@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL4674

@attribute molecule_id {CHEMBL10,CHEMBL101253,CHEMBL103667,CHEMBL105442,CHEMBL1082440,CHEMBL1084546,CHEMBL1088751,CHEMBL1089865,CHEMBL1090356,CHEMBL1090360,CHEMBL116070,CHEMBL1173055,CHEMBL1173655,CHEMBL117697,CHEMBL1190711,CHEMBL119385,CHEMBL1209288,CHEMBL1230020,CHEMBL1230122,CHEMBL1236107,CHEMBL1236126,CHEMBL1240703,CHEMBL1241473,CHEMBL1241674,CHEMBL1242373,CHEMBL124660,CHEMBL127898,CHEMBL1287853,CHEMBL1289926,CHEMBL1336,CHEMBL1375418,CHEMBL1375640,CHEMBL1381197,CHEMBL1419458,CHEMBL1421,CHEMBL1461728,CHEMBL14762,CHEMBL1516890,CHEMBL1614701,CHEMBL1614705,CHEMBL162,CHEMBL1624529,CHEMBL1682341,CHEMBL1682345,CHEMBL1682346,CHEMBL1682357,CHEMBL1682359,CHEMBL1682360,CHEMBL1682540,CHEMBL1682545,CHEMBL1682546,CHEMBL1682552,CHEMBL1682553,CHEMBL1682558,CHEMBL1721885,CHEMBL1727312,CHEMBL17370,CHEMBL178737,CHEMBL1789941,CHEMBL180022,CHEMBL1807446,CHEMBL1825138,CHEMBL1834657,CHEMBL183844,CHEMBL184847,CHEMBL185569,CHEMBL1908391,CHEMBL1908392,CHEMBL1908393,CHEMBL1908394,CHEMBL1908395,CHEMBL1908396,CHEMBL1908397,CHEMBL191003,CHEMBL1916359,CHEMBL1929238,CHEMBL1958401,CHEMBL196363,CHEMBL1964290,CHEMBL1964307,CHEMBL1964399,CHEMBL1964413,CHEMBL1964444,CHEMBL1964644,CHEMBL1964687,CHEMBL1964692,CHEMBL1964777,CHEMBL1964804,CHEMBL1964937,CHEMBL1965131,CHEMBL1965423,CHEMBL1965495,CHEMBL1965507,CHEMBL1965570,CHEMBL1965589,CHEMBL1965631,CHEMBL1965660,CHEMBL1965836,CHEMBL1965845,CHEMBL1965910,CHEMBL1965988,CHEMBL1966035,CHEMBL1966069,CHEMBL1966087,CHEMBL1966279,CHEMBL1966343,CHEMBL1966425,CHEMBL1966514,CHEMBL1966524,CHEMBL1966628,CHEMBL1966703,CHEMBL1966722,CHEMBL1966808,CHEMBL1966816,CHEMBL1967094,CHEMBL1967116,CHEMBL1967302,CHEMBL1967531,CHEMBL1967544,CHEMBL1967560,CHEMBL1967564,CHEMBL1967720,CHEMBL1967878,CHEMBL1967887,CHEMBL1968070,CHEMBL1968127,CHEMBL1968151,CHEMBL1968245,CHEMBL1968380,CHEMBL1968406,CHEMBL1968590,CHEMBL1968705,CHEMBL1968791,CHEMBL1968850,CHEMBL1968926,CHEMBL1969042,CHEMBL1969049,CHEMBL1969102,CHEMBL1969126,CHEMBL1969190,CHEMBL1969264,CHEMBL1969301,CHEMBL1969372,CHEMBL1969502,CHEMBL1969506,CHEMBL1969523,CHEMBL1969537,CHEMBL1969561,CHEMBL1969588,CHEMBL1969664,CHEMBL1969735,CHEMBL1969755,CHEMBL1969843,CHEMBL1969879,CHEMBL1970074,CHEMBL1970083,CHEMBL1970104,CHEMBL1970142,CHEMBL1970189,CHEMBL1970203,CHEMBL1970217,CHEMBL1970314,CHEMBL1970317,CHEMBL1970340,CHEMBL1970369,CHEMBL1970522,CHEMBL1970709,CHEMBL1970735,CHEMBL1970806,CHEMBL1970879,CHEMBL1970903,CHEMBL1970913,CHEMBL1971017,CHEMBL1971021,CHEMBL1971029,CHEMBL1971141,CHEMBL1971149,CHEMBL1971186,CHEMBL1971245,CHEMBL1971430,CHEMBL1971649,CHEMBL1971694,CHEMBL1971801,CHEMBL1971943,CHEMBL1971947,CHEMBL1972119,CHEMBL1972125,CHEMBL1972142,CHEMBL1972158,CHEMBL1972183,CHEMBL1972221,CHEMBL1972250,CHEMBL1972258,CHEMBL1972276,CHEMBL1972362,CHEMBL1972489,CHEMBL1972568,CHEMBL1972576,CHEMBL1972584,CHEMBL1972659,CHEMBL1972820,CHEMBL1972840,CHEMBL1972849,CHEMBL1972937,CHEMBL1973098,CHEMBL1973142,CHEMBL1973145,CHEMBL1973211,CHEMBL1973348,CHEMBL1973395,CHEMBL1973483,CHEMBL1973540,CHEMBL1973711,CHEMBL1973808,CHEMBL1973860,CHEMBL1973893,CHEMBL1973937,CHEMBL1974157,CHEMBL1974254,CHEMBL1974288,CHEMBL1974310,CHEMBL1974328,CHEMBL1974416,CHEMBL1974457,CHEMBL1974664,CHEMBL1974702,CHEMBL1974803,CHEMBL1974870,CHEMBL1974935,CHEMBL1975121,CHEMBL1975128,CHEMBL1975138,CHEMBL1975208,CHEMBL1975233,CHEMBL1975256,CHEMBL1975357,CHEMBL1975418,CHEMBL1975490,CHEMBL1975500,CHEMBL1975534,CHEMBL1975647,CHEMBL1975787,CHEMBL1975900,CHEMBL1976090,CHEMBL1976093,CHEMBL1976134,CHEMBL1976220,CHEMBL1976240,CHEMBL1976328,CHEMBL1976420,CHEMBL1976455,CHEMBL1976732,CHEMBL1977041,CHEMBL1977135,CHEMBL1977148,CHEMBL1977223,CHEMBL1977346,CHEMBL1977374,CHEMBL1977604,CHEMBL1977681,CHEMBL1977814,CHEMBL1978014,CHEMBL1978099,CHEMBL1978200,CHEMBL1978448,CHEMBL1978656,CHEMBL1979057,CHEMBL1979093,CHEMBL1979176,CHEMBL1979252,CHEMBL1979318,CHEMBL1979357,CHEMBL1979516,CHEMBL1979554,CHEMBL1979577,CHEMBL1979718,CHEMBL1979855,CHEMBL1979883,CHEMBL1979970,CHEMBL1980091,CHEMBL1980142,CHEMBL1980144,CHEMBL1980163,CHEMBL1980297,CHEMBL1980391,CHEMBL1980489,CHEMBL1980540,CHEMBL1980704,CHEMBL1980715,CHEMBL1980802,CHEMBL1980896,CHEMBL1980995,CHEMBL1981045,CHEMBL1981047,CHEMBL1981079,CHEMBL1981410,CHEMBL1981720,CHEMBL1981725,CHEMBL1981782,CHEMBL1982122,CHEMBL1982135,CHEMBL1982167,CHEMBL1982361,CHEMBL1982383,CHEMBL1982465,CHEMBL1982466,CHEMBL1982476,CHEMBL1982506,CHEMBL1982563,CHEMBL1982610,CHEMBL1982660,CHEMBL1982711,CHEMBL1982866,CHEMBL1982874,CHEMBL1982880,CHEMBL1982924,CHEMBL1982957,CHEMBL1982980,CHEMBL1982992,CHEMBL1983006,CHEMBL1983025,CHEMBL1983111,CHEMBL1983195,CHEMBL1983309,CHEMBL1983449,CHEMBL1983534,CHEMBL1983923,CHEMBL1983932,CHEMBL1983945,CHEMBL1983963,CHEMBL1984038,CHEMBL1984039,CHEMBL1984044,CHEMBL1984162,CHEMBL1984191,CHEMBL1984206,CHEMBL1984274,CHEMBL1984363,CHEMBL1984367,CHEMBL1984432,CHEMBL1984541,CHEMBL1984586,CHEMBL1984633,CHEMBL1984700,CHEMBL1984711,CHEMBL1984788,CHEMBL1984842,CHEMBL1985074,CHEMBL1985092,CHEMBL1985095,CHEMBL1985311,CHEMBL1985406,CHEMBL1985566,CHEMBL1985580,CHEMBL1986139,CHEMBL1986186,CHEMBL1986263,CHEMBL1986328,CHEMBL1986499,CHEMBL1986530,CHEMBL1986597,CHEMBL1986603,CHEMBL1986781,CHEMBL1986869,CHEMBL1986943,CHEMBL1986970,CHEMBL1987007,CHEMBL1987009,CHEMBL1987034,CHEMBL1987054,CHEMBL1987359,CHEMBL1987533,CHEMBL1987648,CHEMBL1987679,CHEMBL1987756,CHEMBL1987793,CHEMBL1987910,CHEMBL1987982,CHEMBL1988075,CHEMBL1988153,CHEMBL1988163,CHEMBL1988173,CHEMBL1988300,CHEMBL1988370,CHEMBL1988387,CHEMBL1988437,CHEMBL1988537,CHEMBL1988594,CHEMBL1988608,CHEMBL1988717,CHEMBL1988838,CHEMBL1988995,CHEMBL1989029,CHEMBL1989265,CHEMBL1989474,CHEMBL1989518,CHEMBL1989646,CHEMBL1989708,CHEMBL1989805,CHEMBL1989856,CHEMBL1990212,CHEMBL1990254,CHEMBL1990288,CHEMBL1990346,CHEMBL1990415,CHEMBL1990482,CHEMBL1990496,CHEMBL1990583,CHEMBL1990821,CHEMBL1990884,CHEMBL1990885,CHEMBL1990904,CHEMBL1990912,CHEMBL1991063,CHEMBL1991078,CHEMBL1991138,CHEMBL1991143,CHEMBL1991180,CHEMBL1991188,CHEMBL1991285,CHEMBL1991356,CHEMBL1991395,CHEMBL1991429,CHEMBL1991434,CHEMBL1991577,CHEMBL1991640,CHEMBL1991674,CHEMBL1991678,CHEMBL1991725,CHEMBL1991728,CHEMBL1991800,CHEMBL1991846,CHEMBL1992242,CHEMBL1992306,CHEMBL1992323,CHEMBL1992342,CHEMBL1992536,CHEMBL1992555,CHEMBL1992634,CHEMBL1992645,CHEMBL1992732,CHEMBL1992740,CHEMBL1992796,CHEMBL1992922,CHEMBL1992937,CHEMBL1993166,CHEMBL1993243,CHEMBL1993424,CHEMBL1993548,CHEMBL1993584,CHEMBL1993661,CHEMBL1993722,CHEMBL1993781,CHEMBL1993941,CHEMBL1994040,CHEMBL1994074,CHEMBL1994241,CHEMBL1994321,CHEMBL1994361,CHEMBL1994526,CHEMBL1994538,CHEMBL1994693,CHEMBL1994830,CHEMBL1994864,CHEMBL1994938,CHEMBL1995172,CHEMBL1995448,CHEMBL1995592,CHEMBL1995736,CHEMBL1995740,CHEMBL1995813,CHEMBL1995832,CHEMBL1995927,CHEMBL1996066,CHEMBL1996111,CHEMBL1996155,CHEMBL1996208,CHEMBL1996234,CHEMBL1996390,CHEMBL1996500,CHEMBL1996543,CHEMBL1996587,CHEMBL1996780,CHEMBL1996791,CHEMBL1996817,CHEMBL1996831,CHEMBL1996923,CHEMBL1996931,CHEMBL1996979,CHEMBL1997023,CHEMBL1997025,CHEMBL1997129,CHEMBL1997340,CHEMBL1997349,CHEMBL1997503,CHEMBL1997534,CHEMBL1997597,CHEMBL1997617,CHEMBL1997623,CHEMBL1997759,CHEMBL1997764,CHEMBL1997822,CHEMBL1997846,CHEMBL1997872,CHEMBL1998112,CHEMBL1998121,CHEMBL1998159,CHEMBL1998193,CHEMBL1998414,CHEMBL1998435,CHEMBL1998545,CHEMBL1998551,CHEMBL1998585,CHEMBL1998611,CHEMBL1998829,CHEMBL1999112,CHEMBL1999126,CHEMBL1999321,CHEMBL1999428,CHEMBL1999496,CHEMBL1999556,CHEMBL1999590,CHEMBL1999714,CHEMBL1999718,CHEMBL1999749,CHEMBL1999774,CHEMBL1999811,CHEMBL1999918,CHEMBL1999931,CHEMBL2000071,CHEMBL2000104,CHEMBL2000114,CHEMBL2000271,CHEMBL2000335,CHEMBL2000345,CHEMBL2000354,CHEMBL2000393,CHEMBL2000408,CHEMBL2000429,CHEMBL2000481,CHEMBL2000508,CHEMBL2000568,CHEMBL2000685,CHEMBL2000801,CHEMBL2000832,CHEMBL2000894,CHEMBL2001224,CHEMBL2001239,CHEMBL2001257,CHEMBL2001288,CHEMBL2001485,CHEMBL2001547,CHEMBL2001668,CHEMBL2001751,CHEMBL2001920,CHEMBL2001923,CHEMBL2001957,CHEMBL2001998,CHEMBL2002165,CHEMBL2002240,CHEMBL2002322,CHEMBL2002323,CHEMBL2002373,CHEMBL2002407,CHEMBL2002446,CHEMBL2002479,CHEMBL2002649,CHEMBL2002682,CHEMBL2002702,CHEMBL2002726,CHEMBL2002992,CHEMBL2003271,CHEMBL2003286,CHEMBL2003341,CHEMBL2003420,CHEMBL2003456,CHEMBL2003482,CHEMBL2003524,CHEMBL2003638,CHEMBL2003657,CHEMBL2003768,CHEMBL2003817,CHEMBL2004072,CHEMBL2004290,CHEMBL2004311,CHEMBL2004355,CHEMBL2004365,CHEMBL2004419,CHEMBL2004438,CHEMBL2004447,CHEMBL2004544,CHEMBL2004615,CHEMBL2004692,CHEMBL2004716,CHEMBL2004771,CHEMBL2004871,CHEMBL2004872,CHEMBL2004892,CHEMBL2004934,CHEMBL2005112,CHEMBL2005186,CHEMBL2005375,CHEMBL2005475,CHEMBL2005528,CHEMBL2005548,CHEMBL2005631,CHEMBL2005792,CHEMBL2005828,CHEMBL2005886,CHEMBL2005899,CHEMBL2005936,CHEMBL2006010,CHEMBL2006156,CHEMBL2006188,CHEMBL2006237,CHEMBL2006263,CHEMBL2006276,CHEMBL2006439,CHEMBL2006481,CHEMBL2006493,CHEMBL2006567,CHEMBL2006580,CHEMBL2006581,CHEMBL2006715,CHEMBL2006778,CHEMBL2006785,CHEMBL2006836,CHEMBL2006933,CHEMBL2007002,CHEMBL2007044,CHEMBL2007064,CHEMBL2007151,CHEMBL2007296,CHEMBL2007372,CHEMBL2007592,CHEMBL207253,CHEMBL207400,CHEMBL207995,CHEMBL208637,CHEMBL209534,CHEMBL210032,CHEMBL210618,CHEMBL210887,CHEMBL210928,CHEMBL210963,CHEMBL211378,CHEMBL212382,CHEMBL212968,CHEMBL213423,CHEMBL213451,CHEMBL213505,CHEMBL214198,CHEMBL215152,CHEMBL2152382,CHEMBL215652,CHEMBL215803,CHEMBL2178352,CHEMBL219722,CHEMBL220057,CHEMBL220241,CHEMBL221959,CHEMBL223257,CHEMBL223360,CHEMBL223367,CHEMBL223460,CHEMBL225519,CHEMBL226403,CHEMBL226471,CHEMBL230011,CHEMBL2309006,CHEMBL2309609,CHEMBL231209,CHEMBL234085,CHEMBL243088,CHEMBL244378,CHEMBL246970,CHEMBL24828,CHEMBL248757,CHEMBL249282,CHEMBL249697,CHEMBL253969,CHEMBL255863,CHEMBL256835,CHEMBL258202,CHEMBL259084,CHEMBL259850,CHEMBL259922,CHEMBL260092,CHEMBL260135,CHEMBL261849,CHEMBL262433,CHEMBL271381,CHEMBL272453,CHEMBL274064,CHEMBL278041,CHEMBL288441,CHEMBL296468,CHEMBL296586,CHEMBL300138,CHEMBL302449,CHEMBL306380,CHEMBL316264,CHEMBL31965,CHEMBL326282,CHEMBL336961,CHEMBL340384,CHEMBL340921,CHEMBL362558,CHEMBL363648,CHEMBL365847,CHEMBL371206,CHEMBL373598,CHEMBL375284,CHEMBL377300,CHEMBL377383,CHEMBL377408,CHEMBL378627,CHEMBL379218,CHEMBL379835,CHEMBL379929,CHEMBL383172,CHEMBL38380,CHEMBL384304,CHEMBL386051,CHEMBL387971,CHEMBL392642,CHEMBL394619,CHEMBL394790,CHEMBL396523,CHEMBL398951,CHEMBL402846,CHEMBL404367,CHEMBL411903,CHEMBL412142,CHEMBL412281,CHEMBL413779,CHEMBL41783,CHEMBL422897,CHEMBL424872,CHEMBL428690,CHEMBL437747,CHEMBL440084,CHEMBL443962,CHEMBL445813,CHEMBL450786,CHEMBL451964,CHEMBL458997,CHEMBL462120,CHEMBL464552,CHEMBL468280,CHEMBL474432,CHEMBL475251,CHEMBL477772,CHEMBL481491,CHEMBL482767,CHEMBL482967,CHEMBL483158,CHEMBL483321,CHEMBL484390,CHEMBL485556,CHEMBL491473,CHEMBL491758,CHEMBL494089,CHEMBL497151,CHEMBL504950,CHEMBL507249,CHEMBL507936,CHEMBL508928,CHEMBL50894,CHEMBL509032,CHEMBL513846,CHEMBL513909,CHEMBL514499,CHEMBL514582,CHEMBL519697,CHEMBL521851,CHEMBL522892,CHEMBL523823,CHEMBL52387,CHEMBL525191,CHEMBL526133,CHEMBL535,CHEMBL535331,CHEMBL539474,CHEMBL553,CHEMBL554,CHEMBL558752,CHEMBL560813,CHEMBL561932,CHEMBL565612,CHEMBL572878,CHEMBL572881,CHEMBL573339,CHEMBL574738,CHEMBL576982,CHEMBL583144,CHEMBL590109,CHEMBL592030,CHEMBL597592,CHEMBL598626,CHEMBL601719,CHEMBL602123,CHEMBL607707,CHEMBL608154,CHEMBL7064,CHEMBL91829,CHEMBL939,CHEMBL941,CHEMBL95692,CHEMBL97162}
@attribute Chi0_EA.dm. numeric
@attribute Chi1_EA.dm. numeric
@attribute MATS1v numeric
@attribute MATS1i numeric
@attribute ATSC5e numeric
@attribute Eig04_EA.dm. numeric
@attribute Eig02_EA.bo. numeric
@attribute SM12_AEA.ri. numeric
@attribute SssO numeric
@attribute NssO numeric
@attribute AAC numeric
@attribute AECC numeric
@attribute ALOGP numeric
@attribute ALOGP2 numeric
@attribute AMR numeric
@attribute AMW numeric
@attribute ARR numeric
@attribute ATS1e numeric
@attribute ATS1i numeric
@attribute ATS1m numeric
@attribute ATS1p numeric
@attribute ATS1s numeric
@attribute ATS1v numeric
@attribute ATS2e numeric
@attribute ATS2i numeric
@attribute ATS2m numeric
@attribute ATS2p numeric
@attribute ATS2s numeric
@attribute ATS2v numeric
@attribute ATS3e numeric
@attribute ATS3i numeric
@attribute ATS3m numeric
@attribute ATS3p numeric
@attribute ATS3s numeric
@attribute ATS3v numeric
@attribute ATS4e numeric
@attribute ATS4i numeric
@attribute ATS4m numeric
@attribute ATS4p numeric
@attribute ATS4s numeric
@attribute ATS4v numeric
@attribute ATS5e numeric
@attribute ATS5i numeric
@attribute ATS5m numeric
@attribute ATS5p numeric
@attribute ATS5s numeric
@attribute ATS5v numeric
@attribute ATS6e numeric
@attribute ATS6i numeric
@attribute ATS6m numeric
@attribute ATS6p numeric
@attribute ATS6s numeric
@attribute ATS6v numeric
@attribute ATS7e numeric
@attribute ATS7i numeric
@attribute ATS7m numeric
@attribute ATS7p numeric
@attribute ATS7s numeric
@attribute ATS7v numeric
@attribute ATS8e numeric
@attribute ATS8i numeric
@attribute ATS8m numeric
@attribute ATS8p numeric
@attribute ATS8s numeric
@attribute ATS8v numeric
@attribute ATSC1e numeric
@attribute ATSC1i numeric
@attribute ATSC1m numeric
@attribute ATSC1p numeric
@attribute pXC50 numeric

@data
{1 4.368,2 2.498,3 0.039,4 -0.04,5 0.302,7 3.802,8 3.802,11 1.682,12 10.037,13 3.884,14 15.085,15 105.742,16 8.778,17 0.767,18 3.876,19 3.969,20 3.685,21 3.557,22 5.067,23 3.514,24 4.342,25 4.468,26 3.966,27 3.915,28 5.557,29 3.863,30 4.56,31 4.722,32 3.994,33 3.994,34 5.781,35 3.931,36 4.58,37 4.762,38 3.908,39 3.95,40 5.751,41 3.886,42 4.601,43 4.819,44 3.857,45 3.946,46 5.646,47 3.871,48 4.499,49 4.692,50 3.898,51 3.935,52 5.602,53 3.856,54 4.493,55 4.659,56 3.897,57 3.953,58 5.719,59 3.858,60 4.594,61 4.821,62 3.718,63 3.862,64 5.71,65 3.742,66 0.057,67 0.666,68 7.483,69 3.94,70 5.77}
{0 CHEMBL101253,1 18.364,2 28.435,3 0.028,4 0.037,5 0.206,7 3.625,8 3.625,11 1.496,12 10.4,13 4.705,14 22.138,15 100.976,16 8.671,17 0.821,18 3.803,19 3.913,20 3.514,21 3.464,22 4.975,23 3.437,24 4.262,25 4.398,26 3.86,27 3.837,28 5.382,29 3.788,30 4.511,31 4.697,32 3.901,33 3.938,34 5.564,35 3.861,36 4.515,37 4.732,38 3.756,39 3.84,40 5.52,41 3.754,42 4.451,43 4.676,44 3.759,45 3.782,46 5.493,47 3.723,48 4.382,49 4.579,50 3.717,51 3.806,52 5.456,53 3.734,54 4.37,55 4.573,56 3.668,57 3.781,58 5.403,59 3.675,60 4.285,61 4.512,62 3.486,63 3.609,64 5.255,65 3.465,66 0.036,67 0.569,68 5.871,69 3.065,70 5.1}
{0 CHEMBL103667,1 36.989,2 47.755,3 -0.005,4 -0.126,5 0.653,6 0.8,7 4.211,8 4.211,9 11.589,10 2,11 1.476,12 15.333,13 5.907,14 34.897,15 153.448,16 6.944,17 0.512,18 4.416,19 4.543,20 3.928,21 3.926,22 5.446,23 3.899,24 4.975,25 5.161,26 4.296,27 4.324,28 5.966,29 4.279,30 5.224,31 5.428,32 4.344,33 4.489,34 6.191,35 4.408,36 5.354,37 5.615,38 4.314,39 4.494,40 6.25,41 4.385,42 5.289,43 5.537,44 4.298,45 4.402,46 6.266,47 4.322,48 5.161,49 5.377,50 4.272,51 4.38,52 6.186,53 4.313,54 5.213,55 5.426,56 4.329,57 4.471,58 6.285,59 4.385,60 5.328,61 5.566,62 4.237,63 4.518,64 6.285,65 4.402,66 0.071,67 1.114,68 17.099,69 7.024,70 7.721}
{0 CHEMBL105442,1 16.843,2 19.271,3 0.043,4 0.042,5 0.793,7 3.862,8 3.862,9 5.118,10 1,11 1.983,12 9.88,13 4.908,14 24.087,15 99.228,16 12.274,17 0.444,18 3.792,19 3.884,20 3.775,21 3.435,22 5.022,23 3.394,24 4.273,25 4.4,26 4.197,27 3.786,28 5.534,29 3.708,30 4.519,31 4.69,32 4.354,33 3.863,34 6.008,35 3.773,36 4.473,37 4.655,38 4.497,39 3.765,40 5.852,41 3.678,42 4.37,43 4.525,44 4.097,45 3.624,46 5.907,47 3.633,48 4.392,49 4.524,50 4.225,51 3.733,52 6.046,53 3.707,54 4.409,55 4.554,56 4.266,57 3.714,58 5.974,59 3.646,60 4.31,61 4.504,62 4.362,63 3.646,64 5.56,65 3.482,66 0.19,67 0.668,68 0.871,69 3.405,70 5}
{0 CHEMBL1082440,1 17.457,2 25.392,3 0.013,4 -0.216,5 0.562,7 4.265,8 4.265,11 1.636,12 7.182,13 1.577,14 2.486,15 87.781,16 7.43,17 0.458,18 3.852,19 3.966,20 3.602,21 3.427,22 4.807,23 3.36,24 4.444,25 4.629,26 3.909,27 3.84,28 5.605,29 3.754,30 4.74,31 4.939,32 4.135,33 4.105,34 5.724,35 3.985,36 4.931,37 5.139,38 4.141,39 4.152,40 6.034,41 4.013,42 4.902,43 5.105,44 3.92,45 4.008,46 6.155,47 3.895,48 4.751,49 5.001,50 3.491,51 3.806,52 5.851,53 3.678,54 4.467,55 4.708,56 3.283,57 3.746,58 5.21,59 3.568,60 4.555,61 4.858,62 2.916,63 3.575,64 5.252,65 3.325,66 0.072,67 0.669,68 12.495,69 4.37,70 5.2}
{0 CHEMBL1084546,1 36.58,2 61.621,3 0.003,4 -0.2,5 1.09,6 0.4,7 4.065,8 4.065,11 2.002,12 12.6,13 3.111,14 9.678,15 125.221,16 9.228,17 0.474,18 4.149,19 4.255,20 3.99,21 3.651,22 5.359,23 3.667,24 4.704,25 4.855,26 4.362,27 4.024,28 6.412,29 4.039,30 4.88,31 5.041,32 4.333,33 4.128,34 6.214,35 4.132,36 4.996,37 5.202,38 4.37,39 4.122,40 6.476,41 4.104,42 4.942,43 5.154,44 4.237,45 4.101,46 6.192,47 4.067,48 4.961,49 5.186,50 4.17,51 4.037,52 6.312,53 4.009,54 4.841,55 5.061,56 4.216,57 3.971,58 6.151,59 3.981,60 4.804,61 4.988,62 4.381,63 3.967,64 6.417,65 4.004,66 0.3,67 1.116,68 9.7,69 4.813,70 5.6}
{0 CHEMBL1088751,1 24.245,2 26.652,3 -0.003,4 -0.087,5 0.746,6 0.521,7 3.883,8 3.883,9 5.619,10 1,11 1.787,12 12.067,13 3.615,14 13.07,15 116.355,16 9.741,17 0.375,18 3.993,19 4.09,20 3.775,21 3.567,22 5.235,23 3.56,24 4.501,25 4.648,26 4.205,27 3.931,28 5.771,29 3.919,30 4.723,31 4.858,32 4.529,33 4.077,34 6.086,35 4.078,36 4.847,37 5.012,38 4.38,39 4.11,40 6.29,41 4.064,42 4.823,43 5,44 4.366,45 4.146,46 6.007,47 4.058,48 4.812,49 4.982,50 4.439,51 4.145,52 6.079,53 4.04,54 4.806,55 5.014,56 4.452,57 4.009,58 6.136,59 3.917,60 4.594,61 4.766,62 4.168,63 3.767,64 6.036,65 3.71,66 0.139,67 0.79,68 5.568,69 4.515,70 5.2}
{0 CHEMBL1089865,1 22.274,2 25.08,3 0.017,4 -0.05,5 0.718,7 4.107,8 4.107,11 1.691,12 11.5,13 3.883,14 15.078,15 116.624,16 8.355,17 0.472,18 4.081,19 4.19,20 3.743,21 3.648,22 5.282,23 3.652,24 4.591,25 4.75,26 4.12,27 4.015,28 5.806,29 4.011,30 4.812,31 4.982,32 4.279,33 4.14,34 6.118,35 4.145,36 4.923,37 5.094,38 4.33,39 4.18,40 6.386,41 4.189,42 4.918,43 5.09,44 4.267,45 4.203,46 6.253,47 4.187,48 4.925,49 5.111,50 4.184,51 4.183,52 6.197,53 4.147,54 4.955,55 5.168,56 4.027,57 4.07,58 6.407,59 4.005,60 4.741,61 5.002,62 3.731,63 3.859,64 5.761,65 3.769,66 0.121,67 0.922,68 8.248,69 4.644,70 5.456}
{0 CHEMBL1090356,1 30.357,2 47.09,3 0.01,4 -0.179,5 0.449,6 0.4,7 3.759,8 3.759,9 5.472,10 1,11 1.601,12 17.093,13 6.24,14 38.943,15 169.241,16 8.163,17 0.673,18 4.398,19 4.509,20 4.085,21 3.997,22 5.506,23 3.973,24 4.916,25 5.065,26 4.454,27 4.381,28 6.004,29 4.342,30 5.142,31 5.34,32 4.431,33 4.491,34 6.154,35 4.42,36 5.153,37 5.367,38 4.421,39 4.484,40 6.17,41 4.405,42 5.193,43 5.404,44 4.516,45 4.521,46 6.267,47 4.446,48 5.178,49 5.387,50 4.48,51 4.509,52 6.228,53 4.421,54 5.087,55 5.289,56 4.409,57 4.428,58 6.127,59 4.34,60 5.045,61 5.26,62 4.321,63 4.38,64 6.056,65 4.295,66 0.031,67 1.102,68 13,69 6.182,70 5.2}
{0 CHEMBL1090360,1 30.357,2 49.59,3 0.01,4 -0.179,5 0.446,6 0.4,7 3.778,8 3.778,9 5.505,10 1,11 1.601,12 16.395,13 6.24,14 38.943,15 169.241,16 8.163,17 0.673,18 4.398,19 4.509,20 4.085,21 3.997,22 5.506,23 3.973,24 4.916,25 5.065,26 4.454,27 4.381,28 6.004,29 4.342,30 5.142,31 5.34,32 4.431,33 4.491,34 6.152,35 4.42,36 5.153,37 5.367,38 4.435,39 4.485,40 6.171,41 4.408,42 5.198,43 5.405,44 4.539,45 4.53,46 6.274,47 4.462,48 5.205,49 5.409,50 4.524,51 4.543,52 6.263,53 4.459,54 5.157,55 5.365,56 4.456,57 4.48,58 6.189,59 4.391,60 5.111,61 5.332,62 4.352,63 4.421,64 6.116,65 4.338,66 0.031,67 1.102,68 13,69 6.182,70 5.2}
{0 CHEMBL116070,1 10.938,2 11.167,3 0.074,4 0.104,5 0.202,7 3.626,8 3.626,9 5.811,10 1,11 1.898,12 8.55,13 3.143,14 9.881,15 81.507,16 12.042,17 0.727,18 3.513,19 3.582,20 3.534,21 3.235,22 4.777,23 3.191,24 3.943,25 4.021,26 3.991,27 3.623,28 5.265,29 3.552,30 4.129,31 4.222,32 4.023,33 3.636,34 5.398,35 3.553,36 4.028,37 4.15,38 3.71,39 3.452,40 5.234,41 3.38,42 3.876,43 4.03,44 3.586,45 3.316,46 5.069,47 3.262,48 3.903,49 4.043,50 3.611,51 3.352,52 5.342,53 3.277,54 3.868,55 4.06,56 3.523,57 3.296,58 4.921,59 3.124,60 3.513,61 3.686,62 3.575,63 3.012,64 4.712,65 2.831,66 0.082,67 0.371,68 0.346,69 2.166,70 5.3}
{0 CHEMBL1173055,1 15.923,2 15.194,3 0.073,4 0.01,5 0.505,7 3.79,8 3.79,11 1.57,12 9.417,13 2.959,14 8.757,15 92.409,16 7.7,17 0.593,18 3.853,19 3.976,20 3.449,21 3.432,22 4.97,23 3.416,24 4.386,25 4.553,26 3.831,27 3.854,28 5.502,29 3.818,30 4.663,31 4.852,32 3.971,33 4.041,34 5.741,35 3.986,36 4.749,37 4.956,38 3.951,39 4.024,40 5.852,41 3.959,42 4.682,43 4.893,44 3.818,45 3.919,46 5.94,47 3.835,48 4.578,49 4.83,50 3.504,51 3.765,52 5.547,53 3.638,54 4.397,55 4.657,56 3.345,57 3.525,58 5.48,59 3.421,60 4.146,61 4.389,62 3.124,63 3.237,64 5.284,65 3.155,66 0.043,67 0.691,68 8.04,69 3.738,70 5.2}
{0 CHEMBL1173655,1 32.664,2 46.591,3 -0.021,4 -0.212,5 0.694,6 0.86,7 3.872,8 3.872,9 11.549,10 2,11 1.772,12 12.294,13 3.917,14 15.346,15 129.707,16 8.237,17 0.459,18 4.189,19 4.302,20 3.832,21 3.687,22 5.339,23 3.692,24 4.726,25 4.893,26 4.197,27 4.056,28 5.876,29 4.048,30 4.942,31 5.121,32 4.274,33 4.171,34 6.139,35 4.13,36 4.967,37 5.208,38 4.165,39 4.132,40 6.015,41 4.071,42 4.859,43 5.044,44 4.213,45 4.152,46 6.044,47 4.113,48 4.952,49 5.142,50 4.295,51 4.21,52 6.103,53 4.177,54 5.02,55 5.215,56 4.308,57 4.226,58 6.246,59 4.183,60 4.972,61 5.17,62 4.257,63 4.155,64 6.172,65 4.11,66 0.126,67 0.934,68 10.471,69 5.109,70 5}
{0 CHEMBL117697,1 13.8,2 23.856,3 -0.004,4 -0.169,5 0.171,7 3.671,8 3.671,9 5.207,10 1,11 1.517,12 7.895,13 3.461,14 11.979,15 74.095,16 7.853,17 0.81,18 3.584,19 3.694,20 3.21,21 3.156,22 4.756,23 3.15,24 4.04,25 4.191,26 3.51,27 3.488,28 5.171,29 3.467,30 4.194,31 4.373,32 3.534,33 3.565,34 5.255,35 3.523,36 4.203,37 4.414,38 3.391,39 3.478,40 5.244,41 3.406,42 4.16,43 4.401,44 3.227,45 3.403,46 5.119,47 3.316,48 4.002,49 4.223,50 3.13,51 3.317,52 4.998,53 3.222,54 3.936,55 4.172,56 3.023,57 3.191,58 4.894,59 3.096,60 3.749,61 3.969,62 2.745,63 2.936,64 4.764,65 2.837,66 0.013,67 0.468,68 5.75,69 2.649,70 5.2}
{0 CHEMBL1190711,1 19.544,2 28.736,3 -0.008,4 -0.247,5 0.615,6 0.4,7 3.963,8 3.963,9 10.685,10 2,11 1.687,12 10.241,13 2.323,14 5.394,15 105.109,16 8.307,17 0.688,18 3.988,19 4.1,20 3.643,21 3.472,22 5.231,23 3.503,24 4.459,25 4.61,26 3.994,27 3.823,28 5.702,29 3.846,30 4.592,31 4.744,32 4.073,33 3.934,34 5.817,35 3.949,36 4.684,37 4.849,38 4.077,39 3.963,40 5.957,41 3.955,42 4.775,43 4.985,44 3.974,45 3.964,46 5.888,47 3.931,48 4.706,49 4.92,50 4.008,51 3.951,52 5.86,53 3.921,54 4.684,55 4.891,56 3.979,57 3.949,58 5.825,59 3.918,60 4.631,61 4.824,62 3.865,63 3.841,64 5.866,65 3.797,66 0.122,67 0.744,68 7.845,69 3.593,70 5.2}
{0 CHEMBL119385,1 19.118,2 21.577,3 0.007,4 -0.001,5 0.753,7 3.894,8 3.894,11 2.02,12 10.857,13 5.899,14 34.795,15 108.721,16 11.791,17 0.387,18 3.774,19 3.838,20 3.754,21 3.491,22 5.111,23 3.475,24 4.233,25 4.313,26 4.208,27 3.877,28 5.662,29 3.854,30 4.482,31 4.592,32 4.384,33 4.012,34 5.898,35 3.974,36 4.438,37 4.536,38 4.398,39 3.951,40 6.022,41 3.907,42 4.407,43 4.505,44 4.383,45 3.838,46 6.04,47 3.841,48 4.352,49 4.493,50 4.1,51 3.765,52 5.776,53 3.725,54 4.206,55 4.376,56 3.773,57 3.576,58 5.546,59 3.494,60 3.952,61 4.131,62 3.814,63 3.378,64 5.329,65 3.275,66 0.206,67 0.631,68 0.365,69 2.485,70 5.1}
{0 CHEMBL1209288,1 11.843,2 12.602,3 0.038,4 -0.069,5 0.171,7 3.637,8 3.637,11 1.392,12 9.111,13 4.373,14 19.121,15 107.648,16 7.336,17 0.548,18 3.997,19 4.119,20 3.573,21 3.609,22 5.034,23 3.575,24 4.558,25 4.729,26 3.943,27 4.043,28 5.546,29 3.985,30 4.837,31 5.061,32 3.95,33 4.187,34 5.741,35 4.083,36 4.841,37 5.066,38 3.925,39 4.196,40 5.709,41 4.078,42 4.883,43 5.124,44 3.945,45 4.207,46 5.717,47 4.088,48 4.855,49 5.083,50 3.968,51 4.192,52 5.781,53 4.079,54 4.87,55 5.103,56 3.885,57 4.15,58 5.802,59 4.026,60 4.86,61 5.134,62 3.674,63 3.997,64 5.733,65 3.847,66 0.029,67 0.773,68 9.972,69 4.56,70 5}
{0 CHEMBL1230020,1 9.931,2 6.141,3 0.039,4 -0.071,5 1.187,7 4.496,8 4.496,11 2.082,12 10,13 3.768,14 14.197,15 98.861,16 10.094,17 0.552,18 3.85,19 3.929,20 3.793,21 3.455,22 5.092,23 3.441,24 4.377,25 4.493,26 4.109,27 3.831,28 5.867,29 3.816,30 4.639,31 4.795,32 4.219,33 3.907,34 6.08,35 3.898,36 4.633,37 4.775,38 4.268,39 3.839,40 6.398,41 3.861,42 4.566,43 4.696,44 4.176,45 3.776,46 6.311,47 3.796,48 4.493,49 4.637,50 4.131,51 3.713,52 6.047,53 3.736,54 4.464,55 4.621,56 4.02,57 3.632,58 6.303,59 3.635,60 4.354,61 4.54,62 3.938,63 3.524,64 5.865,65 3.479,66 0.225,67 0.758,68 5.948,69 3.96,70 5}
{0 CHEMBL1230122,1 29.266,2 45.306,3 -0.03,4 -0.199,5 0.81,6 0.4,7 3.882,8 3.882,9 10.707,10 2,11 1.817,12 11.893,13 2.065,14 4.265,15 100.648,16 8.444,17 0.387,18 3.972,19 4.075,20 3.634,21 3.442,22 5.174,23 3.477,24 4.524,25 4.679,26 4.021,27 3.817,28 5.755,29 3.846,30 4.782,31 4.965,32 4.116,33 3.925,34 6.075,35 3.942,36 4.768,37 4.987,38 3.978,39 3.838,40 6.099,41 3.833,42 4.613,43 4.811,44 3.912,45 3.774,46 5.865,47 3.773,48 4.584,49 4.779,50 3.906,51 3.762,52 5.991,53 3.76,54 4.536,55 4.727,56 3.806,57 3.765,58 5.728,59 3.735,60 4.601,61 4.82,62 3.711,63 3.674,64 5.963,65 3.624,66 0.189,67 0.829,68 7.429,69 4.048,70 5.2}
{0 CHEMBL1236107,1 6.656,2 4.873,3 -0.014,4 0.012,5 0.239,7 4.334,8 4.334,11 1.623,12 10.731,13 3.403,14 11.578,15 103.098,16 9.217,17 0.867,18 3.829,19 3.94,20 3.642,21 3.455,22 5.026,23 3.437,24 4.294,25 4.44,26 4.046,27 3.831,28 5.445,29 3.809,30 4.428,31 4.597,32 4.039,33 3.91,34 5.552,35 3.836,36 4.391,37 4.585,38 3.875,39 3.811,40 5.447,41 3.719,42 4.291,43 4.491,44 3.827,45 3.7,46 5.335,47 3.618,48 4.228,49 4.422,50 3.757,51 3.628,52 5.318,53 3.567,54 4.165,55 4.358,56 3.696,57 3.532,58 5.303,59 3.485,60 4.023,61 4.213,62 3.466,63 3.445,64 5.121,65 3.387,66 0.097,67 0.691,68 5.169,69 3.012,70 5}
{0 CHEMBL1236126,1 24.987,2 29.433,3 -0.005,4 -0.094,5 0.591,6 0.286,7 4.015,8 4.015,9 5.424,10 1,11 1.671,12 11.656,13 3.609,14 13.026,15 115.911,16 7.866,17 0.471,18 4.128,19 4.235,20 3.718,21 3.601,22 5.357,23 3.608,24 4.648,25 4.805,26 4.103,27 3.989,28 5.954,29 3.982,30 4.908,31 5.085,32 4.175,33 4.11,34 6.145,35 4.093,36 5.07,37 5.295,38 4.11,39 4.059,40 6.308,41 4.04,42 4.772,43 4.94,44 4.115,45 4.012,46 6.062,47 4.01,48 4.886,49 5.065,50 4.119,51 4.083,52 6.318,53 4.045,54 4.928,55 5.145,56 4.008,57 4.061,58 6.069,59 4,60 4.822,61 5.027,62 3.981,63 3.964,64 6.116,65 3.917,66 0.224,67 0.812,68 10.547,69 4.887,70 5.2}
{0 CHEMBL1240703,1 30.107,2 42.947,3 0.035,4 -0.131,5 1.043,6 0.947,7 4.71,8 4.71,9 13.514,10 2,11 1.529,12 10.955,13 4.94,14 24.402,15 162.643,16 7.928,17 0.577,18 4.452,19 4.549,20 4.09,21 4.028,22 5.543,23 4.027,24 5.039,25 5.174,26 4.574,27 4.499,28 6.116,29 4.496,30 5.354,31 5.503,32 4.807,33 4.747,34 6.415,35 4.739,36 5.555,37 5.708,38 4.955,39 4.916,40 6.651,41 4.899,42 5.712,43 5.88,44 5.019,45 5.024,46 6.785,47 4.991,48 5.807,49 5.998,50 5.004,51 5.077,52 6.861,53 5.016,54 5.835,55 6.046,56 4.881,57 5.022,58 6.889,59 4.938,60 5.703,61 5.922,62 4.64,63 4.855,64 6.751,65 4.751,66 0.074,67 1.064,68 13.58,69 6.747,70 5}
{0 CHEMBL1241473,1 34.859,2 58.25,3 -0.007,4 -0.127,5 1.185,6 0.86,7 4.099,8 4.099,9 15.919,10 3,11 1.779,12 11.25,13 3.059,14 9.357,15 115.249,16 8.47,17 0.529,18 4.084,19 4.19,20 3.734,21 3.498,22 5.398,23 3.546,24 4.547,25 4.689,26 4.064,27 3.826,28 5.937,29 3.87,30 4.678,31 4.809,32 4.205,33 3.963,34 5.996,35 4.007,36 4.839,37 4.992,38 4.262,39 4.013,40 6.268,41 4.039,42 4.934,43 5.12,44 4.119,45 4.037,46 6.146,47 4.038,48 4.878,49 5.073,50 4.119,51 4.012,52 6.146,53 3.994,54 4.902,55 5.137,56 4.111,57 3.925,58 6.16,59 3.929,60 4.767,61 4.97,62 4.039,63 3.76,64 6.356,65 3.802,66 0.3,67 0.783,68 8.609,69 3.93,70 5.8}
{0 CHEMBL1241674,1 11.643,2 8.663,3 0.065,4 -0.032,5 0.359,7 4.406,8 4.406,11 1.606,12 8.043,13 2.744,14 7.527,15 89.221,16 7.907,17 0.769,18 3.809,19 3.94,20 3.427,21 3.316,22 4.998,23 3.326,24 4.295,25 4.466,26 3.836,27 3.718,28 5.44,29 3.717,30 4.504,31 4.699,32 3.871,33 3.811,34 5.636,35 3.793,36 4.592,37 4.824,38 3.845,39 3.812,40 5.701,41 3.771,42 4.484,43 4.702,44 3.686,45 3.731,46 5.562,47 3.674,48 4.411,49 4.62,50 3.621,51 3.669,52 5.521,53 3.617,54 4.498,55 4.765,56 3.399,57 3.616,58 5.519,59 3.508,60 4.324,61 4.618,62 3.148,63 3.372,64 5.26,65 3.239,66 0.1,67 0.657,68 7.475,69 2.975,70 5}
{0 CHEMBL1242373,1 23.019,2 29.077,3 0.089,4 0.051,5 0.285,7 3.912,8 3.912,11 1.618,12 11.759,13 3.933,14 15.471,15 117.722,16 8.365,17 0.667,18 3.997,19 4.111,20 3.709,21 3.639,22 5.142,23 3.602,24 4.493,25 4.639,26 4.132,27 4.064,28 5.633,29 3.999,30 4.721,31 4.888,32 4.17,33 4.201,34 5.778,35 4.11,36 4.796,37 4.992,38 4.158,39 4.171,40 5.86,41 4.067,42 4.757,43 4.965,44 3.973,45 4.034,46 5.852,47 3.942,48 4.658,49 4.885,50 3.814,51 3.886,52 5.753,53 3.799,54 4.55,55 4.787,56 3.578,57 3.728,58 5.62,59 3.633,60 4.367,61 4.61,62 3.493,63 3.641,64 5.344,65 3.52,66 0.044,67 0.741,68 8.548,69 4.058,70 5.2}
{0 CHEMBL124660,1 40.814,2 55.107,3 -0.047,4 -0.347,5 0.805,6 0.86,7 3.657,8 3.657,9 17.52,10 3,11 1.513,12 18.659,13 4.674,14 21.849,15 160.828,16 6.781,17 0.378,18 4.504,19 4.634,20 3.996,21 3.959,22 5.494,23 3.939,24 5.097,25 5.3,26 4.334,27 4.349,28 6.041,29 4.305,30 5.358,31 5.586,32 4.406,33 4.521,34 6.247,35 4.445,36 5.406,37 5.651,38 4.362,39 4.536,40 6.305,41 4.436,42 5.403,43 5.647,44 4.34,45 4.538,46 6.32,47 4.425,48 5.395,49 5.648,50 4.265,51 4.494,52 6.233,53 4.371,54 5.334,55 5.596,56 4.214,57 4.386,58 6.216,59 4.276,60 5.196,61 5.433,62 4.174,63 4.308,64 6.094,65 4.223,66 0.024,67 1.222,68 19.498,69 7.398,70 5.1}
{0 CHEMBL127898,1 26.612,2 26.644,3 -0.04,4 -0.152,5 1.346,6 1.704,7 3.948,8 3.948,9 10.261,10 2,11 1.79,12 13,13 4.813,14 23.163,15 134.423,16 8.957,17 0.415,18 4.181,19 4.273,20 3.887,21 3.716,22 5.486,23 3.746,24 4.716,25 4.852,26 4.321,27 4.087,28 6.373,29 4.111,30 4.858,31 4.993,32 4.328,33 4.271,34 6.12,35 4.258,36 5.078,37 5.249,38 4.385,39 4.322,40 6.407,41 4.304,42 5.138,43 5.335,44 4.368,45 4.338,46 6.4,47 4.316,48 5.117,49 5.316,50 4.33,51 4.375,52 6.315,53 4.327,54 5.137,55 5.356,56 4.365,57 4.359,58 6.336,59 4.315,60 5.058,61 5.235,62 4.44,63 4.365,64 6.375,65 4.351,66 0.226,67 1.047,68 7.302,69 5.033,70 5.2}
{0 CHEMBL1287853,1 38.907,2 60.338,4 -0.223,5 0.859,6 0.4,7 3.92,8 3.92,9 5.877,10 1,11 1.604,12 16.351,13 5.318,14 28.281,15 147.876,16 7.188,17 0.45,18 4.371,19 4.497,20 4.019,21 3.889,22 5.369,23 3.842,24 4.938,25 5.128,26 4.328,27 4.271,28 6.08,29 4.207,30 5.195,31 5.411,32 4.346,33 4.419,34 6.197,35 4.302,36 5.303,37 5.572,38 4.288,39 4.382,40 6.295,41 4.254,42 5.17,43 5.392,44 4.201,45 4.294,46 6.317,47 4.214,48 5.038,49 5.252,50 4.156,51 4.306,52 6.029,53 4.205,54 5.106,55 5.353,56 4.197,57 4.337,58 6.073,59 4.205,60 5.076,61 5.315,62 4.098,63 4.27,64 6.039,65 4.136,66 0.096,67 1.121,68 19.611,69 6.83,70 5}
{0 CHEMBL1289926,1 7.851,2 5.913,3 0.052,4 0.09,5 0.169,7 3.946,8 3.946,11 1.585,12 12.286,13 4.493,14 20.186,15 114.788,16 8.402,17 0.71,18 3.933,19 4.041,20 3.653,21 3.596,22 5.11,23 3.55,24 4.385,25 4.525,26 4.009,27 3.968,28 5.533,29 3.895,30 4.58,31 4.752,32 4.064,33 4.071,34 5.68,35 3.961,36 4.574,37 4.747,38 4.008,39 3.986,40 5.713,41 3.882,42 4.522,43 4.712,44 3.866,45 3.941,46 5.584,47 3.83,48 4.549,49 4.75,50 3.804,51 3.926,52 5.609,53 3.818,54 4.533,55 4.753,56 3.746,57 3.841,58 5.597,59 3.752,60 4.411,61 4.634,62 3.583,63 3.705,64 5.489,65 3.601,66 0.044,67 0.663,68 7.861,69 3.899,70 5}
{0 CHEMBL1336,1 27.261,2 35.352,3 0.022,4 -0.089,5 1.117,6 0.86,7 3.823,8 3.823,9 5.658,10 1,11 1.965,12 14.281,13 4.176,14 17.437,15 110.459,16 9.685,17 0.529,18 4.003,19 4.1,20 3.755,21 3.517,22 5.316,23 3.555,24 4.496,25 4.622,26 4.2,27 3.853,28 6.254,29 3.888,30 4.687,31 4.837,32 4.212,33 3.955,34 6.089,35 3.972,36 4.729,37 4.888,38 4.278,39 3.87,40 6.302,41 3.909,42 4.633,43 4.809,44 4.034,45 3.794,46 6.141,47 3.811,48 4.604,49 4.799,50 3.841,51 3.776,52 5.894,53 3.752,54 4.507,55 4.685,56 3.977,57 3.684,58 6.22,59 3.67,60 4.383,61 4.577,62 3.681,63 3.61,64 5.663,65 3.582,66 0.311,67 0.902,68 5.104,69 4.001,70 5.119}
{0 CHEMBL1375418,1 12.138,2 17.319,3 0.012,4 0.045,5 0.237,7 3.617,8 3.617,11 1.411,12 10.75,13 4.302,14 18.507,15 98.445,16 7.693,17 0.815,18 3.828,19 3.956,20 3.445,21 3.417,22 4.958,23 3.397,24 4.304,25 4.471,26 3.778,27 3.779,28 5.374,29 3.741,30 4.504,31 4.712,32 3.769,33 3.843,34 5.533,35 3.773,36 4.535,37 4.789,38 3.611,39 3.728,40 5.482,41 3.645,42 4.399,43 4.66,44 3.545,45 3.614,46 5.356,47 3.546,48 4.229,49 4.433,50 3.469,51 3.587,52 5.251,53 3.518,54 4.276,55 4.522,56 3.322,57 3.542,58 5.209,59 3.444,60 4.15,61 4.392,62 3.216,63 3.45,64 5.046,65 3.336,66 0.073,67 0.649,68 7.695,69 3.368,70 5.2}
{0 CHEMBL1375640,1 13.497,2 14.329,3 0.032,4 -0.076,5 0.243,7 3.774,8 3.774,9 5.709,10 1,11 1.852,12 9.5,13 3.44,14 11.836,15 89.112,16 9.51,17 0.708,18 3.682,19 3.781,20 3.504,21 3.314,22 4.882,23 3.277,24 4.143,25 4.278,26 3.912,27 3.661,28 5.35,29 3.603,30 4.267,31 4.418,32 3.958,33 3.695,34 5.454,35 3.621,36 4.213,37 4.356,38 3.748,39 3.664,40 5.31,41 3.537,42 4.19,43 4.365,44 3.688,45 3.588,46 5.257,47 3.467,48 4.233,49 4.452,50 3.745,51 3.519,52 5.332,53 3.386,54 4.015,55 4.225,56 3.359,57 3.335,58 5.051,59 3.222,60 3.869,61 4.08,62 3.198,63 3.185,64 4.961,65 3.081,66 0.069,67 0.53,68 4.674,69 2.908,70 5.2}
{0 CHEMBL1381197,1 11.313,2 16.489,3 0.012,4 0.054,5 0.252,7 3.617,8 3.617,11 1.564,12 10.75,13 4.48,14 20.072,15 98.209,16 8.837,17 0.815,18 3.771,19 3.887,20 3.497,21 3.387,22 4.941,23 3.373,24 4.235,25 4.379,26 3.858,27 3.753,28 5.376,29 3.721,30 4.452,31 4.651,32 3.851,33 3.807,34 5.536,35 3.741,36 4.419,37 4.651,38 3.657,39 3.66,40 5.438,41 3.595,42 4.297,43 4.537,44 3.592,45 3.565,46 5.318,47 3.513,48 4.199,49 4.396,50 3.54,51 3.564,52 5.276,53 3.498,54 4.157,55 4.368,56 3.385,57 3.505,58 5.165,59 3.415,60 4.07,61 4.293,62 3.363,63 3.411,64 5.062,65 3.306,66 0.072,67 0.598,68 5.458,69 2.871,70 5.2}
{0 CHEMBL1419458,1 12.198,2 8.953,3 0.037,4 0.15,5 0.556,7 3.774,8 3.774,11 1.745,12 10.607,13 1.666,14 2.776,15 104.153,16 9.156,17 0.71,18 3.886,19 4.007,20 3.62,21 3.366,22 5.241,23 3.412,24 4.287,25 4.427,26 3.93,27 3.702,28 5.592,29 3.738,30 4.444,31 4.62,32 3.945,33 3.739,34 5.773,35 3.751,36 4.497,37 4.689,38 3.983,39 3.694,40 5.827,41 3.736,42 4.46,43 4.644,44 3.993,45 3.674,46 5.824,47 3.741,48 4.447,49 4.612,50 3.938,51 3.658,52 5.872,53 3.717,54 4.486,55 4.668,56 3.856,57 3.57,58 5.984,59 3.621,60 4.325,61 4.535,62 3.543,63 3.433,64 5.637,65 3.433,66 0.255,67 0.729,68 5.328,69 2.757,70 5.2}
{0 CHEMBL1421,1 32.957,2 53.106,3 -0.005,4 -0.284,5 0.76,6 0.4,7 3.905,8 3.905,11 1.781,12 14.515,13 3.439,14 11.829,15 130.334,16 8.272,17 0.472,18 4.186,19 4.31,20 3.868,21 3.71,22 5.289,23 3.681,24 4.723,25 4.911,26 4.273,27 4.092,28 5.802,29 4.04,30 4.941,31 5.151,32 4.314,33 4.218,34 5.982,35 4.141,36 5.006,37 5.228,38 4.28,39 4.257,40 6.04,41 4.143,42 5.048,43 5.295,44 4.247,45 4.219,46 6.107,47 4.099,48 4.913,49 5.139,50 4.3,51 4.148,52 5.979,53 4.032,54 4.818,55 5.046,56 4.105,57 4.07,58 5.861,59 3.938,60 4.729,61 4.975,62 3.899,63 3.905,64 5.736,65 3.791,66 0.095,67 0.941,68 11.465,69 5.069,70 5.1}
{0 CHEMBL1461728,1 9.147,2 11.354,3 0.068,4 0.088,5 0.478,7 3.793,8 3.793,11 1.71,12 8.053,13 2.464,14 6.071,15 69.544,16 8.802,17 0.762,18 3.511,19 3.621,20 3.211,21 3.099,22 4.792,23 3.112,24 3.955,25 4.078,26 3.558,27 3.456,28 5.282,29 3.458,30 4.17,31 4.344,32 3.508,33 3.476,34 5.469,35 3.454,36 4.139,37 4.353,38 3.345,39 3.277,40 5.434,41 3.259,42 3.916,43 4.118,44 3.209,45 3.072,46 5.471,47 3.06,48 3.705,49 3.88,50 3.014,51 3.04,52 4.987,53 3.011,54 3.689,55 3.874,56 3.046,57 3.006,58 5.059,59 2.968,60 3.589,61 3.793,62 2.803,63 2.824,64 4.856,65 2.778,66 0.094,67 0.51,68 3.986,69 2.322,70 5.2}
{0 CHEMBL14762,1 24.833,2 38.665,3 -0.016,4 -0.298,5 0.557,7 3.451,8 3.451,11 1.5,12 9.462,13 3.181,14 10.12,15 106.143,16 6.817,17 0.571,18 4.034,19 4.18,20 3.519,21 3.496,22 5.088,23 3.472,24 4.572,25 4.785,26 3.856,27 3.869,28 5.559,29 3.815,30 4.81,31 5.061,32 3.912,33 3.985,34 5.757,35 3.906,36 4.882,37 5.147,38 3.89,39 3.981,40 5.84,41 3.892,42 4.843,43 5.117,44 3.806,45 3.913,46 5.833,47 3.834,48 4.671,49 4.9,50 3.827,51 3.894,52 5.652,53 3.838,54 4.764,55 4.999,56 3.846,57 3.969,58 5.745,59 3.896,60 4.877,61 5.132,62 3.736,63 4.031,64 5.779,65 3.9,66 0.052,67 0.803,68 12.071,69 4.161,70 5}
{0 CHEMBL1516890,1 10.682,2 13.192,3 0.021,4 -0.135,5 0.077,7 4.086,8 4.086,11 1.489,12 7.905,13 2.508,14 6.292,15 81.405,16 8.098,17 0.667,18 3.659,19 3.768,20 3.318,21 3.282,22 4.818,23 3.273,24 4.149,25 4.294,26 3.699,27 3.685,28 5.289,29 3.664,30 4.328,31 4.494,32 3.707,33 3.765,34 5.461,35 3.716,36 4.359,37 4.561,38 3.547,39 3.707,40 5.449,41 3.625,42 4.245,43 4.444,44 3.417,45 3.558,46 5.358,47 3.475,48 4.199,49 4.428,50 3.405,51 3.435,52 5.306,53 3.376,54 4.005,55 4.193,56 3.316,57 3.336,58 5.192,59 3.294,60 4.002,61 4.225,62 2.901,63 3.166,64 5.129,65 3.07,66 0.013,67 0.494,68 5.632,69 2.734,70 5.2}
{0 CHEMBL1614701,1 18.997,2 21.153,3 0.025,4 -0.097,5 0.944,7 3.9,8 3.9,9 4.853,10 1,11 2.039,12 9.815,13 3.234,14 10.461,15 102.384,16 10.898,17 0.552,18 3.88,19 3.977,20 3.747,21 3.406,22 5.143,23 3.419,24 4.367,25 4.502,26 4.17,27 3.789,28 5.626,29 3.787,30 4.575,31 4.72,32 4.313,33 3.908,34 5.974,35 3.885,36 4.605,37 4.779,38 4.414,39 3.873,40 5.96,41 3.844,42 4.549,43 4.713,44 4.164,45 3.765,46 6.036,47 3.785,48 4.562,49 4.689,50 4.272,51 3.821,52 6.169,53 3.842,54 4.586,55 4.746,56 4.239,57 3.795,58 5.983,59 3.784,60 4.555,61 4.749,62 4.302,63 3.728,64 5.806,65 3.674,66 0.255,67 0.679,68 3.015,69 3.461,70 5}
{0 CHEMBL1614705,1 16.683,2 16.542,3 0.02,4 -0.075,5 0.796,7 3.814,8 3.814,11 1.819,12 10.621,13 2.832,14 8.02,15 107.681,16 8.664,17 0.531,18 3.998,19 4.11,20 3.681,21 3.537,22 5.19,23 3.539,24 4.532,25 4.692,26 4.061,27 3.948,28 5.693,29 3.928,30 4.804,31 4.999,32 4.158,33 4.106,34 5.984,35 4.056,36 4.877,37 5.077,38 4.202,39 4.113,40 6.088,41 4.07,42 4.932,43 5.156,44 4.127,45 4.116,46 6.044,47 4.068,48 4.891,49 5.117,50 4.108,51 4.096,52 6.01,53 4.032,54 4.824,55 5.042,56 4.083,57 4.062,58 5.959,59 3.985,60 4.83,61 5.073,62 3.956,63 3.915,64 6.032,65 3.827,66 0.15,67 0.805,68 7.603,69 4.123,70 5.2}
{0 CHEMBL162,1 28.268,2 43.083,3 0.039,4 -0.127,5 0.654,6 0.473,7 4.71,8 4.71,9 13.258,10 2,11 1.512,12 8.057,13 3.82,14 14.59,15 131.874,16 7.649,17 0.571,18 4.263,19 4.37,20 3.882,21 3.832,22 5.286,23 3.826,24 4.873,25 5.021,26 4.374,27 4.318,28 5.859,29 4.309,30 5.178,31 5.337,32 4.61,33 4.573,34 6.149,35 4.556,36 5.369,37 5.531,38 4.757,39 4.756,40 6.333,41 4.727,42 5.532,43 5.717,44 4.778,45 4.847,46 6.495,47 4.794,48 5.585,49 5.797,50 4.686,51 4.848,52 6.518,53 4.761,54 5.533,55 5.767,56 4.425,57 4.709,58 6.463,59 4.58,60 5.314,61 5.575,62 3.935,63 4.389,64 6.201,65 4.21,66 0.027,67 0.917,68 12.149,69 5.573,70 7.207}
{0 CHEMBL1624529,1 29.209,2 44.125,3 0.066,4 -0.067,5 1.174,7 3.898,8 3.898,11 1.88,12 10.033,13 2.188,14 4.787,15 101.04,16 9.253,17 0.353,18 3.98,19 4.077,20 3.703,21 3.501,22 5.283,23 3.545,24 4.501,25 4.633,26 4.124,27 3.904,28 5.894,29 3.941,30 4.792,31 4.967,32 4.239,33 4.011,34 6.182,35 4.041,36 4.823,37 5.013,38 4.263,39 3.957,40 6.431,41 4.006,42 4.733,43 4.904,44 4.215,45 3.959,46 6.242,47 4.003,48 4.699,49 4.85,50 4.225,51 3.924,52 6.21,53 3.987,54 4.741,55 4.885,56 4.23,57 3.862,58 6.607,59 3.925,60 4.664,61 4.843,62 3.925,63 3.717,64 6.209,65 3.741,66 0.299,67 0.926,68 5.585,69 3.93,70 5.2}
{0 CHEMBL1682341,1 13.601,2 17.212,3 0.028,4 0.213,5 0.162,7 3.856,8 3.856,11 1.449,12 9.381,13 3.215,14 10.334,15 83.612,16 8.098,17 0.875,18 3.669,19 3.796,20 3.333,21 3.262,22 4.836,23 3.253,24 4.131,25 4.282,26 3.657,27 3.641,28 5.22,29 3.615,30 4.307,31 4.51,32 3.541,33 3.671,34 5.303,35 3.596,36 4.331,37 4.582,38 3.419,39 3.546,40 5.283,41 3.462,42 4.119,43 4.364,44 3.323,45 3.356,46 5.114,47 3.294,48 3.959,49 4.187,50 3.235,51 3.224,52 5.027,53 3.184,54 3.842,55 4.085,56 3.016,57 3.108,58 4.833,59 3.039,60 3.615,61 3.82,62 2.778,63 3.045,64 4.531,65 2.938,66 0.087,67 0.566,68 5.823,69 2.68,70 5.2}
{0 CHEMBL1682345,1 8.381,2 13.558,3 0.028,4 0.213,5 0.141,7 3.856,8 3.856,11 1.449,12 9.381,13 3.187,14 10.155,15 83.897,16 8.098,17 0.875,18 3.669,19 3.796,20 3.333,21 3.262,22 4.835,23 3.253,24 4.133,25 4.287,26 3.654,27 3.643,28 5.219,29 3.618,30 4.303,31 4.502,32 3.54,33 3.679,34 5.3,35 3.6,36 4.331,37 4.582,38 3.424,39 3.539,40 5.286,41 3.456,42 4.123,43 4.372,44 3.317,45 3.344,46 5.113,47 3.292,48 3.956,49 4.182,50 3.234,51 3.23,52 5.024,53 3.186,54 3.843,55 4.087,56 3.026,57 3.111,58 4.84,59 3.036,60 3.615,61 3.82,62 2.778,63 3.045,64 4.531,65 2.938,66 0.087,67 0.566,68 5.823,69 2.68,70 5.3}
{0 CHEMBL1682346,1 11.544,2 16.058,3 0.072,4 0.266,5 0.171,7 3.876,8 3.876,11 1.481,12 9.5,13 2.702,14 7.299,15 87.602,16 8.066,17 0.84,18 3.729,19 3.865,20 3.378,21 3.289,22 4.92,23 3.287,24 4.184,25 4.342,26 3.717,27 3.677,28 5.299,29 3.657,30 4.367,31 4.568,32 3.645,33 3.722,34 5.437,35 3.659,36 4.414,37 4.662,38 3.511,39 3.611,40 5.404,41 3.534,42 4.232,43 4.482,44 3.41,45 3.438,46 5.241,47 3.383,48 4.084,49 4.317,50 3.339,51 3.322,52 5.184,53 3.276,54 3.975,55 4.224,56 3.162,57 3.193,58 5.05,59 3.126,60 3.773,61 4.005,62 2.866,63 3.114,64 4.683,65 3.011,66 0.109,67 0.62,68 6.431,69 2.74,70 5.6}
{0 CHEMBL1682357,1 7.276,2 10.294,3 0.047,4 0.19,5 0.115,7 3.856,8 3.856,11 1.489,12 9.381,13 3.719,14 13.834,15 81.842,16 8.098,17 0.875,18 3.666,19 3.769,20 3.327,21 3.289,22 4.837,23 3.276,24 4.126,25 4.256,26 3.652,27 3.667,28 5.217,29 3.638,30 4.306,31 4.488,32 3.541,33 3.692,34 5.307,35 3.616,36 4.333,37 4.556,38 3.419,39 3.568,40 5.293,41 3.485,42 4.118,43 4.337,44 3.321,45 3.377,46 5.119,47 3.321,48 3.967,49 4.152,50 3.25,51 3.241,52 5.052,53 3.204,54 3.846,55 4.061,56 3.017,57 3.122,58 4.842,59 3.053,60 3.615,61 3.81,62 2.778,63 3.049,64 4.533,65 2.94,66 0.089,67 0.489,68 5.769,69 2.827,70 5.2}
{0 CHEMBL1682359,1 3.638,2 1.471,3 0.03,4 0.159,5 0.149,7 3.842,8 3.842,11 1.541,12 7.765,13 3.143,14 9.881,15 66.348,16 7.576,17 0.789,18 3.529,19 3.647,20 3.129,21 3.082,22 4.655,23 3.066,24 4.019,25 4.185,26 3.444,27 3.452,28 5.038,29 3.417,30 4.174,31 4.393,32 3.324,33 3.453,34 5.122,35 3.375,36 4.158,37 4.387,38 3.214,39 3.331,40 5.119,41 3.258,42 3.932,43 4.154,44 2.999,45 3.111,46 4.896,47 3.043,48 3.721,49 3.918,50 2.874,51 2.935,52 4.732,53 2.87,54 3.585,55 3.821,56 2.628,57 2.817,58 4.513,59 2.709,60 3.482,61 3.745,62 2.206,63 2.69,64 4.211,65 2.502,66 0.089,67 0.457,68 6.001,69 2.663,70 5.2}
{0 CHEMBL1682360,1 10.227,2 13.229,3 0.015,4 0.002,5 0.16,7 3.845,8 3.845,11 1.515,12 9.381,13 3.157,14 9.967,15 82.841,16 7.241,17 0.625,18 3.79,19 3.917,20 3.359,21 3.317,22 4.819,23 3.298,24 4.346,25 4.531,26 3.689,27 3.73,28 5.268,29 3.686,30 4.576,31 4.815,32 3.588,33 3.804,34 5.403,35 3.695,36 4.602,37 4.876,38 3.461,39 3.694,40 5.395,41 3.569,42 4.349,43 4.61,44 3.352,45 3.489,46 5.191,47 3.397,48 4.191,49 4.407,50 3.296,51 3.336,52 5.155,53 3.278,54 4.052,55 4.287,56 3.07,57 3.196,58 4.946,59 3.118,60 3.837,61 4.051,62 2.841,63 3.143,64 4.621,65 3.019,66 0.093,67 0.614,68 8.522,69 3.496,70 5.2}
{0 CHEMBL1682540,3 -0.001,4 -0.135,5 0.107,7 4.323,8 4.323,11 1.487,12 7.222,13 2.054,14 4.218,15 68.032,16 8.714,17 0.952,18 3.479,19 3.597,20 3.204,21 3.059,22 4.673,23 3.077,24 3.939,25 4.084,26 3.565,27 3.452,28 5.108,29 3.457,30 4.059,31 4.242,32 3.451,33 3.47,34 5.149,35 3.429,36 4.022,37 4.249,38 3.221,39 3.317,40 5.034,41 3.255,42 3.764,43 3.993,44 2.998,45 3.07,46 4.736,47 3.007,48 3.585,49 3.783,50 2.999,51 2.95,52 4.706,53 2.923,54 3.547,55 3.77,56 2.772,57 2.825,58 4.564,59 2.761,60 3.293,61 3.551,62 2.41,63 2.5,64 4.288,65 2.408,66 0.053,67 0.478,68 3.804,69 1.885,70 5.2}
{0 CHEMBL1682545,1 9.487,2 17.5,3 0.069,4 0.116,5 0.104,7 3.856,8 3.856,11 1.559,12 9.381,13 3.968,14 15.745,15 85.95,16 8.86,17 0.875,18 3.639,19 3.748,20 3.425,21 3.322,22 4.795,23 3.278,24 4.083,25 4.207,26 3.783,27 3.684,28 5.204,29 3.628,30 4.238,31 4.426,32 3.621,33 3.679,34 5.26,35 3.582,36 4.22,37 4.441,38 3.588,39 3.609,40 5.193,41 3.478,42 4.044,43 4.251,44 3.516,45 3.503,46 5.006,47 3.35,48 3.852,49 4.025,50 3.399,51 3.356,52 4.918,53 3.232,54 3.767,55 3.966,56 3.18,57 3.18,58 4.732,59 3.068,60 3.593,61 3.792,62 2.803,63 3.03,64 4.556,65 2.913,66 0.045,67 0.512,68 5.179,69 2.614,70 5.2}
{0 CHEMBL1682546,1 9.712,2 15.848,3 0.064,4 0.105,5 0.099,7 3.843,8 3.843,11 1.537,12 10.182,13 3.81,14 14.517,15 92.27,16 8.512,17 0.84,18 3.712,19 3.826,20 3.463,21 3.384,22 4.837,23 3.334,24 4.176,25 4.316,26 3.81,27 3.751,28 5.252,29 3.685,30 4.337,31 4.531,32 3.658,33 3.763,34 5.312,35 3.651,36 4.353,37 4.586,38 3.569,39 3.685,40 5.276,41 3.538,42 4.177,43 4.409,44 3.526,45 3.555,46 5.077,47 3.396,48 3.987,49 4.187,50 3.521,51 3.451,52 5.01,53 3.316,54 3.903,55 4.091,56 3.348,57 3.339,58 4.871,59 3.206,60 3.783,61 4.009,62 2.887,63 3.158,64 4.661,65 3.019,66 0.05,67 0.554,68 6.265,69 2.994,70 5.2}
{0 CHEMBL1682552,1 9.487,2 17.5,3 0.025,4 -0.106,5 0.215,7 4.349,8 4.349,11 1.433,12 8.56,13 3.845,14 14.786,15 98.492,16 7.388,17 0.69,18 3.937,19 4.073,20 3.523,21 3.484,22 4.964,23 3.467,24 4.492,25 4.673,26 3.895,27 3.918,28 5.454,29 3.871,30 4.761,31 5.008,32 3.879,33 4.008,34 5.624,35 3.918,36 4.755,37 5.026,38 3.781,39 3.931,40 5.593,41 3.836,42 4.598,43 4.843,44 3.776,45 3.868,46 5.468,47 3.801,48 4.617,49 4.825,50 3.863,51 3.969,52 5.565,53 3.902,54 4.731,55 4.961,56 3.775,57 4.015,58 5.622,59 3.9,60 4.706,61 4.978,62 3.476,63 3.883,64 5.499,65 3.714,66 0.058,67 0.753,68 9.421,69 3.73,70 5.2}
{0 CHEMBL1682553,1 9.487,2 17.5,3 0.004,4 -0.16,5 0.17,7 4.349,8 4.349,11 1.471,12 7.409,13 2.713,14 7.362,15 86.645,16 7.694,17 0.8,18 3.772,19 3.91,20 3.387,21 3.298,22 4.887,23 3.296,24 4.276,25 4.461,26 3.761,27 3.692,28 5.337,29 3.673,30 4.457,31 4.676,32 3.732,33 3.764,34 5.465,35 3.713,36 4.503,37 4.757,38 3.671,39 3.735,40 5.432,41 3.67,42 4.366,43 4.578,44 3.636,45 3.699,46 5.357,47 3.65,48 4.463,49 4.679,50 3.608,51 3.769,52 5.469,53 3.681,54 4.488,55 4.741,56 3.397,57 3.691,58 5.403,59 3.55,60 4.354,61 4.658,62 2.996,63 3.42,64 5.135,65 3.227,66 0.046,67 0.649,68 7.419,69 2.901,70 5.4}
{0 CHEMBL1682558,1 13.2,2 13.238,3 -0.007,4 -0.138,5 0.377,7 4.2,8 4.2,9 5.449,10 1,11 1.597,12 10.034,13 3.356,14 11.259,15 111.013,16 7.676,17 0.636,18 4.059,19 4.181,20 3.667,21 3.586,22 5.143,23 3.582,24 4.613,25 4.788,26 4.014,27 3.992,28 5.652,29 3.972,30 4.827,31 5.039,32 4.001,33 4.12,34 5.805,35 4.048,36 4.876,37 5.118,38 3.942,39 4.118,40 5.774,41 4.02,42 4.869,43 5.126,44 3.944,45 4.089,46 5.726,47 4.001,48 4.808,49 5.022,50 4.019,51 4.13,52 5.785,53 4.051,54 4.896,55 5.123,56 4.032,57 4.156,58 5.875,59 4.066,60 4.878,61 5.121,62 3.891,63 4.059,64 5.842,65 3.96,66 0.058,67 0.866,68 9.994,69 4.479,70 5.2}
{0 CHEMBL1721885,1 27.43,2 32.432,3 0.031,4 -0.109,5 0.989,6 0.8,7 4.111,8 4.111,9 5.301,10 1,11 1.672,12 13.219,13 1.477,14 2.182,15 119.219,16 7.501,17 0.314,18 4.185,19 4.306,20 3.74,21 3.66,22 5.304,23 3.661,24 4.749,25 4.924,26 4.121,27 4.065,28 5.87,29 4.049,30 4.994,31 5.19,32 4.166,33 4.207,34 6.128,35 4.159,36 5.082,37 5.314,38 4.121,39 4.214,40 6.167,41 4.135,42 5.078,43 5.306,44 4.098,45 4.128,46 6.304,47 4.069,48 5.032,49 5.27,50 4.038,51 4.095,52 6.228,53 4.026,54 4.95,55 5.189,56 4.002,57 4.053,58 6.049,59 3.982,60 4.921,61 5.134,62 3.934,63 3.971,64 6.219,65 3.912,66 0.129,67 0.935,68 12.267,69 5.279,70 5}
{0 CHEMBL1727312,1 14.962,2 26.208,3 0.075,4 0.048,5 0.169,7 3.697,8 3.697,11 1.496,12 5.75,13 2.335,14 5.451,15 61.741,16 8.087,17 0.667,18 3.391,19 3.501,20 3.038,21 3.019,22 4.564,23 3.008,24 3.846,25 3.969,26 3.392,27 3.392,28 5.034,29 3.361,30 4.162,31 4.341,32 3.536,33 3.534,34 5.304,35 3.499,36 4.154,37 4.358,38 3.354,39 3.399,40 5.369,41 3.348,42 3.997,43 4.218,44 3.029,45 3.226,46 5.16,47 3.139,48 3.596,49 3.821,50 2.427,51 2.829,52 4.665,53 2.684,54 3.168,55 3.438,56 1.674,57 2.339,58 3.989,59 2.115,60 2.554,61 2.915,62 0.441,63 1.458,64 2.996,65 1.12,66 0.023,67 0.37,68 4.368,69 2.074,70 5.2}
{0 CHEMBL17370,1 3.956,2 2.018,3 0.039,4 -0.029,5 0.204,7 3.735,8 3.735,11 1.559,12 9.923,13 4.996,14 24.957,15 104.37,16 8.606,17 0.793,18 3.846,19 3.947,20 3.591,21 3.535,22 5.026,23 3.488,24 4.306,25 4.44,26 3.914,27 3.897,28 5.471,29 3.832,30 4.491,31 4.659,32 3.937,33 3.967,34 5.63,35 3.891,36 4.526,37 4.716,38 3.848,39 3.926,40 5.616,41 3.848,42 4.561,43 4.785,44 3.823,45 3.931,46 5.555,47 3.848,48 4.484,49 4.68,50 3.87,51 3.926,52 5.571,53 3.841,54 4.458,55 4.629,56 3.832,57 3.942,58 5.593,59 3.834,60 4.553,61 4.79,62 3.648,63 3.839,64 5.612,65 3.703,66 0.014,67 0.635,68 6.697,69 3.602,70 5.2}
{0 CHEMBL178737,1 24.126,2 28.026,3 -0.018,4 -0.316,5 0.957,6 0.8,7 4.539,8 4.539,9 5.401,10 1,11 1.637,12 12.811,13 1.698,14 2.882,15 134.974,16 8.14,17 0.465,18 4.262,19 4.37,20 3.919,21 3.79,22 5.371,23 3.806,24 4.839,25 4.996,26 4.335,27 4.239,28 5.947,29 4.238,30 5.092,31 5.27,32 4.448,33 4.434,34 6.158,35 4.407,36 5.197,37 5.385,38 4.475,39 4.478,40 6.372,41 4.443,42 5.209,43 5.396,44 4.485,45 4.459,46 6.414,47 4.423,48 5.199,49 5.402,50 4.429,51 4.438,52 6.336,53 4.391,54 5.214,55 5.43,56 4.349,57 4.382,58 6.317,59 4.335,60 5.081,61 5.291,62 4.14,63 4.25,64 6.169,65 4.181,66 0.095,67 0.974,68 10.547,69 5.083,70 5.2}
{0 CHEMBL1789941,1 6.822,2 4.471,3 0.003,4 -0.125,5 0.191,7 3.803,8 3.803,11 1.454,12 8.217,13 2.741,14 7.514,15 87.719,16 7.473,17 0.577,18 3.83,19 3.964,20 3.419,21 3.379,22 4.917,23 3.361,24 4.393,25 4.579,26 3.766,27 3.812,28 5.342,29 3.761,30 4.662,31 4.912,32 3.726,33 3.893,34 5.519,35 3.793,36 4.671,37 4.931,38 3.794,39 3.896,40 5.617,41 3.814,42 4.649,43 4.893,44 3.712,45 3.876,46 5.675,47 3.777,48 4.555,49 4.837,50 3.475,51 3.656,52 5.585,53 3.543,54 4.166,55 4.425,56 3.14,57 3.392,58 5.114,59 3.28,60 4.06,61 4.274,62 3.265,63 3.408,64 5.073,65 3.326,66 0.041,67 0.682,68 8.241,69 3.401,70 5}
{0 CHEMBL180022,1 36.005,2 48.297,3 -0.017,4 -0.194,5 0.671,6 0.916,7 3.896,8 3.896,9 11.605,10 2,11 1.64,12 15.75,13 5.095,14 25.957,15 155.746,16 8.074,17 0.535,18 4.323,19 4.436,20 3.953,21 3.866,22 5.504,23 3.856,24 4.823,25 4.99,26 4.287,27 4.211,28 5.95,29 4.188,30 5.034,31 5.207,32 4.416,33 4.356,34 6.189,35 4.313,36 5.116,37 5.33,38 4.384,39 4.375,40 6.215,41 4.307,42 5.087,43 5.277,44 4.401,45 4.408,46 6.257,47 4.343,48 5.11,49 5.304,50 4.487,51 4.433,52 6.295,53 4.382,54 5.143,55 5.327,56 4.498,57 4.435,58 6.404,59 4.376,60 5.1,61 5.3,62 4.403,63 4.344,64 6.311,65 4.271,66 0.063,67 0.996,68 12.243,69 5.847,70 5}
{0 CHEMBL1807446,1 21.317,2 31.989,3 0.031,4 -0.023,5 0.55,7 3.963,8 3.963,11 1.531,12 12.188,13 5.109,14 26.106,15 124.657,16 7.737,17 0.611,18 4.117,19 4.237,20 3.725,21 3.699,22 5.25,23 3.683,24 4.611,25 4.778,26 4.06,27 4.056,28 5.722,29 4.022,30 4.813,31 5,32 4.16,33 4.168,34 5.956,35 4.129,36 4.907,37 5.097,38 4.162,39 4.167,40 6.109,41 4.129,42 4.918,43 5.13,44 4.101,45 4.166,46 6.083,47 4.114,48 4.857,49 5.046,50 4.12,51 4.202,52 5.983,53 4.139,54 4.955,55 5.184,56 4.038,57 4.188,58 5.998,59 4.101,60 4.88,61 5.125,62 3.877,63 4.072,64 5.882,65 3.966,66 0.051,67 0.835,68 10.243,69 4.726,70 4.602}
{0 CHEMBL1825138,1 23.489,2 28.517,3 0.028,4 -0.029,5 0.89,7 4.065,8 4.065,9 5.975,10 1,11 1.778,12 11.767,13 3.694,14 13.646,15 118.112,16 8.661,17 0.515,18 4.068,19 4.188,20 3.755,21 3.612,22 5.194,23 3.597,24 4.613,25 4.779,26 4.164,27 4.02,28 5.709,29 3.988,30 4.9,31 5.103,32 4.332,33 4.171,34 6.028,35 4.108,36 4.921,37 5.125,38 4.366,39 4.168,40 6.033,41 4.081,42 4.893,43 5.122,44 4.105,45 4.074,46 6.038,47 3.981,48 4.725,49 4.942,50 4.013,51 3.993,52 5.803,53 3.908,54 4.692,55 4.901,56 4.129,57 3.992,58 5.855,59 3.904,60 4.731,61 4.963,62 3.976,63 3.926,64 5.886,65 3.828,66 0.124,67 0.843,68 8.72,69 4.5,70 5.2}
{0 CHEMBL1834657,1 41.542,2 63.434,3 -0.059,4 -0.414,5 1.071,6 0.8,7 3.791,8 3.791,9 10.528,10 2,11 1.729,12 16.316,13 5.343,14 28.544,15 150.96,16 8.124,17 0.439,18 4.336,19 4.459,20 3.971,21 3.804,22 5.442,23 3.8,24 4.879,25 5.072,26 4.342,27 4.18,28 5.938,29 4.158,30 5.081,31 5.27,32 4.563,33 4.381,34 6.169,35 4.338,36 5.209,37 5.41,38 4.553,39 4.472,40 6.303,41 4.366,42 5.284,43 5.532,44 4.47,45 4.393,46 6.35,47 4.293,48 5.126,49 5.363,50 4.354,51 4.275,52 6.234,53 4.19,54 5.007,55 5.219,56 4.257,57 4.22,58 6.099,59 4.128,60 4.962,61 5.174,62 4.186,63 4.148,64 6.065,65 4.078,66 0.103,67 1.031,68 13.148,69 5.647,70 5}
{0 CHEMBL183844,1 22.487,2 31.302,3 0.061,4 0.031,5 0.235,6 0.247,7 3.843,8 3.843,11 1.471,12 11.75,13 3.975,14 15.803,15 109.742,16 7.581,17 0.581,18 3.986,19 4.104,20 3.569,21 3.59,22 5.123,23 3.564,24 4.485,25 4.641,26 3.941,27 3.987,28 5.634,29 3.938,30 4.714,31 4.888,32 3.976,33 4.111,34 5.816,35 4.041,36 4.803,37 5.015,38 3.917,39 4.077,40 5.887,41 3.99,42 4.781,43 5.006,44 3.832,45 3.995,46 5.891,47 3.906,48 4.703,49 4.939,50 3.708,51 3.886,52 5.797,53 3.795,54 4.554,55 4.777,56 3.571,57 3.792,58 5.607,59 3.692,60 4.486,61 4.726,62 3.48,63 3.708,64 5.499,65 3.594,66 0.032,67 0.689,68 9.34,69 4.271,70 5.2}
{0 CHEMBL184847,1 22.751,2 32.701,3 0.061,4 0.031,5 0.284,6 0.247,7 3.875,8 3.875,11 1.471,12 12.536,13 3.975,14 15.803,15 109.742,16 7.581,17 0.581,18 3.986,19 4.104,20 3.569,21 3.59,22 5.123,23 3.564,24 4.485,25 4.641,26 3.941,27 3.987,28 5.634,29 3.938,30 4.714,31 4.888,32 3.974,33 4.115,34 5.816,35 4.044,36 4.799,37 5.006,38 3.884,39 4.075,40 5.894,41 3.977,42 4.798,43 5.05,44 3.752,45 3.943,46 5.859,47 3.841,48 4.585,49 4.825,50 3.613,51 3.77,52 5.668,53 3.682,54 4.425,55 4.652,56 3.469,57 3.627,58 5.537,59 3.543,60 4.29,61 4.509,62 3.38,63 3.521,64 5.402,65 3.444,66 0.032,67 0.689,68 9.34,69 4.271,70 5.2}
{0 CHEMBL185569,1 21.893,2 32.092,3 0.065,4 0.036,5 0.249,6 0.247,7 3.67,8 3.67,11 1.489,12 11.852,13 3.489,14 12.174,15 104.701,16 7.77,17 0.6,18 3.931,19 4.046,20 3.535,21 3.54,22 5.086,23 3.52,24 4.42,25 4.565,26 3.899,27 3.933,28 5.6,29 3.888,30 4.66,31 4.839,32 3.909,33 4.041,34 5.768,35 3.972,36 4.7,37 4.909,38 3.84,39 3.974,40 5.817,41 3.893,42 4.655,43 4.874,44 3.718,45 3.869,46 5.795,47 3.788,48 4.55,49 4.79,50 3.578,51 3.733,52 5.643,53 3.642,54 4.355,55 4.578,56 3.386,57 3.565,58 5.47,59 3.48,60 4.187,61 4.409,62 3.323,63 3.457,64 5.257,65 3.375,66 0.03,67 0.648,68 8.382,69 3.91,70 5.2}
{0 CHEMBL1908391,1 30.255,2 48.345,3 0.008,4 -0.183,5 0.403,6 0.4,7 3.88,8 3.88,11 1.54,12 16.667,13 4.475,14 20.029,15 146.666,16 7.556,17 0.575,18 4.28,19 4.407,20 3.903,21 3.864,22 5.339,23 3.817,24 4.812,25 4.999,26 4.255,27 4.246,28 5.814,29 4.182,30 5.037,31 5.241,32 4.236,33 4.383,34 6.005,35 4.278,36 5.175,37 5.434,38 4.202,39 4.381,40 6.092,41 4.232,42 5.086,43 5.353,44 4.21,45 4.309,46 5.994,47 4.17,48 4.875,49 5.072,50 4.12,51 4.257,52 5.876,53 4.129,54 4.947,55 5.191,56 3.976,57 4.197,58 5.882,59 4.063,60 4.807,61 5.025,62 3.998,63 4.113,64 5.832,65 4.011,66 0.043,67 1.016,68 13.973,69 5.934,70 5}
{0 CHEMBL1908392,1 26.138,2 36.272,3 0.003,4 -0.214,5 0.497,6 0.6,7 3.835,8 3.835,11 1.468,12 14.139,13 4.725,14 22.326,15 143.007,16 7.189,17 0.55,18 4.296,19 4.422,20 3.839,21 3.839,22 5.374,23 3.814,24 4.829,25 5.017,26 4.193,27 4.236,28 5.841,29 4.191,30 5.082,31 5.287,32 4.266,33 4.404,34 6.091,35 4.326,36 5.194,37 5.429,38 4.24,39 4.417,40 6.189,41 4.315,42 5.191,43 5.436,44 4.277,45 4.386,46 6.24,47 4.315,48 5.107,49 5.294,50 4.281,51 4.439,52 6.214,53 4.362,54 5.207,55 5.442,56 4.18,57 4.463,58 6.186,59 4.337,60 5.154,61 5.421,62 3.926,63 4.318,64 6.018,65 4.158,66 0.05,67 0.996,68 14.24,69 5.91,70 5}
{0 CHEMBL1908393,1 42.521,2 55.757,3 -0.001,4 -0.128,5 1.157,6 0.86,7 3.952,8 3.952,9 22.96,10 4,11 1.667,12 20.217,13 3.792,14 14.379,15 168.034,16 7.741,17 0.333,18 4.52,19 4.625,20 4.112,21 4.011,22 5.635,23 4.019,24 5.08,25 5.239,26 4.456,27 4.378,28 6.203,29 4.372,30 5.337,31 5.525,32 4.583,33 4.5,34 6.516,35 4.488,36 5.359,37 5.562,38 4.48,39 4.493,40 6.572,41 4.447,42 5.34,43 5.554,44 4.478,45 4.514,46 6.429,47 4.459,48 5.335,49 5.522,50 4.52,51 4.524,52 6.537,53 4.482,54 5.379,55 5.593,56 4.468,57 4.472,58 6.584,59 4.422,60 5.262,61 5.485,62 4.382,63 4.361,64 6.46,65 4.315,66 0.166,67 1.298,68 15.93,69 7.845,70 6.409}
{0 CHEMBL1908394,1 33.041,2 41.717,3 0.006,4 -0.132,5 1.474,6 0.916,7 4.074,8 4.074,9 5.918,10 1,11 1.781,12 14,13 5.126,14 26.275,15 142.371,16 8.237,17 0.5,18 4.305,19 4.42,20 3.979,21 3.839,22 5.432,23 3.824,24 4.882,25 5.053,26 4.445,27 4.25,28 6.339,29 4.225,30 5.081,31 5.26,32 4.476,33 4.406,34 6.175,35 4.345,36 5.233,37 5.449,38 4.486,39 4.459,40 6.363,41 4.371,42 5.253,43 5.486,44 4.449,45 4.41,46 6.462,47 4.328,48 5.122,49 5.328,50 4.368,51 4.368,52 6.288,53 4.284,54 5.089,55 5.295,56 4.428,57 4.346,58 6.281,59 4.281,60 5.093,61 5.291,62 4.487,63 4.302,64 6.332,65 4.253,66 0.146,67 1.213,68 12.176,69 6.276,70 5}
{0 CHEMBL1908395,1 30.676,2 33.548,3 -0.004,4 -0.21,5 0.49,6 0.835,7 3.881,8 3.881,11 1.503,12 13.5,13 3.328,14 11.073,15 132.718,16 6.979,17 0.297,18 4.265,19 4.401,20 3.774,21 3.783,22 5.32,23 3.752,24 4.844,25 5.048,26 4.12,27 4.201,28 5.813,29 4.138,30 5.129,31 5.356,32 4.19,33 4.389,34 6.129,35 4.279,36 5.226,37 5.479,38 4.177,39 4.391,40 6.2,41 4.275,42 5.188,43 5.43,44 4.146,45 4.364,46 6.187,47 4.261,48 5.159,49 5.396,50 4.153,51 4.392,52 6.14,53 4.276,54 5.238,55 5.501,56 4.101,57 4.409,58 6.093,59 4.27,60 5.236,61 5.509,62 4.051,63 4.347,64 6.12,65 4.207,66 0.035,67 1.005,68 14.504,69 5.794,70 5}
{0 CHEMBL1908396,1 29.158,2 39.065,3 -0.016,4 -0.185,5 1.021,6 0.86,7 3.921,8 3.921,9 22.373,10 4,11 1.725,12 13.882,13 3.467,14 12.019,15 127.926,16 8.286,17 0.595,18 4.179,19 4.273,20 3.865,21 3.695,22 5.365,23 3.691,24 4.676,25 4.82,26 4.21,27 4.029,28 5.836,29 4.019,30 4.81,31 4.952,32 4.267,33 4.128,34 5.969,35 4.117,36 4.908,37 5.054,38 4.256,39 4.189,40 6.087,41 4.155,42 5.014,43 5.2,44 4.236,45 4.199,46 6.198,47 4.144,48 4.963,49 5.171,50 4.112,51 4.147,52 6.037,53 4.08,54 4.901,55 5.101,56 4.059,57 4.096,58 5.988,59 4.024,60 4.825,61 5.018,62 4.052,63 4.041,64 5.849,65 3.962,66 0.12,67 0.839,68 10.643,69 5.373,70 5}
{0 CHEMBL1908397,1 10.372,2 13.198,3 0.033,4 0.001,5 0.283,7 3.811,8 3.811,11 1.472,12 11.68,13 2.724,14 7.42,15 100.285,16 7.388,17 0.571,18 3.911,19 4.039,20 3.483,21 3.483,22 4.988,23 3.457,24 4.433,25 4.608,26 3.812,27 3.874,28 5.459,29 3.825,30 4.685,31 4.91,32 3.823,33 3.981,34 5.672,35 3.893,36 4.685,37 4.917,38 3.663,39 3.874,40 5.729,41 3.773,42 4.528,43 4.765,44 3.498,45 3.747,46 5.542,47 3.635,48 4.405,49 4.635,50 3.443,51 3.711,52 5.33,53 3.589,54 4.418,55 4.68,56 3.334,57 3.628,58 5.309,59 3.496,60 4.195,61 4.446,62 3.138,63 3.439,64 5.085,65 3.309,66 0.056,67 0.685,68 9.145,69 3.907,70 5}
{0 CHEMBL191003,1 22.758,2 34.444,3 0.103,4 -0.029,5 0.974,7 4.238,8 4.238,11 2.109,12 11.074,13 2.35,14 5.521,15 95.039,16 10.113,17 0.586,18 3.831,19 3.929,20 3.765,21 3.35,22 5.175,23 3.377,24 4.294,25 4.403,26 4.067,27 3.692,28 5.973,29 3.726,30 4.516,31 4.664,32 4.096,33 3.74,34 6.069,35 3.787,36 4.554,37 4.712,38 4.082,39 3.625,40 6.416,41 3.691,42 4.417,43 4.611,44 3.837,45 3.475,46 5.937,47 3.54,48 4.269,49 4.458,50 3.821,51 3.419,52 5.905,53 3.466,54 4.198,55 4.384,56 3.609,57 3.348,58 5.662,59 3.355,60 4.157,61 4.363,62 3.564,63 3.28,64 5.69,65 3.266,66 0.28,67 0.806,68 5.893,69 3.296,70 5}
{0 CHEMBL1916359,1 7.846,2 4.378,3 0.013,4 0.004,5 0.615,7 4.154,8 4.154,11 1.793,12 9.222,13 5.686,14 32.326,15 104.111,16 11.342,17 0.767,18 3.758,19 3.824,20 3.676,21 3.485,22 5.051,23 3.47,24 4.223,25 4.304,26 4.115,27 3.893,28 5.555,29 3.87,30 4.506,31 4.621,32 4.32,33 4.066,34 5.834,35 4.026,36 4.512,37 4.609,38 4.473,39 4.058,40 5.965,41 4.02,42 4.536,43 4.643,44 4.395,45 4.061,46 5.999,47 4.019,48 4.531,49 4.676,50 4.195,51 3.976,52 5.863,53 3.903,54 4.359,55 4.53,56 3.895,57 3.708,58 5.661,59 3.627,60 4.086,61 4.245,62 3.806,63 3.444,64 5.591,65 3.384,66 0.153,67 0.496,68 1.049,69 2.257,70 5}
{0 CHEMBL1929238,1 34.116,2 44.007,3 -0.022,4 -0.262,5 0.875,6 0.8,7 3.985,8 3.985,11 1.747,12 13.083,13 4.215,14 17.768,15 145.678,16 8.038,17 0.289,18 4.306,19 4.432,20 3.955,21 3.84,22 5.368,23 3.787,24 4.878,25 5.079,26 4.388,27 4.26,28 5.91,29 4.181,30 5.157,31 5.342,32 4.612,33 4.5,34 6.242,35 4.383,36 5.366,37 5.607,38 4.497,39 4.495,40 6.402,41 4.349,42 5.216,43 5.454,44 4.408,45 4.347,46 6.321,47 4.252,48 5.117,49 5.31,50 4.47,51 4.368,52 6.411,53 4.278,54 5.258,55 5.476,56 4.478,57 4.446,58 6.359,59 4.327,60 5.245,61 5.465,62 4.45,63 4.444,64 6.325,65 4.315,66 0.059,67 1.013,68 14.18,69 6.381,70 4.523}
{0 CHEMBL1958401,1 14.183,2 21.147,3 0.02,4 -0.157,5 0.23,7 3.216,8 3.216,11 1.52,12 8.5,13 1.899,14 3.608,15 77.538,16 7.115,17 0.273,18 3.734,19 3.871,20 3.266,21 3.259,22 4.779,23 3.234,24 4.287,25 4.475,26 3.592,27 3.655,28 5.32,29 3.589,30 4.599,31 4.86,32 3.555,33 3.753,34 5.487,35 3.647,36 4.52,37 4.8,38 3.464,39 3.612,40 5.46,41 3.5,42 4.368,43 4.63,44 3.436,45 3.497,46 5.378,47 3.431,48 4.293,49 4.519,50 3.377,51 3.45,52 5.389,53 3.393,54 4.242,55 4.469,56 3.167,57 3.384,58 5.349,59 3.28,60 4.087,61 4.333,62 2.818,63 3.274,64 4.97,65 3.107,66 0.024,67 0.593,68 8.231,69 3.24,70 5.2}
{0 CHEMBL196363,1 17.311,2 24.218,3 0.081,4 0.032,5 0.294,7 3.686,8 3.686,11 1.652,12 11.852,13 3.463,14 11.989,15 109.616,16 8.534,17 0.733,18 3.903,19 4.018,20 3.629,21 3.534,22 5.101,23 3.501,24 4.355,25 4.496,26 3.997,27 3.912,28 5.561,29 3.855,30 4.551,31 4.72,32 3.992,33 3.999,34 5.679,35 3.924,36 4.63,37 4.836,38 3.999,39 3.967,40 5.764,41 3.87,42 4.586,43 4.798,44 3.778,45 3.844,46 5.736,47 3.739,48 4.422,49 4.649,50 3.617,51 3.66,52 5.565,53 3.579,54 4.268,55 4.481,56 3.435,57 3.547,58 5.368,59 3.463,60 4.186,61 4.415,62 3.382,63 3.51,64 5.202,65 3.387,66 0.053,67 0.684,68 7.51,69 3.604,70 5.2}
{0 CHEMBL1964290,1 9.269,2 6.931,3 0.093,4 0.061,5 0.268,7 3.899,8 3.899,11 1.557,12 7.957,13 2.942,14 8.656,15 90.446,16 7.685,17 0.68,18 3.793,19 3.928,20 3.373,21 3.34,22 5.01,23 3.33,24 4.249,25 4.42,26 3.747,27 3.715,28 5.482,29 3.685,30 4.427,31 4.596,32 3.795,33 3.846,34 5.589,35 3.801,36 4.566,37 4.757,38 3.791,39 3.895,40 5.706,41 3.822,42 4.674,43 4.924,44 3.73,45 3.883,46 5.708,47 3.787,48 4.566,49 4.799,50 3.691,51 3.76,52 5.77,53 3.691,54 4.482,55 4.714,56 3.483,57 3.606,58 5.697,59 3.524,60 4.338,61 4.595,62 3.244,63 3.386,64 5.621,65 3.284,66 0.056,67 0.631,68 7.707,69 3.105,70 6.6}
{0 CHEMBL1964307,1 16.003,2 20.616,3 0.089,4 0.203,5 0.238,7 3.701,8 3.701,11 1.458,12 11.37,13 4.09,14 16.731,15 109.069,16 7.584,17 0.733,18 3.95,19 4.076,20 3.534,21 3.556,22 5.107,23 3.529,24 4.421,25 4.574,26 3.886,27 3.945,28 5.538,29 3.895,30 4.658,31 4.84,32 3.903,33 4.058,34 5.74,35 3.981,36 4.741,37 4.968,38 3.856,39 4.022,40 5.79,41 3.928,42 4.686,43 4.91,44 3.74,45 3.921,46 5.805,47 3.83,48 4.605,49 4.852,50 3.576,51 3.808,52 5.648,53 3.698,54 4.426,55 4.667,56 3.338,57 3.666,58 5.395,59 3.535,60 4.293,61 4.547,62 3.305,63 3.556,64 5.194,65 3.431,66 0.071,67 0.692,68 9.052,69 3.97,70 5.2}
{0 CHEMBL1964399,1 31.33,2 51.659,3 -0.015,4 -0.235,5 0.633,6 0.6,7 3.922,8 3.922,9 10.543,10 2,11 1.615,12 12.581,13 3.553,14 12.626,15 118.804,16 7.337,17 0.364,18 4.155,19 4.271,20 3.689,21 3.603,22 5.334,23 3.605,24 4.643,25 4.83,26 4.029,27 3.921,28 5.756,29 3.917,30 4.822,31 4.995,32 4.118,33 4.079,34 6.052,35 4.044,36 5.032,37 5.289,38 4.017,39 4.123,40 6.05,41 4.033,42 4.955,43 5.198,44 4.025,45 4.086,46 5.985,47 4.019,48 4.853,49 5.044,50 4.047,51 4.028,52 6.064,53 3.989,54 4.904,55 5.13,56 3.934,57 3.929,58 6.122,59 3.885,60 4.756,61 4.985,62 3.783,63 3.844,64 5.896,65 3.785,66 0.101,67 0.84,68 12.392,69 4.991,70 5.3}
{0 CHEMBL1964413,1 15.723,2 21.746,3 0.029,4 0.031,5 1.607,7 4.123,8 4.123,11 1.816,12 11.172,13 5.071,14 25.718,15 95.845,16 10.283,17 0.656,18 3.873,19 3.977,20 3.672,21 3.376,22 5.212,23 3.441,24 4.431,25 4.56,26 4.202,27 3.766,28 6.472,29 3.842,30 4.52,31 4.673,32 4.065,33 3.855,34 5.949,35 3.884,36 4.707,37 4.909,38 4.091,39 3.778,40 6.178,41 3.843,42 4.614,43 4.83,44 4.037,45 3.585,46 6.124,47 3.699,48 4.495,49 4.667,50 4.199,51 3.439,52 6.811,53 3.591,54 4.3,55 4.525,56 3.702,57 3.307,58 5.877,59 3.377,60 3.937,61 4.09,62 3.556,63 3.258,64 5.533,65 3.303,66 0.42,67 1.147,68 2.859,69 3.604,70 5.2}
{0 CHEMBL1964444,1 18.603,2 25.872,3 0.023,4 -0.093,5 0.768,7 3.869,8 3.869,11 1.818,12 9.76,13 3.955,14 15.64,15 85.212,16 9.114,17 0.63,18 3.773,19 3.883,20 3.482,21 3.299,22 5.06,23 3.333,24 4.282,25 4.424,26 3.943,27 3.645,28 6.086,29 3.675,30 4.447,31 4.622,32 3.897,33 3.736,34 5.868,35 3.743,36 4.488,37 4.693,38 3.82,39 3.657,40 5.861,41 3.661,42 4.423,43 4.623,44 3.761,45 3.527,46 5.895,47 3.551,48 4.338,49 4.549,50 3.546,51 3.391,52 5.756,53 3.41,54 4.19,55 4.391,56 3.576,57 3.312,58 5.975,59 3.315,60 4.05,61 4.255,62 3.302,63 3.278,64 5.357,65 3.262,66 0.197,67 0.807,68 4.732,69 3.18,70 5.2}
{0 CHEMBL1964644,1 16.902,2 24.954,3 0.038,4 0.01,5 0.348,6 0.133,7 3.448,8 3.448,11 1.96,12 9.421,13 1.546,14 2.39,15 70.53,16 9.597,17 0.55,18 3.509,19 3.61,20 3.326,21 3.055,22 4.835,23 3.044,24 3.945,25 4.067,26 3.702,27 3.381,28 5.449,29 3.349,30 4.093,31 4.266,32 3.572,33 3.346,34 5.357,35 3.291,36 4.076,37 4.278,38 3.433,39 3.149,40 5.49,41 3.127,42 3.852,43 4.07,44 3.215,45 2.984,46 5.172,47 2.955,48 3.778,49 3.952,50 3.119,51 2.934,52 5.174,53 2.908,54 3.65,55 3.801,56 3.194,57 2.872,58 5.442,59 2.84,60 3.492,61 3.668,62 2.952,63 2.842,64 4.708,65 2.747,66 0.182,67 0.478,68 3.765,69 2.368,70 5.2}
{0 CHEMBL1964687,1 25.444,2 33.935,3 0.084,4 0.046,5 0.276,7 3.912,8 3.912,11 1.596,12 11.867,13 4.42,14 19.532,15 122.763,16 8.148,17 0.647,18 4.048,19 4.166,20 3.738,21 3.684,22 5.176,23 3.643,24 4.554,25 4.709,26 4.166,27 4.112,28 5.669,29 4.044,30 4.772,31 4.935,32 4.208,33 4.259,34 5.824,35 4.165,36 4.884,37 5.091,38 4.211,39 4.242,40 5.916,41 4.134,42 4.834,43 5.035,44 4.011,45 4.116,46 5.916,47 4.015,48 4.801,49 5.058,50 3.871,51 3.964,52 5.84,53 3.862,54 4.623,55 4.857,56 3.623,57 3.777,58 5.723,59 3.687,60 4.435,61 4.683,62 3.555,63 3.712,64 5.391,65 3.59,66 0.038,67 0.782,68 9.587,69 4.423,70 5.2}
{0 CHEMBL1964692,1 22.502,2 31.901,3 0.056,4 -0.033,5 0.959,7 3.869,8 3.869,11 1.794,12 12.839,13 3.475,14 12.077,15 111.37,16 8.884,17 0.647,18 4.012,19 4.133,20 3.704,21 3.525,22 5.288,23 3.556,24 4.513,25 4.66,26 4.156,27 3.905,28 6.208,29 3.929,30 4.685,31 4.855,32 4.132,33 4.033,34 5.994,35 4.031,36 4.807,37 5.006,38 4.121,39 4.005,40 6.147,41 3.999,42 4.768,43 4.982,44 4.016,45 3.895,46 6.167,47 3.888,48 4.68,49 4.917,50 3.779,51 3.785,52 5.912,53 3.748,54 4.48,55 4.694,56 3.743,57 3.654,58 6.077,59 3.604,60 4.383,61 4.624,62 3.535,63 3.56,64 5.545,65 3.496,66 0.224,67 0.985,68 6.729,69 3.856,70 5.2}
{0 CHEMBL1964777,1 10.922,2 12.031,3 0.082,4 0.053,5 0.275,7 3.658,8 3.658,9 5.618,10 1,11 1.898,12 7.9,13 2.601,14 6.763,15 74.101,16 9.942,17 0.727,18 3.522,19 3.596,20 3.374,21 3.178,22 4.848,23 3.165,24 3.954,25 4.038,26 3.783,27 3.544,28 5.368,29 3.514,30 4.146,31 4.254,32 3.804,33 3.527,34 5.518,35 3.505,36 4.046,37 4.176,38 3.606,39 3.369,40 5.425,41 3.352,42 3.89,43 4.047,44 3.366,45 3.29,46 5.141,47 3.253,48 3.919,49 4.058,50 3.509,51 3.299,52 5.44,53 3.267,54 3.901,55 4.092,56 3.243,57 3.183,58 5.219,59 3.084,60 3.546,61 3.738,62 3.067,63 2.773,64 4.974,65 2.721,66 0.12,67 0.467,68 2.985,69 2.482,70 5.2}
{0 CHEMBL1964804,1 6.915,2 6.587,3 0.004,4 -0.188,5 0.531,7 4.363,8 4.363,9 5.552,10 1,11 1.736,12 10.875,13 1.117,14 1.247,15 91.16,16 8.377,17 0.654,18 3.824,19 3.914,20 3.659,21 3.419,22 4.93,23 3.382,24 4.343,25 4.48,26 3.841,27 3.754,28 5.707,29 3.716,30 4.551,31 4.724,32 3.769,33 3.851,34 5.7,35 3.778,36 4.495,37 4.691,38 3.65,39 3.773,40 5.529,41 3.672,42 4.492,43 4.721,44 3.584,45 3.658,46 5.612,47 3.565,48 4.307,49 4.522,50 3.522,51 3.562,52 5.312,53 3.468,54 4.207,55 4.39,56 3.552,57 3.516,58 5.352,59 3.43,60 4.255,61 4.468,62 3.438,63 3.405,64 5.487,65 3.313,66 0.096,67 0.619,68 9.75,69 4.042,70 5.2}
{0 CHEMBL1964937,1 14.444,2 17.412,3 0.039,4 -0.11,5 0.49,6 0.074,7 3.558,8 3.558,11 1.526,12 11.667,13 1.937,14 3.752,15 104.771,16 7.397,17 0.533,18 3.997,19 4.12,20 3.557,21 3.539,22 5.1,23 3.522,24 4.522,25 4.691,26 3.899,27 3.946,28 5.588,29 3.898,30 4.789,31 5.002,32 3.954,33 4.079,34 5.776,35 4.001,36 4.85,37 5.066,38 3.904,39 4.051,40 5.914,41 3.969,42 4.878,43 5.119,44 3.827,45 3.985,46 5.986,47 3.887,48 4.795,49 5.052,50 3.693,51 3.895,52 5.762,53 3.787,54 4.69,55 4.945,56 3.555,57 3.785,58 5.691,59 3.67,60 4.532,61 4.792,62 3.392,63 3.637,64 5.524,65 3.508,66 0.039,67 0.737,68 10.103,69 4.255,70 5.2}
{0 CHEMBL1965131,1 14.937,2 17.631,3 0.103,4 0.194,5 0.44,7 3.759,8 3.759,11 1.878,12 8.833,13 4.585,14 21.023,15 97.706,16 10.536,17 0.615,18 3.703,19 3.784,20 3.596,21 3.424,22 4.959,23 3.375,24 4.162,25 4.259,26 4.053,27 3.836,28 5.48,29 3.76,30 4.386,31 4.487,32 4.304,33 3.946,34 5.726,35 3.862,36 4.438,37 4.578,38 4.18,39 3.875,40 5.767,41 3.774,42 4.329,43 4.482,44 4.084,45 3.705,46 5.694,47 3.65,48 4.229,49 4.334,50 4.072,51 3.656,52 5.951,53 3.628,54 4.251,55 4.376,56 3.923,57 3.652,58 5.764,59 3.562,60 4.079,61 4.238,62 3.56,63 3.504,64 5.341,65 3.362,66 0.101,67 0.464,68 2.989,69 2.698,70 5.2}
{0 CHEMBL1965423,1 7.489,2 4.198,3 0.033,4 -0.106,5 0.194,7 4.548,8 4.548,11 1.612,12 10,13 5.764,14 33.223,15 115.15,16 8.276,17 0.758,18 4.016,19 4.134,20 3.725,21 3.633,22 5.145,23 3.597,24 4.534,25 4.695,26 4.146,27 4.038,28 5.637,29 3.994,30 4.742,31 4.938,32 4.116,33 4.132,34 5.811,35 4.064,36 4.836,37 5.074,38 4.084,39 4.15,40 5.816,41 4.071,42 4.769,43 4.957,44 4.189,45 4.225,46 5.812,47 4.134,48 4.887,49 5.095,50 4.137,51 4.259,52 5.915,53 4.124,54 4.83,55 5.074,56 4.043,57 4.116,58 5.786,59 3.988,60 4.653,61 4.881,62 3.972,63 3.921,64 5.731,65 3.823,66 0.031,67 0.837,68 8.941,69 4.321,70 5.2}
{0 CHEMBL1965495,1 5.75,2 3.815,3 0.037,4 0.088,5 0.052,7 3.649,8 3.649,11 1.432,12 5.889,13 2.199,14 4.834,15 67.892,16 8.367,17 0.8,18 3.457,19 3.571,20 3.138,21 3.099,22 4.715,23 3.088,24 3.904,25 4.053,26 3.471,27 3.466,28 5.045,29 3.44,30 4.067,31 4.236,32 3.525,33 3.564,34 5.213,35 3.521,36 4.133,37 4.331,38 3.502,39 3.557,40 5.31,41 3.507,42 4.071,43 4.246,44 3.45,45 3.504,46 5.329,47 3.454,48 4.091,49 4.318,50 3.159,51 3.302,52 5.397,53 3.206,54 3.816,55 4.142,56 2.219,57 2.705,58 4.866,59 2.508,60 2.894,61 3.273,62 0.629,63 1.641,64 3.541,65 1.319,66 0.037,67 0.431,68 4.181,69 2.091,70 5.2}
{0 CHEMBL1965507,1 24.83,2 34.91,3 0.082,4 0.004,5 0.635,7 3.681,8 3.681,11 1.735,12 13.4,13 2.729,14 7.446,15 117.735,16 8.719,17 0.667,18 3.994,19 4.11,20 3.724,21 3.59,22 5.229,23 3.571,24 4.444,25 4.582,26 4.094,27 3.959,28 5.713,29 3.918,30 4.652,31 4.818,32 4.098,33 4.033,34 5.862,35 3.982,36 4.729,37 4.933,38 4.126,39 3.959,40 5.977,41 3.909,42 4.655,43 4.859,44 3.881,45 3.832,46 6.015,47 3.773,48 4.49,49 4.692,50 3.787,51 3.757,52 5.721,53 3.703,54 4.417,55 4.602,56 3.737,57 3.787,58 5.606,59 3.691,60 4.403,61 4.614,62 3.61,63 3.712,64 5.505,65 3.616,66 0.1,67 0.77,68 7.777,69 3.844,70 5.2}
{0 CHEMBL1965570,1 14.841,2 18.707,3 0.087,4 0.052,5 0.682,7 3.821,8 3.821,11 1.747,12 13.313,13 4.373,14 19.121,15 123.635,16 9.072,17 0.75,18 4.031,19 4.127,20 3.797,21 3.67,22 5.282,23 3.656,24 4.484,25 4.591,26 4.17,27 4.064,28 5.751,29 4.028,30 4.698,31 4.856,32 4.219,33 4.152,34 5.924,35 4.095,36 4.752,37 4.918,38 4.289,39 4.165,40 5.996,41 4.099,42 4.778,43 4.953,44 4.194,45 4.113,46 6.109,47 4.031,48 4.625,49 4.81,50 3.922,51 3.95,52 5.814,53 3.887,54 4.525,55 4.723,56 3.798,57 3.85,58 5.687,59 3.781,60 4.521,61 4.729,62 3.726,63 3.803,64 5.673,65 3.715,66 0.109,67 0.77,68 6.882,69 4.057,70 5.2}
{0 CHEMBL1965589,1 15.053,2 17.95,3 0.016,4 -0.167,5 0.538,7 3.942,8 3.942,11 1.735,12 10.067,13 3.218,14 10.356,15 106.995,16 8.509,17 0.647,18 4.02,19 4.134,20 3.694,21 3.547,22 5.231,23 3.569,24 4.518,25 4.679,26 4.076,27 3.898,28 5.763,29 3.915,30 4.738,31 4.927,32 4.126,33 3.988,34 6.006,35 3.995,36 4.759,37 4.976,38 4.128,39 3.99,40 6.089,41 3.992,42 4.696,43 4.883,44 4.145,45 4.035,46 5.914,47 4.025,48 4.753,49 4.939,50 4.197,51 4.076,52 6.058,53 4.073,54 4.818,55 5.011,56 4.113,57 4.056,58 6.105,59 4.028,60 4.808,61 5.053,62 3.862,63 3.872,64 6.039,65 3.8,66 0.148,67 0.923,68 7.543,69 3.984,70 5.2}
{0 CHEMBL1965631,1 18.24,2 26.806,3 -0.006,4 -0.003,5 0.471,6 0.163,7 3.878,8 3.878,11 1.567,12 12.214,13 2.788,14 7.774,15 109.563,16 7.663,17 0.677,18 4.008,19 4.146,20 3.607,21 3.514,22 5.155,23 3.509,24 4.508,25 4.699,26 3.939,27 3.893,28 5.587,29 3.872,30 4.683,31 4.878,32 3.902,33 3.988,34 5.76,35 3.92,36 4.812,37 5.082,38 3.884,39 3.925,40 5.816,41 3.852,42 4.635,43 4.857,44 3.83,45 3.794,46 5.813,47 3.771,48 4.545,49 4.776,50 3.788,51 3.766,52 5.618,53 3.723,54 4.496,55 4.72,56 3.711,57 3.74,58 5.58,59 3.686,60 4.488,61 4.725,62 3.515,63 3.722,64 5.498,65 3.619,66 0.106,67 0.811,68 9.624,69 3.918,70 5.7}
{0 CHEMBL1965660,1 9.189,2 6.774,3 0.128,4 0.088,5 0.407,7 3.845,8 3.845,11 1.844,12 8.435,13 3.299,14 10.88,15 89.973,16 10.241,17 0.68,18 3.67,19 3.781,20 3.483,21 3.274,22 4.975,23 3.279,24 4.096,25 4.215,26 3.905,27 3.66,28 5.485,29 3.643,30 4.311,31 4.453,32 3.968,33 3.769,34 5.602,35 3.728,36 4.329,37 4.477,38 4.072,39 3.745,40 5.679,41 3.702,42 4.357,43 4.54,44 3.855,45 3.718,46 5.598,47 3.657,48 4.321,49 4.506,50 3.894,51 3.59,52 5.772,53 3.555,54 4.203,55 4.39,56 3.713,57 3.469,58 5.548,59 3.404,60 4,61 4.191,62 3.593,63 3.228,64 5.556,65 3.157,66 0.14,67 0.532,68 3.247,69 2.272,70 7.1}
{0 CHEMBL1965836,1 16.206,2 16.1,3 0.04,4 0.014,5 0.803,7 3.816,8 3.816,9 9.743,10 2,11 1.746,12 13.625,13 5.332,14 28.431,15 114.669,16 8.349,17 0.629,18 4.095,19 4.205,20 3.739,21 3.607,22 5.3,23 3.624,24 4.632,25 4.773,26 4.182,27 3.982,28 6.281,29 3.986,30 4.789,31 4.968,32 4.06,33 4.106,34 5.9,35 4.056,36 4.905,37 5.13,38 4.032,39 4.084,40 6.01,41 4.022,42 4.859,43 5.076,44 4,45 4.01,46 6.054,47 3.968,48 4.817,49 5.033,50 3.972,51 3.942,52 6.01,53 3.903,54 4.789,55 5.026,56 3.814,57 3.841,58 5.938,59 3.793,60 4.626,61 4.851,62 3.82,63 3.753,64 5.953,65 3.711,66 0.195,67 0.984,68 8.79,69 4.893,70 5.9}
{0 CHEMBL1965845,1 19.002,2 23.993,3 0.005,4 -0.172,5 0.415,6 0.522,7 3.723,8 3.723,9 5.266,10 1,11 1.505,12 12.393,13 2.809,14 7.889,15 109.69,16 7.24,17 0.516,18 4.049,19 4.173,20 3.598,21 3.579,22 5.125,23 3.56,24 4.587,25 4.766,26 3.945,27 3.976,28 5.622,29 3.932,30 4.808,31 5.012,32 3.992,33 4.121,34 5.775,35 4.047,36 4.898,37 5.111,38 3.928,39 4.122,40 5.917,41 4.026,42 4.946,43 5.2,44 3.815,45 4.059,46 5.885,47 3.939,48 4.846,49 5.102,50 3.697,51 3.965,52 5.734,53 3.839,54 4.778,55 5.055,56 3.604,57 3.864,58 5.709,59 3.722,60 4.624,61 4.902,62 3.505,63 3.7,64 5.56,65 3.575,66 0.026,67 0.774,68 10.997,69 4.588,70 5.2}
{0 CHEMBL1965910,1 26.71,2 30.133,3 0.026,4 -0.134,5 0.378,7 3.714,8 3.714,9 6.106,10 1,11 1.397,12 13.514,13 5.249,14 27.548,15 141.865,16 6.877,17 0.55,18 4.315,19 4.445,20 3.835,21 3.872,22 5.295,23 3.836,24 4.896,25 5.08,26 4.2,27 4.308,28 5.8,29 4.242,30 5.195,31 5.432,32 4.237,33 4.458,34 5.995,35 4.351,36 5.254,37 5.505,38 4.231,39 4.478,40 6.061,41 4.357,42 5.279,43 5.537,44 4.194,45 4.492,46 6.058,47 4.358,48 5.235,49 5.492,50 4.18,51 4.445,52 6.055,53 4.318,54 5.177,55 5.435,56 4.134,57 4.378,58 6.048,59 4.253,60 5.118,61 5.374,62 4.022,63 4.318,64 5.932,65 4.188,66 0.066,67 1.019,68 15.424,69 6.308,70 5.2}
{0 CHEMBL1965988,1 22.195,2 27.362,3 0.109,4 0.151,5 0.232,7 3.74,8 3.74,11 1.587,12 13.742,13 3.728,14 13.894,15 127.847,16 8.222,17 0.647,18 4.051,19 4.172,20 3.734,21 3.686,22 5.249,23 3.646,24 4.501,25 4.649,26 4.083,27 4.066,28 5.688,29 3.995,30 4.7,31 4.873,32 4.145,33 4.175,34 5.829,35 4.088,36 4.755,37 4.945,38 4.183,39 4.165,40 5.893,41 4.068,42 4.751,43 4.947,44 4.032,45 4.094,46 5.909,47 3.989,48 4.693,49 4.908,50 3.935,51 3.994,52 5.844,53 3.895,54 4.593,55 4.799,56 3.744,57 3.909,58 5.692,59 3.805,60 4.515,61 4.743,62 3.644,63 3.829,64 5.569,65 3.702,66 0.057,67 0.776,68 9.537,69 4.279,70 5.2}
{0 CHEMBL1966035,1 16.158,2 24.622,3 0.046,4 -0.079,5 0.16,7 3.547,8 3.547,11 1.565,12 9.227,13 1.722,14 2.965,15 84.781,16 7.928,17 0.5,18 3.722,19 3.824,20 3.332,21 3.294,22 4.961,23 3.288,24 4.135,25 4.285,26 3.617,27 3.583,28 5.329,29 3.564,30 4.343,31 4.539,32 3.642,33 3.64,34 5.624,35 3.592,36 4.306,37 4.506,38 3.502,39 3.603,40 5.451,41 3.531,42 4.325,43 4.531,44 3.554,45 3.611,46 5.45,47 3.556,48 4.347,49 4.528,50 3.56,51 3.553,52 5.627,53 3.526,54 4.298,55 4.487,56 3.43,57 3.441,58 5.614,59 3.405,60 4.172,61 4.39,62 3.14,63 3.337,64 5.346,65 3.24,66 0.06,67 0.524,68 6.657,69 3.204,70 5.2}
{0 CHEMBL1966069,1 14.706,2 20.475,3 0.008,4 0.208,5 0.308,7 4.391,8 4.391,11 1.53,12 10.208,13 3.056,14 9.337,15 92.942,16 8.788,17 0.893,18 3.772,19 3.902,20 3.501,21 3.31,22 4.987,23 3.333,24 4.238,25 4.39,26 3.857,27 3.701,28 5.376,29 3.717,30 4.391,31 4.589,32 3.763,33 3.719,34 5.467,35 3.695,36 4.423,37 4.662,38 3.651,39 3.613,40 5.48,41 3.582,42 4.193,43 4.427,44 3.497,45 3.426,46 5.26,47 3.395,48 4.047,49 4.259,50 3.455,51 3.318,52 5.173,53 3.307,54 3.988,55 4.228,56 3.287,57 3.194,58 5.05,59 3.176,60 3.812,61 4.034,62 3.114,63 3.105,64 4.833,65 3.074,66 0.15,67 0.68,68 5.151,69 2.572,70 5.2}
{0 CHEMBL1966087,1 11.026,2 15.849,3 -0.003,4 -0.166,5 0.104,7 3.483,8 3.483,9 5.899,10 1,11 1.473,12 9.4,13 1.011,14 1.022,15 78.953,16 7.226,17 0.545,18 3.708,19 3.83,20 3.262,21 3.258,22 4.777,23 3.234,24 4.225,25 4.398,26 3.539,27 3.61,28 5.229,29 3.562,30 4.459,31 4.685,32 3.42,33 3.65,34 5.377,35 3.539,36 4.293,37 4.551,38 3.23,39 3.493,40 5.132,41 3.369,42 4.149,43 4.366,44 3.265,45 3.466,46 5.068,47 3.369,48 4.212,49 4.449,50 3.249,51 3.468,52 5.132,53 3.361,54 4.143,55 4.391,56 3.118,57 3.346,58 5.058,59 3.229,60 4.002,61 4.266,62 2.835,63 3.1,64 4.878,65 2.972,66 0.021,67 0.542,68 7.744,69 3.295,70 5.2}
{0 CHEMBL1966279,1 19.367,2 18.535,3 0.084,4 0.107,5 0.646,7 4.165,8 4.165,11 1.733,12 14.706,13 1.622,14 2.631,15 128.796,16 8.379,17 0.486,18 4.152,19 4.258,20 3.93,21 3.744,22 5.318,23 3.715,24 4.654,25 4.789,26 4.221,27 4.125,28 6.01,29 4.078,30 4.931,31 5.113,32 4.31,33 4.258,34 6.168,35 4.195,36 4.974,37 5.163,38 4.269,39 4.2,40 6.265,41 4.15,42 4.912,43 5.096,44 4.223,45 4.151,46 6.182,47 4.104,48 4.869,49 5.051,50 4.073,51 4.108,52 6.333,53 4.027,54 4.786,55 5.001,56 3.882,57 4.01,58 5.917,59 3.901,60 4.661,61 4.882,62 3.843,63 3.858,64 5.847,65 3.766,66 0.169,67 0.887,68 12.45,69 5.211,70 5.2}
{0 CHEMBL1966343,1 6.8,2 3.971,3 0.067,4 0.215,5 0.172,7 3.865,8 3.865,11 1.549,12 8,13 3.188,14 10.161,15 75.911,16 7.324,17 0.714,18 3.673,19 3.806,20 3.231,21 3.19,22 4.809,23 3.173,24 4.168,25 4.345,26 3.584,27 3.581,28 5.198,29 3.544,30 4.361,31 4.573,32 3.508,33 3.637,34 5.361,35 3.556,36 4.466,37 4.734,38 3.405,39 3.554,40 5.389,41 3.461,42 4.179,43 4.41,44 3.237,45 3.336,46 5.181,47 3.268,48 4.041,49 4.256,50 3.1,51 3.169,52 5.075,53 3.096,54 3.825,55 4.05,56 2.932,57 3.045,58 4.858,59 2.961,60 3.794,61 4.046,62 2.567,63 3.021,64 4.595,65 2.845,66 0.107,67 0.545,68 7.539,69 3.018,70 5.4}
{0 CHEMBL1966425,1 27.559,2 40.91,3 0.007,4 -0.156,5 0.388,6 0.473,7 4.279,8 4.279,9 5.984,10 1,11 1.524,12 13.758,13 4.112,14 16.909,15 127.198,16 7.501,17 0.595,18 4.188,19 4.301,20 3.77,21 3.726,22 5.278,23 3.716,24 4.722,25 4.889,26 4.132,27 4.118,28 5.796,29 4.091,30 4.919,31 5.105,32 4.125,33 4.226,34 5.935,35 4.164,36 4.992,37 5.22,38 4.06,39 4.199,40 5.95,41 4.115,42 4.91,43 5.127,44 4.046,45 4.133,46 5.925,47 4.06,48 4.897,49 5.112,50 3.958,51 4.11,52 5.874,53 4.034,54 4.791,55 4.994,56 3.89,57 4.081,58 5.797,59 3.991,60 4.813,61 5.036,62 3.822,63 4.045,64 5.773,65 3.931,66 0.027,67 0.86,68 11.857,69 5.27,70 5.2}
{0 CHEMBL1966514,1 16.513,2 22.779,3 0.087,4 0.052,5 0.551,7 3.819,8 3.819,11 1.747,12 13.344,13 4.373,14 19.121,15 123.635,16 9.072,17 0.75,18 4.031,19 4.127,20 3.797,21 3.67,22 5.282,23 3.656,24 4.484,25 4.591,26 4.17,27 4.064,28 5.76,29 4.028,30 4.697,31 4.856,32 4.195,33 4.152,34 5.89,35 4.092,36 4.744,37 4.913,38 4.289,39 4.166,40 5.981,41 4.094,42 4.776,43 4.952,44 4.162,45 4.113,46 5.991,47 4.03,48 4.628,49 4.811,50 3.963,51 3.951,52 5.948,53 3.889,54 4.525,55 4.723,56 3.767,57 3.851,58 5.657,59 3.775,60 4.51,61 4.721,62 3.72,63 3.804,64 5.621,65 3.71,66 0.109,67 0.77,68 6.882,69 4.057,70 5.2}
{0 CHEMBL1966524,1 8.592,2 7.94,3 0.068,4 0.032,5 0.21,7 4.439,8 4.439,9 5.959,10 1,11 1.564,12 12.621,13 3.582,14 12.83,15 116.579,16 8.174,17 0.788,18 4.011,19 4.119,20 3.711,21 3.658,22 5.129,23 3.616,24 4.507,25 4.644,26 4.088,27 4.071,28 5.555,29 4.001,30 4.733,31 4.915,32 4.085,33 4.151,34 5.737,35 4.04,36 4.772,37 4.991,38 3.945,39 4.08,40 5.674,41 3.948,42 4.668,43 4.892,44 3.849,45 3.946,46 5.619,47 3.837,48 4.651,49 4.87,50 3.77,51 3.895,52 5.66,53 3.792,54 4.638,55 4.893,56 3.667,57 3.822,58 5.573,59 3.701,60 4.422,61 4.632,62 3.633,63 3.72,64 5.405,65 3.609,66 0.034,67 0.71,68 9.126,69 4.308,70 5.7}
{0 CHEMBL1966628,1 12.649,2 20,3 0.058,4 -0.102,5 0.277,7 3.681,8 3.681,11 1.439,12 10,13 1.862,14 3.467,15 90.848,16 7.173,17 0.615,18 3.875,19 4.021,20 3.42,21 3.398,22 4.924,23 3.379,24 4.419,25 4.607,26 3.778,27 3.822,28 5.41,29 3.766,30 4.72,31 4.977,32 3.761,33 3.922,34 5.596,35 3.825,36 4.708,37 4.99,38 3.627,39 3.831,40 5.563,41 3.715,42 4.559,43 4.842,44 3.545,45 3.686,46 5.463,47 3.588,48 4.37,49 4.619,50 3.47,51 3.582,52 5.335,53 3.505,54 4.298,55 4.546,56 3.318,57 3.537,58 5.239,59 3.42,60 4.243,61 4.499,62 3.163,63 3.465,64 5.063,65 3.331,66 0.048,67 0.712,68 9.431,69 3.425,70 6.1}
{0 CHEMBL1966703,1 19.011,2 24.686,3 0.068,4 0.08,5 0.378,7 3.785,8 3.785,11 1.553,12 7.083,13 3.471,14 12.049,15 93.552,16 7.396,17 0.407,18 3.893,19 4.014,20 3.455,21 3.463,22 5.005,23 3.437,24 4.446,25 4.618,26 3.896,27 3.916,28 5.483,29 3.876,30 4.742,31 4.913,32 4.009,33 4.119,34 5.802,35 4.052,36 4.995,37 5.254,38 4.062,39 4.147,40 6.023,41 4.068,42 4.826,43 5.023,44 4.045,45 4.074,46 5.995,47 4.036,48 4.815,49 5.007,50 4.063,51 4.032,52 6.162,53 3.976,54 4.844,55 5.111,56 3.403,57 3.836,58 5.889,59 3.684,60 4.507,61 4.838,62 2.753,63 3.434,64 5.269,65 3.18,66 0.06,67 0.718,68 9.099,69 4.272,70 5.2}
{0 CHEMBL1966722,1 18.538,2 21.476,3 0.077,4 0.193,5 0.51,6 0.142,7 3.629,8 3.629,11 1.74,12 11.214,13 4.272,14 18.253,15 114.116,16 8.955,17 0.6,18 3.926,19 4.032,20 3.635,21 3.553,22 5.139,23 3.52,24 4.373,25 4.49,26 4.029,27 3.916,28 5.612,29 3.868,30 4.686,31 4.85,32 4.14,33 4.059,34 6.005,35 3.985,36 4.733,37 4.908,38 4.105,39 4.021,40 6.029,41 3.953,42 4.748,43 4.928,44 4.147,45 4.005,46 6.095,47 3.942,48 4.723,49 4.929,50 4.002,51 3.973,52 5.947,53 3.864,54 4.599,55 4.831,56 3.98,57 3.896,58 5.722,59 3.743,60 4.415,61 4.625,62 3.766,63 3.762,64 5.585,65 3.613,66 0.1,67 0.63,68 6.892,69 3.73,70 5.2}
{0 CHEMBL1966808,1 15.889,2 20.315,3 0.032,4 -0.053,5 0.296,7 3.979,8 3.979,11 1.733,12 8.391,13 2.887,14 8.333,15 86.049,16 8.984,17 0.593,18 3.753,19 3.858,20 3.545,21 3.387,22 4.864,23 3.362,24 4.298,25 4.442,26 3.993,27 3.832,28 5.41,29 3.781,30 4.507,31 4.693,32 4.011,33 3.924,34 5.575,35 3.839,36 4.465,37 4.646,38 3.997,39 3.817,40 5.583,41 3.751,42 4.299,43 4.497,44 3.751,45 3.614,46 5.386,47 3.575,48 4.218,49 4.416,50 3.571,51 3.529,52 5.321,53 3.493,54 4.191,55 4.375,56 3.462,57 3.461,58 5.404,59 3.391,60 3.949,61 4.126,62 3.17,63 3.272,64 5.122,65 3.134,66 0.067,67 0.611,68 5.415,69 3.05,70 5.2}
{0 CHEMBL1966816,1 17.805,2 25.064,3 0.029,4 -0.093,5 1.005,7 3.869,8 3.869,11 1.894,12 9.76,13 3.674,14 13.498,15 80.387,16 10.009,17 0.63,18 3.717,19 3.818,20 3.492,21 3.229,22 5.086,23 3.291,24 4.217,25 4.337,26 3.96,27 3.565,28 6.115,29 3.631,30 4.402,31 4.574,32 3.944,33 3.631,34 5.963,35 3.688,36 4.38,37 4.556,38 3.866,39 3.524,40 5.931,41 3.597,42 4.343,43 4.527,44 3.759,45 3.394,46 5.963,47 3.469,48 4.226,49 4.427,50 3.514,51 3.231,52 5.749,53 3.296,54 4.028,55 4.195,56 3.599,57 3.149,58 6.07,59 3.211,60 3.884,61 4.064,62 3.302,63 3.174,64 5.281,65 3.189,66 0.304,67 0.859,68 2.913,69 2.868,70 5.3}
{0 CHEMBL1967094,1 9.346,2 10.29,3 0.071,4 0.173,5 0.238,7 3.629,8 3.629,11 1.727,12 11.48,13 4.752,14 22.585,15 102.768,16 9.433,17 0.75,18 3.789,19 3.884,20 3.607,21 3.494,22 4.959,23 3.445,24 4.259,25 4.374,26 4.016,27 3.891,28 5.427,29 3.817,30 4.458,31 4.617,32 4.015,33 3.914,34 5.577,35 3.815,36 4.443,37 4.637,38 3.769,39 3.776,40 5.547,41 3.674,42 4.344,43 4.546,44 3.783,45 3.724,46 5.479,47 3.619,48 4.252,49 4.422,50 3.761,51 3.671,52 5.455,53 3.551,54 4.066,55 4.211,56 3.583,57 3.534,58 5.272,59 3.413,60 3.97,61 4.127,62 3.488,63 3.379,64 5.254,65 3.291,66 0.063,67 0.541,68 5.079,69 3.081,70 5.2}
{0 CHEMBL1967116,1 20.473,2 26.718,3 0.065,4 0.062,5 0.384,7 3.88,8 3.88,11 1.605,12 13.909,13 4.2,14 17.636,15 134.53,16 8.265,17 0.73,18 4.123,19 4.243,20 3.82,21 3.742,22 5.292,23 3.708,24 4.595,25 4.748,26 4.192,27 4.142,28 5.745,29 4.086,30 4.786,31 4.954,32 4.221,33 4.26,34 5.88,35 4.177,36 4.89,37 5.088,38 4.299,39 4.279,40 5.978,41 4.175,42 4.88,43 5.085,44 4.193,45 4.2,46 5.997,47 4.098,48 4.747,49 4.951,50 4.033,51 4.072,52 5.866,53 3.988,54 4.704,55 4.92,56 3.855,57 4.005,58 5.779,59 3.903,60 4.646,61 4.875,62 3.765,63 3.95,64 5.634,65 3.827,66 0.068,67 0.859,68 9.939,69 4.596,70 5.2}
{0 CHEMBL1967302,1 17.176,2 20.104,3 0.074,4 0.046,5 0.229,7 4.068,8 4.068,9 5.936,10 1,11 1.505,12 13.233,13 2.569,14 6.599,15 115.32,16 7.663,17 0.647,18 4.068,19 4.184,20 3.665,21 3.652,22 5.188,23 3.637,24 4.582,25 4.727,26 4.031,27 4.066,28 5.662,29 4.029,30 4.84,31 5.029,32 4.023,33 4.166,34 5.898,35 4.09,36 4.872,37 5.104,38 3.894,39 4.11,40 5.809,41 4.004,42 4.792,43 5.024,44 3.836,45 4.001,46 5.795,47 3.906,48 4.744,49 4.973,50 3.771,51 3.925,52 5.747,53 3.833,54 4.699,55 4.952,56 3.693,57 3.84,58 5.671,59 3.748,60 4.532,61 4.749,62 3.621,63 3.743,64 5.6,65 3.662,66 0.038,67 0.762,68 10.016,69 4.494,70 5.2}
{0 CHEMBL1967531,1 14.885,2 20.83,3 0.089,4 0.038,5 0.286,7 3.675,8 3.675,11 1.676,12 11.731,13 2.976,14 8.858,15 104.575,16 8.816,17 0.759,18 3.843,19 3.955,20 3.597,21 3.482,22 5.064,23 3.453,24 4.28,25 4.407,26 3.958,27 3.855,28 5.522,29 3.801,30 4.487,31 4.662,32 3.945,33 3.922,34 5.623,35 3.854,36 4.515,37 4.707,38 3.95,39 3.88,40 5.695,41 3.794,42 4.491,43 4.694,44 3.74,45 3.769,46 5.68,47 3.672,48 4.317,49 4.529,50 3.545,51 3.589,52 5.486,53 3.513,54 4.162,55 4.379,56 3.382,57 3.485,58 5.218,59 3.395,60 4.097,61 4.319,62 3.308,63 3.422,64 5.146,65 3.3,66 0.062,67 0.643,68 6.452,69 3.247,70 5.2}
{0 CHEMBL1967544,1 16.804,2 24.466,3 0.024,4 -0.146,5 0.651,7 4.365,8 4.365,11 1.587,12 12.333,13 3.511,14 12.326,15 145.007,16 7.9,17 0.7,18 4.242,19 4.351,20 3.986,21 3.859,22 5.336,23 3.814,24 4.762,25 4.923,26 4.307,27 4.262,28 5.961,29 4.204,30 5,31 5.165,32 4.48,33 4.481,34 6.087,35 4.389,36 5.17,37 5.349,38 4.538,39 4.531,40 6.328,41 4.437,42 5.242,43 5.432,44 4.495,45 4.521,46 6.497,47 4.433,48 5.201,49 5.41,50 4.384,51 4.487,52 6.314,53 4.373,54 5.169,55 5.386,56 4.315,57 4.441,58 6.257,59 4.322,60 5.165,61 5.397,62 4.191,63 4.34,64 6.277,65 4.238,66 0.083,67 0.952,68 14.706,69 5.855,70 5.2}
{0 CHEMBL1967560,1 45.066,2 77.376,3 -0.045,4 -0.342,5 1.092,6 0.8,7 3.964,8 3.964,9 5.617,10 1,11 1.556,12 14.237,13 3.201,14 10.244,15 147.504,16 6.878,17 0.286,18 4.426,19 4.568,20 3.93,21 3.864,22 5.433,23 3.849,24 5.026,25 5.239,26 4.312,27 4.283,28 5.981,29 4.244,30 5.3,31 5.536,32 4.439,33 4.468,34 6.248,35 4.407,36 5.401,37 5.648,38 4.448,39 4.502,40 6.397,41 4.44,42 5.403,43 5.64,44 4.458,45 4.532,46 6.474,47 4.462,48 5.377,49 5.609,50 4.349,51 4.528,52 6.366,53 4.428,54 5.404,55 5.679,56 4.187,57 4.437,58 6.3,59 4.31,60 5.256,61 5.535,62 4.114,63 4.302,64 6.143,65 4.186,66 0.048,67 1.18,68 17.784,69 6.219,70 5.2}
{0 CHEMBL1967564,1 8.052,2 10.484,3 0.037,4 0.028,5 0.252,7 3.942,8 3.942,11 1.571,12 8.316,13 2.361,14 5.573,15 69.818,16 7.707,17 0.714,18 3.614,19 3.743,20 3.215,21 3.163,22 4.754,23 3.153,24 4.113,25 4.284,26 3.563,27 3.534,28 5.236,29 3.499,30 4.324,31 4.544,32 3.56,33 3.564,34 5.418,35 3.518,36 4.261,37 4.493,38 3.436,39 3.443,40 5.39,41 3.396,42 4.104,43 4.313,44 3.312,45 3.292,46 5.324,47 3.262,48 3.997,49 4.224,50 3.129,51 3.185,52 5.106,53 3.124,54 3.901,55 4.155,56 2.823,57 3.05,58 4.899,59 2.948,60 3.752,61 4.011,62 2.567,63 2.885,64 4.764,65 2.752,66 0.053,67 0.526,68 6.303,69 2.72,70 5.2}
{0 CHEMBL1967720,1 24.903,2 35.532,3 0.087,4 0.072,5 0.695,6 0.148,7 4.036,8 4.036,11 1.759,12 15.474,13 3.569,14 12.735,15 146.818,16 8.543,17 0.643,18 4.247,19 4.366,20 3.949,21 3.83,22 5.483,23 3.813,24 4.725,25 4.869,26 4.357,27 4.236,28 5.985,29 4.203,30 4.986,31 5.153,32 4.439,33 4.377,34 6.227,35 4.329,36 5.132,37 5.335,38 4.483,39 4.422,40 6.385,41 4.345,42 5.095,43 5.316,44 4.331,45 4.341,46 6.241,47 4.242,48 4.866,49 5.064,50 4.2,51 4.191,52 6.126,53 4.122,54 4.828,55 5.019,56 4.204,57 4.208,58 5.978,59 4.124,60 4.926,61 5.137,62 4.211,63 4.225,64 6.087,65 4.122,66 0.15,67 1.051,68 10.45,69 5.204,70 5.2}
{0 CHEMBL1967878,1 36.662,2 58.849,3 0.024,4 -0.177,5 0.611,6 0.4,7 3.878,8 3.878,11 1.582,12 13.424,13 3.131,14 9.8,15 130.054,16 7.168,17 0.324,18 4.249,19 4.391,20 3.784,21 3.738,22 5.304,23 3.723,24 4.834,25 5.032,26 4.187,27 4.188,28 5.857,29 4.147,30 5.133,31 5.361,32 4.224,33 4.341,34 6.144,35 4.254,36 5.206,37 5.471,38 4.167,39 4.324,40 6.162,41 4.218,42 5.169,43 5.435,44 4.105,45 4.277,46 6.162,47 4.174,48 5.079,49 5.346,50 4.106,51 4.179,52 6.123,53 4.096,54 4.95,55 5.209,56 4.024,57 4.013,58 6.192,59 3.96,60 4.791,61 5.037,62 3.791,63 3.899,64 5.916,65 3.813,66 0.05,67 1.072,68 13.931,69 5.277,70 5.2}
{0 CHEMBL1967887,1 7.63,2 7.082,3 0.05,4 0.092,5 0.119,7 3.816,8 3.816,9 5.507,10 1,11 1.542,12 8.65,13 1.279,14 1.635,15 78.057,16 7.454,17 0.727,18 3.697,19 3.827,20 3.267,21 3.222,22 4.835,23 3.212,24 4.183,25 4.355,26 3.582,27 3.584,28 5.24,29 3.556,30 4.35,31 4.546,32 3.583,33 3.666,34 5.408,35 3.605,36 4.356,37 4.58,38 3.421,39 3.619,40 5.304,41 3.523,42 4.266,43 4.501,44 3.331,45 3.518,46 5.208,47 3.419,48 4.195,49 4.422,50 3.271,51 3.412,52 5.204,53 3.323,54 4.114,55 4.363,56 3.099,57 3.255,58 5.08,59 3.151,60 3.981,61 4.256,62 2.86,63 3.039,64 4.919,65 2.912,66 0.056,67 0.557,68 7.412,69 3.036,70 5.2}
{0 CHEMBL1968070,1 19.388,2 30.145,3 0.134,4 0.129,5 0.67,7 3.933,8 3.933,11 1.928,12 6.95,13 1.132,14 1.281,15 74.208,16 10.346,17 0.545,18 3.512,19 3.62,20 3.328,21 3.063,22 4.866,23 3.102,24 3.944,25 4.05,26 3.751,27 3.441,28 5.398,29 3.469,30 4.241,31 4.373,32 3.904,33 3.608,34 5.628,35 3.64,36 4.282,37 4.439,38 3.84,39 3.53,40 5.755,41 3.559,42 4.243,43 4.424,44 3.777,45 3.41,46 5.756,47 3.426,48 3.973,49 4.162,50 3.389,51 3.131,52 5.427,53 3.116,54 3.609,55 3.806,56 3.058,57 2.724,58 5.34,59 2.691,60 3.097,61 3.285,62 2.616,63 2.257,64 4.501,65 2.15,66 0.173,67 0.474,68 2.399,69 1.838,70 5.2}
{0 CHEMBL1968127,1 14.469,2 21.18,3 -0.047,4 -0.307,5 0.274,7 3.71,8 3.71,11 1.605,12 11.5,13 4.53,14 20.519,15 115.058,16 7.428,17 0.636,18 4.112,19 4.242,20 3.681,21 3.593,22 5.226,23 3.589,24 4.65,25 4.85,26 4.064,27 3.99,28 5.727,29 3.972,30 4.845,31 5.038,32 4.059,33 4.138,34 5.89,35 4.069,36 5.076,37 5.381,38 4.041,39 4.147,40 5.946,41 4.062,42 4.888,43 5.092,44 4.099,45 4.164,46 5.918,47 4.095,48 5.077,49 5.368,50 4.058,51 4.129,52 6.048,53 4.051,54 4.772,55 4.986,56 3.94,57 3.993,58 5.839,59 3.924,60 4.747,61 4.997,62 3.758,63 3.873,64 5.832,65 3.784,66 0.035,67 0.922,68 11.355,69 4.582,70 5.2}
{0 CHEMBL1968151,1 10.18,2 14.401,3 0.016,4 -0.091,5 0.255,7 3.768,8 3.768,11 1.843,12 7.158,13 1.504,14 2.261,15 68.741,16 10.358,17 0.727,18 3.466,19 3.559,20 3.372,21 3.104,22 4.72,23 3.103,24 3.925,25 4.035,26 3.776,27 3.484,28 5.224,29 3.474,30 4.035,31 4.179,32 3.699,33 3.459,34 5.335,35 3.445,36 3.978,37 4.137,38 3.691,39 3.301,40 5.336,41 3.327,42 3.779,43 3.968,44 3.356,45 3.116,46 5.049,47 3.103,48 3.491,49 3.62,50 3.067,51 2.961,52 4.791,53 2.934,54 3.508,55 3.642,56 3.053,57 2.969,58 4.801,59 2.892,60 3.463,61 3.67,62 2.741,63 2.737,64 4.662,65 2.553,66 0.101,67 0.472,68 2.08,69 1.896,70 5.2}
{0 CHEMBL1968245,1 8.957,2 7.515,3 0.044,4 -0.011,5 0.229,7 3.914,8 3.914,9 5.879,10 1,11 1.558,12 13.138,13 3.77,14 14.214,15 117.602,16 8.099,17 0.688,18 4.012,19 4.127,20 3.653,21 3.613,22 5.15,23 3.588,24 4.498,25 4.645,26 3.998,27 3.987,28 5.586,29 3.94,30 4.743,31 4.938,32 4.043,33 4.091,34 5.794,35 4.001,36 4.781,37 5.013,38 3.851,39 4.026,40 5.698,41 3.902,42 4.69,43 4.919,44 3.825,45 3.948,46 5.656,47 3.835,48 4.685,49 4.904,50 3.889,51 3.935,52 5.741,53 3.829,54 4.67,55 4.908,56 3.786,57 3.878,58 5.674,59 3.765,60 4.493,61 4.711,62 3.803,63 3.769,64 5.537,65 3.679,66 0.029,67 0.71,68 8.957,69 4.199,70 5.2}
{0 CHEMBL1968380,1 41.796,2 69.22,3 -0.029,4 -0.336,5 1.011,6 0.835,7 3.964,8 3.964,9 5.625,10 1,11 1.525,12 14.237,13 3.655,14 13.36,15 148.213,16 6.776,17 0.286,18 4.432,19 4.57,20 3.921,21 3.892,22 5.424,23 3.869,24 5.038,25 5.248,26 4.303,27 4.321,28 5.967,29 4.272,30 5.327,31 5.562,32 4.434,33 4.515,34 6.261,35 4.439,36 5.431,37 5.678,38 4.445,39 4.554,40 6.405,41 4.474,42 5.442,43 5.683,44 4.457,45 4.572,46 6.485,47 4.487,48 5.406,49 5.644,50 4.35,51 4.546,52 6.381,53 4.44,54 5.411,55 5.686,56 4.183,57 4.452,58 6.3,59 4.321,60 5.263,61 5.539,62 4.107,63 4.326,64 6.139,65 4.205,66 0.032,67 1.179,68 18.11,69 6.578,70 5.2}
{0 CHEMBL1968406,1 24.231,2 29.077,3 0.084,4 0.046,5 0.272,7 3.912,8 3.912,11 1.596,12 12.467,13 4.39,14 19.268,15 122.323,16 8.148,17 0.647,18 4.048,19 4.166,20 3.738,21 3.684,22 5.172,23 3.643,24 4.555,25 4.707,26 4.154,27 4.109,28 5.666,29 4.037,30 4.792,31 4.974,32 4.202,33 4.249,34 5.815,35 4.153,36 4.843,37 5.034,38 4.197,39 4.231,40 5.902,41 4.124,42 4.849,43 5.066,44 4.02,45 4.109,46 5.91,47 4.008,48 4.739,49 4.972,50 3.85,51 3.953,52 5.801,53 3.858,54 4.634,55 4.882,56 3.648,57 3.791,58 5.687,59 3.692,60 4.453,61 4.692,62 3.542,63 3.694,64 5.474,65 3.58,66 0.038,67 0.782,68 9.587,69 4.423,70 5.2}
{0 CHEMBL1968590,1 9.945,2 7.162,3 0.086,4 0.071,5 0.123,7 4.417,8 4.417,11 1.709,12 10.462,13 2.873,14 8.252,15 110.681,16 9.06,17 0.69,18 3.856,19 3.957,20 3.678,21 3.558,22 5.034,23 3.49,24 4.324,25 4.462,26 4.091,27 3.956,28 5.485,29 3.866,30 4.464,31 4.606,32 4.078,33 4.04,34 5.615,35 3.933,36 4.528,37 4.675,38 4.052,39 4.043,40 5.659,41 3.924,42 4.508,43 4.692,44 3.886,45 3.958,46 5.56,47 3.819,48 4.481,49 4.681,50 3.969,51 3.859,52 5.625,53 3.752,54 4.368,55 4.557,56 3.936,57 3.813,58 5.501,59 3.672,60 4.3,61 4.51,62 3.647,63 3.637,64 5.434,65 3.496,66 0.041,67 0.623,68 6.727,69 3.638,70 5.2}
{0 CHEMBL1968705,1 29.259,2 41.877,3 0.019,4 -0.089,5 0.66,6 0.4,7 4.363,8 4.363,9 6.138,10 1,11 1.509,12 14.2,13 5.568,14 31.003,15 154.244,16 7.338,17 0.6,18 4.394,19 4.522,20 3.958,21 3.932,22 5.454,23 3.914,24 4.938,25 5.116,26 4.308,27 4.328,28 5.961,29 4.286,30 5.19,31 5.416,32 4.311,33 4.426,34 6.156,35 4.351,36 5.178,37 5.421,38 4.281,39 4.373,40 6.152,41 4.298,42 5.124,43 5.346,44 4.292,45 4.357,46 6.161,47 4.294,48 5.087,49 5.296,50 4.314,51 4.422,52 6.074,53 4.358,54 5.138,55 5.334,56 4.384,57 4.506,58 6.179,59 4.429,60 5.234,61 5.457,62 4.355,63 4.514,64 6.183,65 4.425,66 0.063,67 1.129,68 15.222,69 6.371,70 5.2}
{0 CHEMBL1968791,1 25.723,2 26.054,3 0.026,4 -0.134,5 0.357,7 3.717,8 3.717,9 6.126,10 1,11 1.397,12 13.429,13 4.812,14 23.157,15 142.236,16 6.877,17 0.55,18 4.315,19 4.445,20 3.835,21 3.872,22 5.299,23 3.836,24 4.881,25 5.069,26 4.182,27 4.283,28 5.788,29 4.218,30 5.131,31 5.359,32 4.214,33 4.418,34 5.956,35 4.318,36 5.207,37 5.453,38 4.248,39 4.455,40 6.029,41 4.345,42 5.223,43 5.456,44 4.242,45 4.497,46 6.065,47 4.382,48 5.292,49 5.548,50 4.201,51 4.49,52 6.127,53 4.355,54 5.249,55 5.523,56 4.106,57 4.388,58 6.077,59 4.249,60 5.097,61 5.356,62 4.028,63 4.304,64 5.88,65 4.179,66 0.066,67 1.019,68 15.424,69 6.308,70 5.2}
{0 CHEMBL1968850,1 16.564,2 26.849,3 0.064,4 0.054,5 0.433,7 3.733,8 3.733,11 1.847,12 6.294,13 2.13,14 4.535,15 65.627,16 10.278,17 0.632,18 3.36,19 3.463,20 3.189,21 2.956,22 4.643,23 2.978,24 3.801,25 3.91,26 3.597,27 3.322,28 5.138,29 3.333,30 4.092,31 4.247,32 3.719,33 3.459,34 5.386,35 3.466,36 4.063,37 4.246,38 3.555,39 3.305,40 5.425,41 3.303,42 3.893,43 4.086,44 3.458,45 3.101,46 5.349,47 3.087,48 3.431,49 3.608,50 2.864,51 2.733,52 4.721,53 2.651,54 2.925,55 3.131,56 2.397,57 2.258,58 4.085,59 2.134,60 2.367,61 2.563,62 2.039,63 1.742,64 3.526,65 1.531,66 0.111,67 0.399,68 1.98,69 1.604,70 5.2}
{0 CHEMBL1968926,1 5.279,2 4.511,3 0.028,4 0.027,5 0.17,7 3.449,8 3.449,11 1.589,12 9.316,13 3.011,14 9.065,15 78.841,16 8.657,17 0.81,18 3.553,19 3.666,20 3.322,21 3.213,22 4.715,23 3.161,24 3.995,25 4.138,26 3.637,27 3.543,28 5.115,29 3.465,30 4.106,31 4.297,32 3.56,33 3.561,34 5.083,35 3.431,36 4.101,37 4.331,38 3.395,39 3.423,40 5.059,41 3.272,42 3.951,43 4.188,44 3.34,45 3.269,46 4.969,47 3.14,48 3.719,49 3.932,50 3.172,51 3.098,52 4.781,53 2.988,54 3.521,55 3.694,56 2.931,57 2.965,58 4.556,59 2.871,60 3.561,61 3.795,62 2.635,63 2.912,64 4.445,65 2.798,66 0.036,67 0.49,68 5.208,69 2.603,70 5.2}
{0 CHEMBL1969042,1 15.957,2 20.988,3 0.126,4 0.236,5 0.292,7 3.648,8 3.648,11 1.568,12 9.852,13 4.612,14 21.268,15 102.468,16 8.168,17 0.767,18 3.916,19 4.015,20 3.543,21 3.491,22 5.182,23 3.493,24 4.33,25 4.443,26 3.898,27 3.867,28 5.58,29 3.851,30 4.603,31 4.768,32 3.92,33 3.953,34 5.807,35 3.913,36 4.64,37 4.845,38 3.847,39 3.917,40 5.724,41 3.859,42 4.589,43 4.8,44 3.901,45 3.922,46 5.665,47 3.878,48 4.616,49 4.809,50 3.889,51 3.962,52 5.741,53 3.91,54 4.64,55 4.836,56 3.866,57 3.963,58 5.824,59 3.886,60 4.611,61 4.812,62 3.695,63 3.867,64 5.796,65 3.776,66 0.136,67 0.619,68 7.769,69 3.749,70 5.2}
{0 CHEMBL1969049,1 15.446,2 19.526,3 0.012,4 -0.066,5 0.282,7 3.725,8 3.725,9 5.248,10 1,11 1.414,12 11.538,13 3.837,14 14.72,15 103.05,16 7.218,17 0.643,18 3.941,19 4.055,20 3.482,21 3.529,22 5.067,23 3.494,24 4.438,25 4.606,26 3.798,27 3.886,28 5.51,29 3.832,30 4.644,31 4.823,32 3.876,33 4.042,34 5.696,35 3.964,36 4.763,37 4.966,38 3.823,39 4.06,40 5.809,41 3.954,42 4.823,43 5.056,44 3.761,45 4.026,46 5.847,47 3.902,48 4.754,49 4.999,50 3.583,51 3.894,52 5.745,53 3.762,54 4.586,55 4.853,56 3.486,57 3.729,58 5.599,59 3.604,60 4.415,61 4.657,62 3.389,63 3.608,64 5.443,65 3.497,66 0.027,67 0.635,68 9.745,69 4.49,70 5.2}
{0 CHEMBL1969102,1 17.311,2 24.218,3 0.096,4 0.145,5 0.394,7 3.819,8 3.819,11 1.624,12 13.344,13 3.994,14 15.949,15 129.634,16 8.472,17 0.75,18 4.075,19 4.193,20 3.791,21 3.705,22 5.266,23 3.675,24 4.532,25 4.671,26 4.156,27 4.107,28 5.707,29 4.05,30 4.732,31 4.899,32 4.184,33 4.211,34 5.827,35 4.129,36 4.824,37 5.017,38 4.278,39 4.228,40 5.94,41 4.132,42 4.837,43 5.037,44 4.16,45 4.157,46 5.977,47 4.056,48 4.694,49 4.905,50 3.94,51 3.991,52 5.821,53 3.912,54 4.589,55 4.801,56 3.767,57 3.888,58 5.7,59 3.802,60 4.559,61 4.795,62 3.698,63 3.856,64 5.561,65 3.739,66 0.084,67 0.818,68 8.95,69 4.226,70 5.2}
{0 CHEMBL1969126,1 9.58,2 6.987,3 -0.022,4 -0.063,5 0.487,7 4.486,8 4.486,11 1.737,12 9.25,13 5.24,14 27.458,15 100.768,16 8.823,17 0.781,18 3.925,19 4.03,20 3.641,21 3.467,22 5.161,23 3.493,24 4.438,25 4.583,26 4.061,27 3.865,28 5.673,29 3.891,30 4.629,31 4.813,32 4.079,33 3.949,34 5.859,35 3.96,36 4.681,37 4.883,38 4.082,39 3.962,40 6.029,41 3.96,42 4.621,43 4.793,44 4.027,45 3.979,46 5.796,47 3.962,48 4.661,49 4.834,50 4.062,51 3.958,52 5.925,53 3.942,54 4.655,55 4.856,56 3.969,57 3.85,58 5.887,59 3.836,60 4.522,61 4.747,62 3.805,63 3.649,64 5.803,65 3.64,66 0.151,67 0.829,68 5.913,69 3.661,70 5.2}
{0 CHEMBL1969190,1 22.454,2 30.042,3 0.07,4 0.026,5 0.868,7 3.819,8 3.819,9 5.267,10 1,11 1.806,12 12.6,13 3.882,14 15.072,15 107.307,16 8.922,17 0.667,18 3.978,19 4.077,20 3.675,21 3.497,22 5.297,23 3.532,24 4.434,25 4.553,26 4.049,27 3.861,28 5.798,29 3.889,30 4.65,31 4.798,32 4.103,33 3.961,34 5.979,35 3.979,36 4.705,37 4.87,38 4.127,39 3.948,40 6.153,41 3.954,42 4.715,43 4.902,44 3.935,45 3.887,46 6.015,47 3.873,48 4.64,49 4.846,50 3.849,51 3.762,52 6.096,53 3.733,54 4.423,55 4.632,56 3.568,57 3.606,58 5.589,59 3.564,60 4.339,61 4.556,62 3.58,63 3.53,64 5.567,65 3.489,66 0.242,67 0.816,68 6.412,69 3.841,70 5.2}
{0 CHEMBL1969264,1 9.101,2 18.192,3 0.039,4 -0.082,5 0.362,7 4.232,8 4.232,11 1.493,12 9.333,13 3.415,14 11.661,15 91.726,16 7.581,17 0.741,18 3.847,19 3.97,20 3.441,21 3.435,22 4.961,23 3.414,24 4.368,25 4.535,26 3.869,27 3.839,28 5.477,29 3.811,30 4.628,31 4.82,32 3.888,33 3.953,34 5.75,35 3.897,36 4.734,37 5.008,38 3.771,39 3.865,40 5.755,41 3.784,42 4.413,43 4.598,44 3.621,45 3.692,46 5.651,47 3.647,48 4.3,49 4.488,50 3.483,51 3.697,52 5.366,53 3.598,54 4.374,55 4.628,56 3.339,57 3.601,58 5.277,59 3.47,60 4.208,61 4.458,62 3.238,63 3.376,64 5.272,65 3.282,66 0.023,67 0.638,68 8.099,69 3.573,70 5.2}
{0 CHEMBL1969301,1 23.435,2 26.047,3 -0.004,4 -0.184,5 0.427,6 0.555,7 3.838,8 3.838,11 1.475,12 12.941,13 5.538,14 30.671,15 131.385,16 7.04,17 0.432,18 4.245,19 4.375,20 3.764,21 3.794,22 5.313,23 3.758,24 4.814,25 5.007,26 4.119,27 4.203,28 5.798,29 4.135,30 5.117,31 5.353,32 4.223,33 4.347,34 6.107,35 4.263,36 5.173,37 5.411,38 4.207,39 4.321,40 6.27,41 4.242,42 5.111,43 5.346,44 4.188,45 4.287,46 6.2,47 4.215,48 5.105,49 5.337,50 4.152,51 4.322,52 6.215,53 4.227,54 5.105,55 5.346,56 4.09,57 4.319,58 6.074,59 4.208,60 5.056,61 5.301,62 4.026,63 4.279,64 6.027,65 4.156,66 0.031,67 0.961,68 13.892,69 5.914,70 5.2}
{0 CHEMBL1969372,1 11,2 14.194,3 -0.043,4 -0.285,5 0.436,7 3.699,8 3.699,9 5.041,10 1,11 1.693,12 10.519,13 2.793,14 7.799,15 99.839,16 8.282,17 0.733,18 3.919,19 4.036,20 3.579,21 3.424,22 5.119,23 3.445,24 4.416,25 4.583,26 3.911,27 3.771,28 5.607,29 3.782,30 4.566,31 4.766,32 3.944,33 3.874,34 5.722,35 3.859,36 4.577,37 4.784,38 3.917,39 3.873,40 5.679,41 3.85,42 4.577,43 4.782,44 3.956,45 3.916,46 5.682,47 3.891,48 4.624,49 4.815,50 3.987,51 3.954,52 5.802,53 3.918,54 4.67,55 4.899,56 3.832,57 3.86,58 5.77,59 3.804,60 4.539,61 4.788,62 3.602,63 3.635,64 5.673,65 3.564,66 0.085,67 0.778,68 7.245,69 3.463,70 5.2}
{0 CHEMBL1969502,1 17.303,2 18.934,3 0.086,4 0.139,5 0.388,7 3.664,8 3.664,11 1.572,12 10.385,13 2.309,14 5.332,15 97.898,16 8.2,17 0.533,18 3.881,19 3.993,20 3.538,21 3.488,22 5.041,23 3.484,24 4.366,25 4.5,26 3.878,27 3.879,28 5.52,29 3.849,30 4.646,31 4.821,32 3.998,33 4.013,34 5.801,35 3.975,36 4.675,37 4.872,38 3.899,39 3.936,40 5.829,41 3.885,42 4.588,43 4.804,44 3.747,45 3.757,46 5.79,47 3.701,48 4.436,49 4.661,50 3.504,51 3.565,52 5.614,53 3.505,54 4.26,55 4.469,56 3.497,57 3.483,58 5.576,59 3.444,60 4.155,61 4.328,62 3.408,63 3.489,64 5.342,65 3.436,66 0.076,67 0.645,68 7.018,69 3.471,70 5.5}
{0 CHEMBL1969506,1 27.998,2 40.052,3 0.046,4 -0.016,5 1.058,6 0.262,7 4.538,8 4.538,9 5.35,10 1,11 1.803,12 14.743,13 1.885,14 3.553,15 132.181,16 8.579,17 0.421,18 4.183,19 4.28,20 3.972,21 3.723,22 5.371,23 3.715,24 4.694,25 4.829,26 4.287,27 4.072,28 6.134,29 4.069,30 4.931,31 5.078,32 4.284,33 4.193,34 6.299,35 4.156,36 5.039,37 5.266,38 4.21,39 4.144,40 6.276,41 4.098,42 4.899,43 5.091,44 4.088,45 4.024,46 6.209,47 4.013,48 4.758,49 4.926,50 4.1,51 4.054,52 6.015,53 4.028,54 4.809,55 4.967,56 4.056,57 4.063,58 6.149,59 4.005,60 4.829,61 5.057,62 3.937,63 3.941,64 6.042,65 3.86,66 0.22,67 0.907,68 12.126,69 5.348,70 5.2}
{0 CHEMBL1969523,1 26.523,2 45.402,3 0.018,4 -0.157,5 0.333,7 3.741,8 3.741,11 1.54,12 11.143,13 4.072,14 16.584,15 110.919,16 7.161,17 0.4,18 4.053,19 4.18,20 3.57,21 3.559,22 5.205,23 3.537,24 4.533,25 4.73,26 3.924,27 3.894,28 5.628,29 3.858,30 4.764,31 4.961,32 3.96,33 4.033,34 5.95,35 3.959,36 4.957,37 5.247,38 3.83,39 4.018,40 5.912,41 3.896,42 4.772,43 5.03,44 3.883,45 3.94,46 5.801,47 3.873,48 4.684,49 4.867,50 3.946,51 3.907,52 5.928,53 3.88,54 4.755,55 4.963,56 3.785,57 3.842,58 6.015,59 3.797,60 4.643,61 4.873,62 3.584,63 3.777,64 5.747,65 3.679,66 0.047,67 0.791,68 11.427,69 4.603,70 5.2}
{0 CHEMBL1969537,1 8.037,2 4.228,3 -0.071,4 -0.083,5 0.255,7 4.158,8 4.158,11 1.867,12 5.95,13 3.276,14 10.734,15 85.857,16 11.445,17 0.75,18 3.563,19 3.648,20 3.556,21 3.264,22 4.718,23 3.206,24 4.086,25 4.205,26 4.079,27 3.703,28 5.202,29 3.656,30 4.231,31 4.382,32 4.133,33 3.828,34 5.292,35 3.71,36 4.195,37 4.323,38 4.22,39 3.765,40 5.359,41 3.666,42 4.033,43 4.171,44 3.997,45 3.623,46 5.235,47 3.524,48 3.938,49 4.116,50 3.826,51 3.478,52 5.042,53 3.258,54 3.744,55 3.964,56 2.757,57 3.032,58 4.733,59 2.698,60 3.02,61 3.323,62 1.112,63 2.063,64 3.78,65 1.6,66 0.103,67 0.554,68 3.762,69 2.539,70 5.2}
{0 CHEMBL1969561,1 16.518,2 25.201,3 -0.007,4 0.034,5 0.398,7 4.193,8 4.193,11 1.527,12 9.214,13 3.618,14 13.093,15 111.315,16 7.49,17 0.677,18 4.017,19 4.15,20 3.6,21 3.551,22 5.146,23 3.533,24 4.53,25 4.718,26 3.954,27 3.935,28 5.57,29 3.905,30 4.73,31 4.93,32 3.995,33 4.059,34 5.778,35 3.998,36 4.886,37 5.117,38 4.022,39 4.047,40 6.015,41 3.985,42 4.824,43 5.066,44 3.995,45 3.98,46 5.908,47 3.947,48 4.738,49 4.932,50 4.048,51 4.03,52 5.896,53 4.007,54 4.855,55 5.076,56 3.96,57 4.099,58 5.933,59 4.02,60 4.85,61 5.084,62 3.808,63 4.108,64 5.851,65 3.972,66 0.086,67 0.802,68 10.034,69 4.269,70 5.2}
{0 CHEMBL1969588,1 11.313,2 17.755,3 0.038,4 -0.071,5 0.144,7 3.814,8 3.814,11 1.508,12 10.042,13 4.205,14 17.682,15 98.906,16 8.585,17 0.815,18 3.784,19 3.898,20 3.483,21 3.423,22 4.923,23 3.4,24 4.255,25 4.399,26 3.851,27 3.802,28 5.39,29 3.758,30 4.468,31 4.663,32 3.823,33 3.882,34 5.473,35 3.798,36 4.455,37 4.668,38 3.78,39 3.814,40 5.449,41 3.718,42 4.431,43 4.655,44 3.725,45 3.76,46 5.412,47 3.653,48 4.341,49 4.553,50 3.78,51 3.685,52 5.423,53 3.596,54 4.21,55 4.414,56 3.66,57 3.592,58 5.314,59 3.492,60 4.101,61 4.309,62 3.426,63 3.484,64 5.116,65 3.357,66 0.021,67 0.569,68 6.04,69 2.981,70 6.7}
{0 CHEMBL1969664,1 16.484,2 18.276,3 0.024,4 -0.141,5 0.283,6 0.172,7 3.682,8 3.682,9 5.367,10 1,11 1.571,12 10.76,13 2.417,14 5.842,15 94.054,16 7.777,17 0.571,18 3.885,19 3.994,20 3.493,21 3.43,22 5.037,23 3.428,24 4.417,25 4.576,26 3.837,27 3.831,28 5.476,29 3.809,30 4.651,31 4.842,32 3.874,33 3.972,34 5.69,35 3.909,36 4.712,37 4.954,38 3.794,39 3.937,40 5.746,41 3.843,42 4.611,43 4.841,44 3.723,45 3.819,46 5.696,47 3.75,48 4.485,49 4.707,50 3.562,51 3.698,52 5.602,53 3.614,54 4.343,55 4.599,56 3.333,57 3.476,58 5.486,59 3.374,60 4.006,61 4.219,62 3.115,63 3.238,64 5.091,65 3.157,66 0.049,67 0.644,68 8.155,69 3.711,70 5.2}
{0 CHEMBL1969735,1 12.213,2 15.508,3 -0.003,4 -0.216,5 0.408,7 3.783,8 3.783,11 1.76,12 10.733,13 4.172,14 17.405,15 114.578,16 8.538,17 0.667,18 4.033,19 4.15,20 3.708,21 3.567,22 5.225,23 3.568,24 4.543,25 4.711,26 4.118,27 3.959,28 5.727,29 3.948,30 4.789,31 4.974,32 4.217,33 4.108,34 5.967,35 4.066,36 4.962,37 5.221,38 4.14,39 4.096,40 6.029,41 4.033,42 4.724,43 4.935,44 4.137,45 4.056,46 5.806,47 4.017,48 4.765,49 4.956,50 4.262,51 4.109,52 6.042,53 4.078,54 4.785,55 4.978,56 4.144,57 4.097,58 5.944,59 4.019,60 4.739,61 4.972,62 3.953,63 3.888,64 5.902,65 3.799,66 0.11,67 0.848,68 8.148,69 4.091,70 5.2}
{0 CHEMBL1969755,1 10.264,2 9.598,3 0.049,4 0.002,5 0.454,7 3.597,8 3.597,11 1.56,12 11.5,13 3.005,14 9.032,15 98.061,16 7.787,17 0.643,18 3.894,19 4.001,20 3.483,21 3.485,22 5.099,23 3.465,24 4.376,25 4.521,26 3.796,27 3.847,28 5.564,29 3.804,30 4.665,31 4.865,32 3.87,33 3.967,34 5.811,35 3.9,36 4.72,37 4.932,38 3.847,39 3.906,40 6.022,41 3.836,42 4.679,43 4.893,44 3.781,45 3.845,46 5.962,47 3.783,48 4.621,49 4.841,50 3.732,51 3.761,52 5.869,53 3.709,54 4.541,55 4.759,56 3.628,57 3.612,58 5.983,59 3.572,60 4.292,61 4.502,62 3.406,63 3.463,64 5.566,65 3.413,66 0.052,67 0.668,68 8.185,69 4.166,70 5.2}
{0 CHEMBL1969843,1 9.057,2 5.988,3 0.007,4 0.12,5 0.334,7 3.845,8 3.845,9 5.391,10 1,11 1.572,12 9.381,13 2.023,14 4.091,15 82.577,16 7.457,17 0.625,18 3.776,19 3.907,20 3.368,21 3.278,22 4.829,23 3.272,24 4.335,25 4.51,26 3.693,27 3.696,28 5.292,29 3.665,30 4.553,31 4.784,32 3.582,33 3.778,34 5.398,35 3.677,36 4.576,37 4.858,38 3.466,39 3.658,40 5.388,41 3.544,42 4.38,43 4.665,44 3.359,45 3.438,46 5.242,47 3.361,48 4.11,49 4.34,50 3.289,51 3.296,52 5.135,53 3.243,54 4.012,55 4.26,56 3.087,57 3.169,58 4.949,59 3.087,60 3.781,61 3.992,62 2.828,63 3.137,64 4.559,65 3.011,66 0.092,67 0.624,68 8.027,69 3.355,70 5.2}
{0 CHEMBL1969879,1 16.238,2 21.865,3 -0.035,4 -0.413,5 0.539,6 0.129,7 3.209,8 3.209,11 1.602,12 7.955,13 0.854,14 0.73,15 84.36,16 7.056,17 0.417,18 3.867,19 4.005,20 3.383,21 3.298,22 4.937,23 3.293,24 4.441,25 4.649,26 3.746,27 3.718,28 5.431,29 3.685,30 4.699,31 4.922,32 3.846,33 3.904,34 5.735,35 3.834,36 4.854,37 5.104,38 3.792,39 3.973,40 5.772,41 3.871,42 4.915,43 5.19,44 3.686,45 3.964,46 5.799,47 3.83,48 4.83,49 5.108,50 3.618,51 3.867,52 5.743,53 3.737,54 4.683,55 4.947,56 3.469,57 3.681,58 5.728,59 3.56,60 4.484,61 4.783,62 3.083,63 3.343,64 5.51,65 3.206,66 0.051,67 0.668,68 9.793,69 3.318,70 5.2}
{0 CHEMBL1970074,1 18.603,2 25.872,3 0.064,4 0.034,5 0.764,7 3.869,8 3.869,11 1.717,12 12.267,13 4.91,14 24.108,15 108.208,16 8.733,17 0.667,18 3.979,19 4.092,20 3.661,21 3.544,22 5.222,23 3.557,24 4.486,25 4.622,26 4.111,27 3.923,28 6.171,29 3.927,30 4.67,31 4.843,32 4.066,33 4.032,34 5.937,35 4.011,36 4.779,37 4.985,38 4.042,39 3.998,40 6.073,41 3.975,42 4.706,43 4.903,44 3.956,45 3.909,46 6.072,47 3.879,48 4.657,49 4.889,50 3.721,51 3.793,52 5.857,53 3.733,54 4.479,55 4.71,56 3.679,57 3.618,58 6.038,59 3.553,60 4.281,61 4.514,62 3.482,63 3.484,64 5.456,65 3.433,66 0.172,67 0.92,68 6.72,69 4.072,70 5.2}
{0 CHEMBL1970083,1 19.296,2 24.778,3 0.086,4 0.007,5 1.122,7 3.996,8 3.996,11 1.842,12 14.919,13 5.061,14 25.61,15 134.938,16 9.695,17 0.683,18 4.133,19 4.231,20 3.932,21 3.751,22 5.436,23 3.755,24 4.621,25 4.735,26 4.377,27 4.142,28 6.312,29 4.135,30 4.823,31 4.972,32 4.413,33 4.265,34 6.184,35 4.24,36 4.928,37 5.097,38 4.456,39 4.275,40 6.3,41 4.239,42 4.922,43 5.1,44 4.386,45 4.226,46 6.361,47 4.171,48 4.827,49 5.011,50 4.257,51 4.087,52 6.421,53 4.055,54 4.688,55 4.87,56 4.102,57 3.97,58 6.28,59 3.938,60 4.661,61 4.874,62 3.923,63 3.931,64 5.918,65 3.866,66 0.247,67 1.11,68 5.819,69 4.583,70 5.2}
{0 CHEMBL1970104,1 6.063,2 5.882,3 0.052,4 0.066,5 0.154,7 4.365,8 4.365,11 1.369,12 8.636,13 4.743,14 22.499,15 87.891,16 7.26,17 0.8,18 3.797,19 3.929,20 3.364,21 3.391,22 4.865,23 3.358,24 4.315,25 4.491,26 3.778,27 3.814,28 5.316,29 3.769,30 4.538,31 4.727,32 3.765,33 3.936,34 5.532,35 3.844,36 4.715,37 4.993,38 3.649,39 3.874,40 5.586,41 3.748,42 4.497,43 4.77,44 3.457,45 3.682,46 5.35,47 3.561,48 4.267,49 4.518,50 3.358,51 3.513,52 5.213,53 3.431,54 4.124,55 4.356,56 3.095,57 3.424,58 5.012,59 3.303,60 3.949,61 4.2,62 2.938,63 3.249,64 4.753,65 3.112,66 0.065,67 0.617,68 8.343,69 3.484,70 5.2}
{0 CHEMBL1970142,1 26.286,2 33.219,3 0.059,4 0.03,5 0.496,6 0.247,7 3.92,8 3.92,11 1.643,12 16.553,13 3.85,14 14.824,15 151.902,16 8.088,17 0.643,18 4.28,19 4.404,20 3.946,21 3.864,22 5.451,23 3.834,24 4.768,25 4.93,26 4.321,27 4.261,28 5.917,29 4.209,30 4.987,31 5.165,32 4.395,33 4.392,34 6.128,35 4.324,36 5.102,37 5.296,38 4.455,39 4.433,40 6.275,41 4.345,42 5.107,43 5.329,44 4.342,45 4.367,46 6.209,47 4.264,48 4.946,49 5.164,50 4.169,51 4.242,52 6.023,53 4.156,54 4.883,55 5.093,56 4.165,57 4.228,58 5.958,59 4.13,60 4.924,61 5.137,62 4.162,63 4.21,64 6.033,65 4.106,66 0.091,67 1.024,68 12.264,69 5.526,70 5.2}
{0 CHEMBL1970189,1 14.014,2 15.265,3 0.087,4 0.209,5 0.312,7 3.772,8 3.772,9 5.397,10 1,11 1.749,12 5.95,13 2.655,14 7.049,15 76.815,16 9.25,17 0.5,18 3.576,19 3.682,20 3.318,21 3.17,22 4.849,23 3.171,24 4.044,25 4.171,26 3.723,27 3.573,28 5.232,29 3.554,30 4.263,31 4.399,32 3.863,33 3.731,34 5.442,35 3.697,36 4.404,37 4.576,38 3.892,39 3.778,40 5.705,41 3.728,42 4.358,43 4.537,44 3.891,45 3.723,46 5.653,47 3.678,48 4.286,49 4.462,50 3.875,51 3.526,52 5.796,53 3.479,54 4.093,55 4.367,56 2.559,57 3.019,58 5.243,59 2.813,60 3.373,61 3.77,62 0.798,63 2.001,64 3.951,65 1.625,66 0.097,67 0.473,68 4.098,69 2.35,70 5.2}
{0 CHEMBL1970203,1 27.256,2 39.769,3 0.076,4 0.001,5 0.628,7 3.819,8 3.819,11 1.711,12 13.516,13 3.215,14 10.336,15 122.776,16 8.481,17 0.647,18 4.046,19 4.165,20 3.752,21 3.637,22 5.261,23 3.613,24 4.508,25 4.657,26 4.129,27 4.011,28 5.747,29 3.966,30 4.706,31 4.868,32 4.138,33 4.101,34 5.905,35 4.044,36 4.823,37 5.037,38 4.18,39 4.046,40 6.027,41 3.986,42 4.739,43 4.937,44 3.924,45 3.93,46 6.069,47 3.858,48 4.658,49 4.898,50 3.845,51 3.846,52 5.811,53 3.773,54 4.5,55 4.685,56 3.775,57 3.834,58 5.71,59 3.742,60 4.469,61 4.687,62 3.666,63 3.779,64 5.545,65 3.681,66 0.089,67 0.81,68 8.823,69 4.188,70 5.2}
{0 CHEMBL1970217,1 15.446,2 19.526,3 0.012,4 -0.066,5 0.304,7 3.729,8 3.729,9 5.242,10 1,11 1.414,12 11.654,13 3.837,14 14.72,15 103.05,16 7.218,17 0.643,18 3.941,19 4.055,20 3.482,21 3.529,22 5.067,23 3.494,24 4.438,25 4.606,26 3.798,27 3.886,28 5.508,29 3.832,30 4.644,31 4.823,32 3.88,33 4.038,34 5.703,35 3.961,36 4.767,37 4.975,38 3.803,39 4.042,40 5.825,41 3.936,42 4.799,43 5.036,44 3.7,45 3.993,46 5.807,47 3.864,48 4.69,49 4.94,50 3.532,51 3.856,52 5.641,53 3.717,54 4.522,55 4.784,56 3.445,57 3.68,58 5.543,59 3.555,60 4.344,61 4.585,62 3.387,63 3.528,64 5.42,65 3.436,66 0.027,67 0.635,68 9.745,69 4.49,70 5.2}
{0 CHEMBL1970314,1 5.987,2 4.851,3 0.128,4 0.225,5 0.071,7 3.784,8 3.784,11 1.503,12 7.15,13 1.79,14 3.205,15 78.397,16 7.979,17 0.773,18 3.606,19 3.725,20 3.225,21 3.232,22 4.853,23 3.216,24 4.034,25 4.164,26 3.577,27 3.611,28 5.298,29 3.574,30 4.284,31 4.447,32 3.639,33 3.737,34 5.469,35 3.68,36 4.333,37 4.534,38 3.573,39 3.687,40 5.516,41 3.614,42 4.273,43 4.472,44 3.511,45 3.615,46 5.47,47 3.545,48 4.23,49 4.437,50 3.319,51 3.474,52 5.465,53 3.39,54 4.127,55 4.383,56 3.073,57 3.24,58 5.27,59 3.141,60 3.814,61 4.071,62 2.731,63 2.867,64 5.138,65 2.749,66 0.04,67 0.476,68 5.731,69 2.609,70 5.2}
{0 CHEMBL1970317,1 19.675,2 25.279,3 0.071,4 0.041,5 0.522,7 3.88,8 3.88,11 1.734,12 13.909,13 3.919,14 15.357,15 129.706,16 8.818,17 0.73,18 4.084,19 4.197,20 3.827,21 3.698,22 5.312,23 3.68,24 4.548,25 4.687,26 4.205,27 4.094,28 5.795,29 4.057,30 4.753,31 4.919,32 4.232,33 4.199,34 5.939,35 4.138,36 4.815,37 4.997,38 4.309,39 4.214,40 6.018,41 4.132,42 4.822,43 5.016,44 4.194,45 4.146,46 6.01,47 4.062,48 4.684,49 4.87,50 4.054,51 4.024,52 5.989,53 3.955,54 4.647,55 4.861,56 3.855,57 3.964,58 5.74,59 3.87,60 4.601,61 4.821,62 3.786,63 3.892,64 5.69,65 3.789,66 0.114,67 0.89,68 8.018,69 4.269,70 5.2}
{0 CHEMBL1970340,1 5.319,2 3.663,3 0.129,4 0.287,5 0.164,7 3.7,8 3.7,11 1.595,12 5.882,13 2.527,14 6.388,15 65.672,16 8.38,17 0.842,18 3.451,19 3.544,20 3.111,21 3.033,22 4.737,23 3.041,24 3.858,25 3.962,26 3.464,27 3.406,28 5.101,29 3.4,30 4.073,31 4.223,32 3.462,33 3.471,34 5.273,35 3.441,36 4.083,37 4.256,38 3.362,39 3.405,40 5.228,41 3.362,42 3.992,43 4.175,44 3.208,45 3.28,46 5.178,47 3.225,48 3.959,49 4.178,50 2.99,51 3.057,52 5.117,53 2.995,54 3.675,55 3.923,56 2.607,57 2.54,58 5.038,59 2.465,60 3.033,61 3.327,62 0.879,63 1.695,64 4.007,65 1.482,66 0.113,67 0.377,68 4.507,69 2.252,70 5.2}
{0 CHEMBL1970369,1 10.86,2 11.437,3 0.05,4 0.072,5 0.497,7 3.936,8 3.936,11 1.694,12 10.24,13 1.19,14 1.415,15 90.581,16 8.081,17 0.536,18 3.881,19 3.998,20 3.513,21 3.383,22 5.072,23 3.396,24 4.407,25 4.563,26 3.885,27 3.802,28 5.565,29 3.793,30 4.672,31 4.868,32 3.89,33 3.9,34 5.796,35 3.856,36 4.746,37 4.965,38 3.828,39 3.818,40 5.939,41 3.776,42 4.556,43 4.784,44 3.674,45 3.648,46 5.685,47 3.619,48 4.405,49 4.59,50 3.641,51 3.489,52 5.812,53 3.494,54 4.232,55 4.427,56 3.469,57 3.338,58 5.521,59 3.343,60 4.043,61 4.212,62 3.292,63 3.269,64 5.319,65 3.238,66 0.158,67 0.673,68 7.628,69 3.474,70 5.2}
{0 CHEMBL1970522,1 14.539,2 15.157,3 0.051,4 -0.009,5 0.291,6 0.624,7 3.673,8 3.673,9 5.067,10 1,11 1.708,12 10.087,13 3.496,14 12.219,15 91.11,16 8.822,17 0.48,18 3.732,19 3.814,20 3.483,21 3.353,22 4.974,23 3.326,24 4.172,25 4.283,26 3.866,27 3.692,28 5.42,29 3.649,30 4.333,31 4.473,32 3.83,33 3.719,34 5.614,35 3.659,36 4.295,37 4.466,38 3.711,39 3.645,40 5.487,41 3.551,42 4.266,43 4.437,44 3.704,45 3.654,46 5.424,47 3.542,48 4.224,49 4.393,50 3.638,51 3.549,52 5.441,53 3.464,54 4.109,55 4.291,56 3.499,57 3.326,58 5.426,59 3.281,60 3.886,61 4.028,62 3.212,63 3.176,64 5.351,65 3.113,66 0.08,67 0.499,68 5.92,69 3.374,70 5.2}
{0 CHEMBL1970709,1 13.592,2 17.987,3 0.059,4 0.103,5 0.261,7 3.616,8 3.616,11 1.714,12 10.238,13 2.922,14 8.538,15 84.964,16 10.154,17 0.696,18 3.651,19 3.771,20 3.481,21 3.252,22 4.828,23 3.233,24 4.111,25 4.255,26 3.879,27 3.635,28 5.309,29 3.582,30 4.324,31 4.51,32 3.833,33 3.695,34 5.408,35 3.593,36 4.322,37 4.558,38 3.55,39 3.495,40 5.394,41 3.388,42 4.116,43 4.361,44 3.43,45 3.253,46 5.261,47 3.186,48 3.964,49 4.157,50 3.445,51 3.183,52 5.219,53 3.132,54 3.889,55 4.093,56 3.347,57 3.159,58 5.148,59 3.079,60 3.743,61 3.935,62 3.491,63 3.144,64 4.84,65 3.046,66 0.078,67 0.526,68 3.619,69 2.638,70 5.2}
{0 CHEMBL1970735,1 15.702,2 22.096,3 -0.011,4 -0.157,5 0.304,6 0.149,7 3.04,8 3.04,9 5.315,10 1,11 1.685,12 7.059,13 0.866,14 0.751,15 63.784,16 7.558,17 0.353,18 3.514,19 3.646,20 3.055,21 2.945,22 4.781,23 2.954,24 3.988,25 4.178,26 3.348,27 3.227,28 5.199,29 3.213,30 4.168,31 4.375,32 3.405,33 3.282,34 5.422,35 3.289,36 4.133,37 4.347,38 3.438,39 3.246,40 5.586,41 3.237,42 4.036,43 4.228,44 3.192,45 3.21,46 5.303,47 3.186,48 4.04,49 4.257,50 3.134,51 3.19,52 5.394,53 3.116,54 4.048,55 4.3,56 2.759,57 3.053,58 5.267,59 2.931,60 3.867,61 4.174,62 2.271,63 2.731,64 5.14,65 2.537,66 0.074,67 0.45,68 6.178,69 2.312,70 5.2}
{0 CHEMBL1970806,1 15.889,2 20.315,3 0.032,4 -0.053,5 0.253,7 3.979,8 3.979,11 1.733,12 8.391,13 2.887,14 8.333,15 86.049,16 8.984,17 0.593,18 3.753,19 3.858,20 3.545,21 3.387,22 4.864,23 3.362,24 4.298,25 4.442,26 3.993,27 3.832,28 5.409,29 3.781,30 4.507,31 4.692,32 4.014,33 3.92,34 5.58,35 3.835,36 4.468,37 4.656,38 4,39 3.807,40 5.599,41 3.742,42 4.269,43 4.458,44 3.747,45 3.603,46 5.351,47 3.568,48 4.22,49 4.419,50 3.571,51 3.521,52 5.33,53 3.489,54 4.199,55 4.389,56 3.475,57 3.444,58 5.447,59 3.377,60 3.901,61 4.074,62 3.163,63 3.243,64 5.019,65 3.117,66 0.067,67 0.611,68 5.415,69 3.05,70 5.2}
{0 CHEMBL1970879,1 35.77,2 42.239,3 -0.003,4 -0.209,5 0.937,6 0.8,7 4.587,8 4.587,9 5.743,10 1,11 1.558,12 17.304,13 3.775,14 14.253,15 177.706,16 7.316,17 0.5,18 4.553,19 4.684,20 4.114,21 4.052,22 5.618,23 4.042,24 5.127,25 5.317,26 4.51,27 4.481,28 6.135,29 4.453,30 5.399,31 5.611,32 4.624,33 4.678,34 6.379,35 4.622,36 5.536,37 5.758,38 4.618,39 4.749,40 6.529,41 4.664,42 5.607,43 5.867,44 4.535,45 4.728,46 6.554,47 4.619,48 5.511,49 5.768,50 4.519,51 4.657,52 6.44,53 4.562,54 5.442,55 5.679,56 4.496,57 4.615,58 6.417,59 4.533,60 5.435,61 5.672,62 4.447,63 4.602,64 6.407,65 4.511,66 0.065,67 1.354,68 18.125,69 7.221,70 5.2}
{0 CHEMBL1970903,1 11.017,2 9.41,3 0.07,4 0.106,5 0.21,7 4.474,8 4.474,9 5.971,10 1,11 1.47,12 12.733,13 3.506,14 12.29,15 118.181,16 7.5,17 0.765,18 4.084,19 4.209,20 3.668,21 3.66,22 5.193,23 3.641,24 4.588,25 4.746,26 4.023,27 4.064,28 5.621,29 4.026,30 4.818,31 5.012,32 4.032,33 4.171,34 5.83,35 4.093,36 4.904,37 5.142,38 3.899,39 4.137,40 5.807,41 4.026,42 4.807,43 5.047,44 3.828,45 4.036,46 5.733,47 3.926,48 4.781,49 5.017,50 3.797,51 3.965,52 5.756,53 3.866,54 4.723,55 4.979,56 3.697,57 3.872,58 5.66,59 3.768,60 4.578,61 4.823,62 3.616,63 3.777,64 5.528,65 3.676,66 0.074,67 0.805,68 10.661,69 4.55,70 6}
{0 CHEMBL1970913,1 14.557,2 19.474,3 -0.005,4 -0.089,5 0.342,7 4.037,8 4.037,11 1.588,12 8.435,13 3.159,14 9.979,15 86.763,16 7.57,17 0.6,18 3.812,19 3.936,20 3.392,21 3.346,22 4.947,23 3.332,24 4.336,25 4.515,26 3.759,27 3.71,28 5.457,29 3.677,30 4.564,31 4.782,32 3.836,33 3.766,34 5.751,35 3.743,36 4.509,37 4.713,38 3.795,39 3.706,40 5.77,41 3.698,42 4.42,43 4.608,44 3.734,45 3.676,46 5.658,47 3.661,48 4.437,49 4.628,50 3.661,51 3.68,52 5.647,53 3.643,54 4.432,55 4.639,56 3.517,57 3.641,58 5.693,59 3.568,60 4.436,61 4.661,62 3.245,63 3.57,64 5.55,65 3.441,66 0.051,67 0.629,68 7.969,69 3.551,70 5.2}
{0 CHEMBL1971017,1 4.452,2 3.014,3 0.104,4 0.096,5 0.213,7 3.734,8 3.734,11 1.813,12 7.105,13 2.559,14 6.547,15 72.996,16 9.726,17 0.762,18 3.472,19 3.556,20 3.316,21 3.182,22 4.775,23 3.146,24 3.908,25 4.005,26 3.728,27 3.578,28 5.287,29 3.518,30 4.104,31 4.227,32 3.763,33 3.615,34 5.423,35 3.552,36 4.073,37 4.225,38 3.577,39 3.525,40 5.344,41 3.454,42 4.013,43 4.196,44 3.472,45 3.411,46 5.265,47 3.339,48 3.936,49 4.098,50 3.429,51 3.254,52 5.437,53 3.191,54 3.716,55 3.923,56 3.093,57 2.871,58 5.11,59 2.804,60 3.28,61 3.498,62 2.308,63 2.269,64 4.693,65 2.223,66 0.073,67 0.446,68 3.148,69 2.307,70 5.2}
{0 CHEMBL1971021,1 28.774,2 43.022,3 0.061,4 -0.001,5 0.901,6 0.473,7 3.919,8 3.919,11 1.701,12 11.813,13 4.918,14 24.183,15 115.715,16 8.451,17 0.514,18 4.065,19 4.175,20 3.717,21 3.632,22 5.281,23 3.637,24 4.6,25 4.746,26 4.183,27 4.032,28 6.237,29 4.025,30 4.791,31 4.949,32 4.169,33 4.173,34 6.044,35 4.14,36 4.932,37 5.131,38 4.227,39 4.154,40 6.229,41 4.133,42 4.92,43 5.107,44 4.21,45 4.089,46 6.342,47 4.084,48 4.95,49 5.186,50 4.159,51 3.983,52 6.306,53 3.991,54 4.806,55 5,56 4.121,57 3.777,58 6.575,59 3.832,60 4.544,61 4.757,62 3.783,63 3.644,64 6.176,65 3.638,66 0.155,67 0.958,68 8.065,69 4.734,70 5.2}
{0 CHEMBL1971029,1 35.803,2 56.529,3 -0.021,4 -0.326,5 0.977,6 0.555,7 3.98,8 3.98,9 5.536,10 1,11 1.833,12 13.973,13 3.428,14 11.753,15 145.845,16 9.086,17 0.45,18 4.284,19 4.397,20 4.118,21 3.804,22 5.38,23 3.779,24 4.828,25 5.002,26 4.464,27 4.18,28 6.076,29 4.141,30 5.047,31 5.227,32 4.637,33 4.353,34 6.192,35 4.297,36 5.149,37 5.331,38 4.497,39 4.399,40 6.328,41 4.313,42 5.218,43 5.454,44 4.528,45 4.391,46 6.282,47 4.29,48 5.135,49 5.377,50 4.688,51 4.364,52 6.173,53 4.251,54 5.029,55 5.226,56 4.742,57 4.28,58 6.192,59 4.219,60 5.003,61 5.199,62 4.512,63 4.236,64 6.186,65 4.146,66 0.166,67 1.035,68 12.737,69 5.799,70 5.2}
{0 CHEMBL1971141,1 16.973,2 24.07,3 0.079,4 0.114,5 0.246,7 3.664,8 3.664,11 1.498,12 11.846,13 3.53,14 12.459,15 101.249,16 7.676,17 0.643,18 3.891,19 4.011,20 3.47,21 3.487,22 5.097,23 3.465,24 4.34,25 4.485,26 3.806,27 3.849,28 5.596,29 3.799,30 4.594,31 4.773,32 3.816,33 3.962,34 5.753,35 3.889,36 4.65,37 4.872,38 3.741,39 3.887,40 5.788,41 3.799,42 4.587,43 4.812,44 3.653,45 3.776,46 5.765,47 3.702,48 4.456,49 4.685,50 3.538,51 3.66,52 5.619,53 3.581,54 4.323,55 4.533,56 3.388,57 3.556,58 5.516,59 3.478,60 4.25,61 4.487,62 3.289,63 3.482,64 5.326,65 3.381,66 0.039,67 0.63,68 8.361,69 3.791,70 5.2}
{0 CHEMBL1971149,1 17.322,2 21.88,3 -0.003,4 -0.186,5 0.628,7 3.942,8 3.942,11 1.776,12 10.875,13 3.995,14 15.962,15 113.463,16 8.432,17 0.629,18 4.076,19 4.19,20 3.731,21 3.582,22 5.339,23 3.603,24 4.582,25 4.748,26 4.146,27 3.968,28 5.9,29 3.984,30 4.83,31 5.002,32 4.25,33 4.109,34 6.138,35 4.116,36 5.005,37 5.228,38 4.205,39 4.104,40 6.369,41 4.096,42 4.82,43 5.029,44 4.181,45 4.101,46 5.986,47 4.082,48 4.832,49 5.019,50 4.281,51 4.129,52 6.218,53 4.13,54 4.883,55 5.074,56 4.192,57 4.129,58 6.195,59 4.104,60 4.897,61 5.135,62 3.965,63 3.969,64 6.159,65 3.905,66 0.172,67 0.955,68 8.286,69 4.313,70 5.2}
{0 CHEMBL1971186,1 17.439,2 30.662,3 -0.003,4 -0.225,5 0.435,7 3.711,8 3.711,11 1.668,12 10.607,13 3.052,14 9.313,15 103.571,16 8.052,17 0.656,18 3.996,19 4.117,20 3.639,21 3.506,22 5.122,23 3.521,24 4.535,25 4.702,26 4.016,27 3.911,28 5.665,29 3.902,30 4.774,31 5.007,32 3.985,33 3.997,34 5.788,35 3.951,36 4.73,37 4.972,38 3.936,39 3.936,40 5.735,41 3.891,42 4.669,43 4.887,44 4.01,45 3.941,46 5.736,47 3.924,48 4.664,49 4.851,50 4.001,51 3.954,52 5.828,53 3.93,54 4.659,55 4.869,56 3.838,57 3.882,58 5.723,59 3.817,60 4.582,61 4.826,62 3.676,63 3.729,64 5.667,65 3.653,66 0.081,67 0.837,68 8.466,69 3.812,70 5.2}
{0 CHEMBL1971245,1 24.418,2 40.887,3 -0.011,4 -0.318,5 0.436,6 0.4,7 3.776,8 3.776,11 1.556,12 12.531,13 3.213,14 10.325,15 122.951,16 7.653,17 0.611,18 4.147,19 4.283,20 3.747,21 3.648,22 5.268,23 3.65,24 4.671,25 4.861,26 4.117,27 4.04,28 5.782,29 4.026,30 4.905,31 5.119,32 4.157,33 4.202,34 5.942,35 4.149,36 4.977,37 5.213,38 4.137,39 4.217,40 5.966,41 4.139,42 4.969,43 5.218,44 4.129,45 4.176,46 6.031,47 4.111,48 4.893,49 5.115,50 4.076,51 4.105,52 6.04,53 4.051,54 4.844,55 5.094,56 3.861,57 3.995,58 5.896,59 3.898,60 4.705,61 4.977,62 3.725,63 3.851,64 5.639,65 3.77,66 0.046,67 0.936,68 11.039,69 4.228,70 5.2}
{0 CHEMBL1971430,1 18.954,2 20.542,3 0.03,4 -0.078,5 0.331,6 0.204,7 3.586,8 3.586,11 1.439,12 11.844,13 3.316,14 10.998,15 127.827,16 7.213,17 0.514,18 4.156,19 4.287,20 3.697,21 3.727,22 5.268,23 3.694,24 4.66,25 4.842,26 4.033,27 4.11,28 5.704,29 4.052,30 4.917,31 5.122,32 4.131,33 4.261,34 5.953,35 4.182,36 5.039,37 5.281,38 4.132,39 4.256,40 6.092,41 4.174,42 5.005,43 5.218,44 4.202,45 4.288,46 6.095,47 4.219,48 5.093,49 5.314,50 4.204,51 4.325,52 6.179,53 4.25,54 5.138,55 5.38,56 4.06,57 4.315,58 6.194,59 4.195,60 5.071,61 5.341,62 3.856,63 4.222,64 5.957,65 4.064,66 0.051,67 0.873,68 12.209,69 5.103,70 5.2}
{0 CHEMBL1971649,1 17.267,2 22.095,3 0.07,4 -0.006,5 0.555,7 3.891,8 3.891,11 1.623,12 12.552,13 3.451,14 11.907,15 108.978,16 8.244,17 0.719,18 3.966,19 4.086,20 3.61,21 3.546,22 5.209,23 3.546,24 4.422,25 4.568,26 3.976,27 3.916,28 5.677,29 3.899,30 4.671,31 4.846,32 4.061,33 4.036,34 5.938,35 4.007,36 4.732,37 4.942,38 3.956,39 3.987,40 5.955,41 3.936,42 4.704,43 4.921,44 3.867,45 3.893,46 6.045,47 3.837,48 4.603,49 4.848,50 3.655,51 3.754,52 5.764,53 3.685,54 4.377,55 4.596,56 3.564,57 3.636,58 5.548,59 3.579,60 4.295,61 4.507,62 3.505,63 3.575,64 5.493,65 3.515,66 0.079,67 0.784,68 7.705,69 3.747,70 5.2}
{0 CHEMBL1971694,1 16.976,2 27.733,3 -0.012,4 -0.241,5 0.37,7 3.611,8 3.611,11 1.863,12 9,13 3.052,14 9.315,15 77.64,16 8.305,17 0.55,18 3.631,19 3.752,20 3.423,21 3.149,22 4.754,23 3.121,24 4.133,25 4.319,26 3.616,27 3.463,28 5.392,29 3.407,30 4.328,31 4.581,32 3.555,33 3.444,34 5.423,35 3.372,36 4.262,37 4.519,38 3.429,39 3.396,40 5.338,41 3.286,42 4.165,43 4.401,44 3.493,45 3.379,46 5.271,47 3.28,48 4.106,49 4.304,50 3.478,51 3.359,52 5.307,53 3.263,54 4.056,55 4.253,56 3.298,57 3.235,58 5.341,59 3.129,60 3.939,61 4.164,62 3.03,63 3,64 5.212,65 2.881,66 0.101,67 0.613,68 8.266,69 2.865,70 5.2}
{0 CHEMBL1971801,1 14.962,2 26.208,3 0.058,4 0.045,5 0.299,7 3.697,8 3.697,11 1.666,12 5.75,13 1.256,14 1.577,15 59.761,16 8.843,17 0.667,18 3.349,19 3.465,20 3.063,21 2.91,22 4.612,23 2.935,24 3.785,25 3.912,26 3.41,27 3.271,28 5.054,29 3.279,30 4.075,31 4.249,32 3.549,33 3.403,34 5.308,35 3.412,36 4.051,37 4.248,38 3.376,39 3.24,40 5.397,41 3.24,42 3.869,43 4.089,44 3.056,45 3.033,46 5.164,47 2.999,48 3.389,49 3.615,50 2.426,51 2.566,52 4.575,53 2.491,54 2.89,55 3.136,56 1.66,57 2.06,58 3.892,59 1.916,60 2.242,61 2.582,62 0.38,63 1.206,64 2.773,65 0.929,66 0.079,67 0.41,68 3.311,69 1.705,70 5.2}
{0 CHEMBL1971943,1 23.916,2 38.556,3 0.055,4 -0.109,5 0.848,7 4.083,8 4.083,9 5.531,10 1,11 1.926,12 10.464,13 4.448,14 19.786,15 102.632,16 9.825,17 0.71,18 3.88,19 3.988,20 3.657,21 3.402,22 5.194,23 3.444,24 4.339,25 4.472,26 4.081,27 3.761,28 5.725,29 3.801,30 4.544,31 4.693,32 4.13,33 3.822,34 5.952,35 3.861,36 4.546,37 4.71,38 4.142,39 3.783,40 6.074,41 3.803,42 4.523,43 4.703,44 3.867,45 3.773,46 5.836,47 3.757,48 4.462,49 4.641,50 4.022,51 3.733,52 5.927,53 3.751,54 4.461,55 4.638,56 4.008,57 3.595,58 6.061,59 3.641,60 4.319,61 4.538,62 3.724,63 3.265,64 5.98,65 3.288,66 0.232,67 0.799,68 4.272,69 3.045,70 5.2}
{0 CHEMBL1971947,1 21.7,2 25.957,3 0.075,4 0.06,5 0.235,7 3.764,8 3.764,11 1.549,12 15.257,13 4.989,14 24.894,15 142.353,16 8.493,17 0.718,18 4.132,19 4.24,20 3.85,21 3.802,22 5.34,23 3.766,24 4.578,25 4.712,26 4.2,27 4.181,28 5.772,29 4.119,30 4.788,31 4.953,32 4.245,33 4.284,34 5.929,35 4.201,36 4.834,37 5.029,38 4.247,39 4.246,40 5.969,41 4.149,42 4.784,43 4.973,44 4.112,45 4.17,46 5.945,47 4.073,48 4.718,49 4.911,50 4.094,51 4.119,52 5.877,53 4.034,54 4.696,55 4.883,56 4.046,57 4.107,58 5.821,59 4.016,60 4.65,61 4.851,62 3.947,63 4.059,64 5.713,65 3.948,66 0.038,67 0.789,68 9.105,69 4.452,70 5.2}
{0 CHEMBL1972119,1 26.632,2 39.846,3 -0.009,4 -0.167,5 0.908,6 0.8,7 3.738,8 3.738,9 5.322,10 1,11 1.838,12 11.933,13 3.429,14 11.758,15 104.359,16 8.696,17 0.515,18 4.014,19 4.126,20 3.692,21 3.489,22 5.219,23 3.527,24 4.571,25 4.724,26 4.13,27 3.861,28 6.206,29 3.89,30 4.763,31 4.959,32 4.113,33 3.992,34 5.963,35 3.994,36 4.801,37 5.007,38 4.151,39 3.965,40 6.193,41 3.969,42 4.791,43 5.001,44 4.073,45 3.888,46 6.153,47 3.903,48 4.712,49 4.932,50 3.911,51 3.737,52 6.106,53 3.735,54 4.548,55 4.782,56 3.7,57 3.598,58 5.786,59 3.592,60 4.423,61 4.616,62 3.773,63 3.522,64 6.103,65 3.537,66 0.23,67 0.956,68 7.166,69 4.059,70 5.2}
{0 CHEMBL1972125,1 13.045,2 11.877,3 0.085,4 0.122,5 0.299,7 4.137,8 4.137,9 5.972,10 1,11 1.454,12 14.714,13 4.237,14 17.951,15 138.85,16 7.583,17 0.718,18 4.207,19 4.324,20 3.79,21 3.813,22 5.362,23 3.789,24 4.691,25 4.833,26 4.134,27 4.207,28 5.782,29 4.162,30 4.966,31 5.151,32 4.204,33 4.331,34 6.062,35 4.257,36 5.044,37 5.26,38 4.135,39 4.297,40 6.134,41 4.209,42 4.992,43 5.208,44 4.111,45 4.252,46 6.076,47 4.17,48 4.984,49 5.198,50 4.072,51 4.23,52 6.069,53 4.143,54 4.977,55 5.219,56 3.978,57 4.177,58 6.014,59 4.072,60 4.847,61 5.082,62 3.897,63 4.088,64 5.882,65 3.981,66 0.056,67 0.852,68 11.734,69 5.284,70 5.2}
{0 CHEMBL1972142,1 7.745,2 9.649,3 0.051,4 -0.005,5 0.132,7 3.872,8 3.872,11 1.428,12 10.88,13 3.342,14 11.171,15 98.166,16 7.795,17 0.786,18 3.842,19 3.955,20 3.459,21 3.478,22 4.99,23 3.454,24 4.313,25 4.456,26 3.788,27 3.859,28 5.445,29 3.81,30 4.546,31 4.737,32 3.78,33 3.929,34 5.617,35 3.847,36 4.556,37 4.776,38 3.63,39 3.822,40 5.622,41 3.731,42 4.444,43 4.67,44 3.577,45 3.731,46 5.502,47 3.645,48 4.359,49 4.56,50 3.569,51 3.682,52 5.511,53 3.614,54 4.315,55 4.511,56 3.484,57 3.636,58 5.484,59 3.556,60 4.242,61 4.466,62 3.317,63 3.548,64 5.241,65 3.438,66 0.027,67 0.58,68 7.474,69 3.481,70 5.2}
{0 CHEMBL1972158,1 11.544,2 16.058,3 0.072,4 0.262,5 0.205,7 4.259,8 4.259,11 1.422,12 9.286,13 4.512,14 20.354,15 112.615,16 7.967,17 0.844,18 3.959,19 4.087,20 3.601,21 3.565,22 5.131,23 3.55,24 4.421,25 4.569,26 3.951,27 3.958,28 5.514,29 3.925,30 4.637,31 4.831,32 3.963,33 4.039,34 5.679,35 3.977,36 4.71,37 4.937,38 3.939,39 4,40 5.714,41 3.941,42 4.651,43 4.868,44 3.96,45 3.991,46 5.69,47 3.948,48 4.654,49 4.856,50 3.961,51 4.046,52 5.723,53 3.985,54 4.684,55 4.901,56 3.902,57 4.059,58 5.713,59 3.968,60 4.65,61 4.872,62 3.727,63 4.003,64 5.61,65 3.884,66 0.11,67 0.741,68 8.183,69 3.634,70 5.7}
{0 CHEMBL1972183,1 17.429,2 19.551,3 -0.014,4 -0.191,5 0.29,7 3.44,8 3.44,9 5.949,10 1,11 1.333,12 10.273,13 3.722,14 13.855,15 89.932,16 6.445,17 0.5,18 3.893,19 4.023,20 3.35,21 3.439,22 4.843,23 3.386,24 4.465,25 4.664,26 3.636,27 3.823,28 5.312,29 3.738,30 4.717,31 4.955,32 3.583,33 3.937,34 5.496,35 3.789,36 4.749,37 5.029,38 3.392,39 3.831,40 5.45,41 3.646,42 4.648,43 4.947,44 3.333,45 3.687,46 5.361,47 3.536,48 4.328,49 4.542,50 3.403,51 3.662,52 5.202,53 3.548,54 4.45,55 4.699,56 3.366,57 3.669,58 5.284,59 3.53,60 4.432,61 4.719,62 3.136,63 3.527,64 5.184,65 3.37,66 0.046,67 0.64,68 10.88,69 4.535,70 5.2}
{0 CHEMBL1972221,1 13.507,2 13.959,3 0.047,4 0.018,5 0.468,7 4.488,8 4.488,11 1.705,12 12.185,13 3.575,14 12.778,15 107.34,16 7.888,17 0.552,18 3.986,19 4.099,20 3.745,21 3.558,22 5.066,23 3.511,24 4.517,25 4.675,26 3.998,27 3.926,28 5.807,29 3.861,30 4.763,31 4.968,32 4.017,33 4.021,34 5.905,35 3.936,36 4.753,37 4.955,38 3.965,39 3.992,40 5.966,41 3.906,42 4.708,43 4.913,44 3.844,45 3.924,46 5.918,47 3.844,48 4.604,49 4.816,50 3.721,51 3.854,52 5.698,53 3.76,54 4.553,55 4.787,56 3.631,57 3.777,58 5.559,59 3.651,60 4.492,61 4.743,62 3.534,63 3.661,64 5.532,65 3.519,66 0.129,67 0.763,68 12.534,69 4.74,70 5.6}
{0 CHEMBL1972250,1 16.406,2 18.273,3 0.028,4 0.061,5 0.241,7 3.974,8 3.974,9 5.376,10 1,11 1.511,12 9.917,13 4.443,14 19.738,15 90.978,16 8.676,17 0.63,18 3.72,19 3.815,20 3.43,21 3.362,22 5.006,23 3.364,24 4.188,25 4.314,26 3.788,27 3.748,28 5.339,29 3.742,30 4.338,31 4.468,32 3.87,33 3.863,34 5.557,35 3.838,36 4.451,37 4.626,38 3.782,39 3.844,40 5.642,41 3.794,42 4.426,43 4.635,44 3.65,45 3.742,46 5.525,47 3.673,48 4.285,49 4.497,50 3.475,51 3.582,52 5.388,53 3.511,54 4.073,55 4.283,56 3.307,57 3.421,58 5.23,59 3.344,60 3.988,61 4.237,62 3.13,63 3.212,64 5.17,65 3.14,66 0.05,67 0.51,68 4.848,69 2.696,70 5.2}
{0 CHEMBL1972258,1 6.973,2 7.519,3 0.006,4 -0.086,5 0.162,7 3.481,8 3.481,9 5.553,10 1,11 1.48,12 9.895,13 0.732,14 0.536,15 76.477,16 7.093,17 0.6,18 3.658,19 3.787,20 3.176,21 3.187,22 4.79,23 3.16,24 4.127,25 4.306,26 3.391,27 3.496,28 5.173,29 3.437,30 4.328,31 4.557,32 3.345,33 3.553,34 5.283,35 3.45,36 4.248,37 4.498,38 3.174,39 3.43,40 5.179,41 3.305,42 4.148,43 4.396,44 3.123,45 3.364,46 5.038,47 3.256,48 4.05,49 4.264,50 3.142,51 3.359,52 5.033,53 3.255,54 4.117,55 4.373,56 3.078,57 3.282,58 5.11,59 3.167,60 3.986,61 4.257,62 2.835,63 3.055,64 4.927,65 2.935,66 0.029,67 0.517,68 7.659,69 3.14,70 5.2}
{0 CHEMBL1972276,1 18.827,2 26.405,3 0.011,4 -0.182,5 0.392,7 3.786,8 3.786,11 1.498,12 11.852,13 2.797,14 7.824,15 108.521,16 6.915,17 0.552,18 4.049,19 4.197,20 3.543,21 3.535,22 5.121,23 3.509,24 4.577,25 4.787,26 3.871,27 3.897,28 5.628,29 3.843,30 4.809,31 5.06,32 3.911,33 4.009,34 5.777,35 3.933,36 4.847,37 5.093,38 3.877,39 4.027,40 5.857,41 3.929,42 4.902,43 5.187,44 3.755,45 3.985,46 5.82,47 3.849,48 4.787,49 5.082,50 3.603,51 3.86,52 5.644,53 3.728,54 4.622,55 4.9,56 3.581,57 3.767,58 5.564,59 3.656,60 4.523,61 4.768,62 3.527,63 3.712,64 5.512,65 3.613,66 0.051,67 0.823,68 11.957,69 4.261,70 5.2}
{0 CHEMBL1972362,1 5.977,2 4.836,3 0.097,4 0.105,5 0.327,7 4.565,8 4.565,11 1.841,12 8.682,13 1.879,14 3.531,15 86.534,16 9.777,17 0.667,18 3.653,19 3.718,20 3.655,21 3.391,22 4.847,23 3.313,24 4.141,25 4.229,26 3.962,27 3.779,28 5.63,29 3.697,30 4.341,31 4.442,32 3.983,33 3.847,34 5.696,35 3.761,36 4.35,37 4.485,38 3.787,39 3.782,40 5.654,41 3.686,42 4.324,43 4.529,44 3.598,45 3.644,46 5.475,47 3.525,48 4.114,49 4.303,50 3.559,51 3.483,52 5.362,53 3.355,54 3.906,55 4.066,56 3.431,57 3.284,58 5.203,59 3.162,60 3.845,61 3.984,62 3.501,63 3.13,64 5.422,65 3.038,66 0.101,67 0.483,68 5.952,69 3.493,70 5.2}
{0 CHEMBL1972489,1 9.121,2 11.333,3 0.065,4 0.164,5 0.268,7 3.762,8 3.762,11 1.71,12 8.632,13 3.06,14 9.364,15 73.883,16 9.37,17 0.762,18 3.505,19 3.61,20 3.265,21 3.14,22 4.735,23 3.132,24 3.948,25 4.065,26 3.633,27 3.513,28 5.205,29 3.486,30 4.158,31 4.325,32 3.591,33 3.545,34 5.375,35 3.483,36 4.101,37 4.298,38 3.359,39 3.324,40 5.347,41 3.265,42 3.907,43 4.124,44 3.167,45 3.108,46 5.124,47 3.065,48 3.683,49 3.838,50 3.263,51 3.073,52 5.097,53 3.035,54 3.669,55 3.856,56 3.043,57 3.058,58 4.849,59 2.972,60 3.569,61 3.778,62 2.947,63 2.903,64 4.678,65 2.807,66 0.075,67 0.428,68 3.527,69 2.134,70 5.2}
{0 CHEMBL1972568,1 4.313,2 4.651,3 -0.041,4 -0.221,5 0.13,7 3.481,8 3.481,9 5.1,10 1,11 1.481,12 7.875,13 1.499,14 2.246,15 63.662,16 7.581,17 0.706,18 3.421,19 3.528,20 3.013,21 2.995,22 4.61,23 2.977,24 3.856,25 4.016,26 3.229,27 3.283,28 4.965,29 3.247,30 3.956,31 4.131,32 3.175,33 3.346,34 5.016,35 3.262,36 3.946,37 4.177,38 2.928,39 3.213,40 4.89,41 3.084,42 3.876,43 4.14,44 2.813,45 3.073,46 4.769,47 2.958,48 3.628,49 3.821,50 2.757,51 2.985,52 4.631,53 2.882,54 3.673,55 3.929,56 2.699,57 2.844,58 4.635,59 2.746,60 3.457,61 3.704,62 2.452,63 2.539,64 4.47,65 2.468,66 0.004,67 0.381,68 5.224,69 2.444,70 5.2}
{0 CHEMBL1972576,1 24.83,2 32.993,3 0.082,4 0.004,5 0.619,7 3.671,8 3.671,11 1.735,12 13.967,13 2.729,14 7.446,15 117.735,16 8.719,17 0.667,18 3.994,19 4.11,20 3.724,21 3.59,22 5.229,23 3.571,24 4.444,25 4.582,26 4.094,27 3.959,28 5.713,29 3.918,30 4.652,31 4.818,32 4.098,33 4.033,34 5.865,35 3.982,36 4.729,37 4.933,38 4.11,39 3.956,40 5.975,41 3.901,42 4.648,43 4.86,44 3.876,45 3.81,46 6.004,47 3.751,48 4.433,49 4.62,50 3.757,51 3.73,52 5.679,53 3.685,54 4.399,55 4.591,56 3.759,57 3.791,58 5.556,59 3.691,60 4.421,61 4.624,62 3.597,63 3.694,64 5.582,65 3.606,66 0.1,67 0.77,68 7.777,69 3.844,70 5.2}
{0 CHEMBL1972584,1 33.225,2 40.174,3 0.007,4 -0.187,5 0.71,6 0.555,7 4.587,8 4.587,11 1.528,12 17.341,13 3.792,14 14.377,15 171.243,16 7.306,17 0.52,18 4.504,19 4.638,20 4.066,21 4.022,22 5.56,23 4.007,24 5.078,25 5.268,26 4.467,27 4.457,28 6.082,29 4.421,30 5.369,31 5.59,32 4.56,33 4.646,34 6.331,35 4.58,36 5.489,37 5.72,38 4.539,39 4.699,40 6.47,41 4.604,42 5.536,43 5.804,44 4.425,45 4.66,46 6.45,47 4.541,48 5.421,49 5.685,50 4.379,51 4.578,52 6.325,53 4.469,54 5.332,55 5.585,56 4.3,57 4.525,58 6.237,59 4.414,60 5.307,61 5.565,62 4.243,63 4.478,64 6.235,65 4.356,66 0.058,67 1.308,68 17.187,69 6.842,70 5.8}
{0 CHEMBL1972659,1 16.025,2 17.39,3 0.071,4 0.172,5 0.232,7 4.212,8 4.212,11 1.408,12 11.111,13 4.607,14 21.228,15 107.157,16 7.316,17 0.567,18 3.98,19 4.092,20 3.534,21 3.599,22 5.09,23 3.56,24 4.493,25 4.649,26 3.888,27 4.005,28 5.54,29 3.94,30 4.777,31 4.966,32 3.994,33 4.152,34 5.842,35 4.072,36 4.833,37 5.04,38 3.885,39 4.113,40 5.846,41 4.008,42 4.85,43 5.097,44 3.763,45 3.984,46 5.85,47 3.866,48 4.724,49 4.987,50 3.614,51 3.746,52 5.826,53 3.651,54 4.482,55 4.731,56 3.445,57 3.579,58 5.603,59 3.5,60 4.289,61 4.504,62 3.379,63 3.589,64 5.33,65 3.501,66 0.067,67 0.655,68 9.908,69 4.681,70 5.2}
{0 CHEMBL1972820,1 14.19,2 17.04,3 0.086,4 0.008,5 0.738,7 3.964,8 3.964,11 1.615,12 7.905,13 1.776,14 3.154,15 71.446,16 9.442,17 0.522,18 3.561,19 3.619,20 3.295,21 3.142,22 4.955,23 3.181,24 3.998,25 4.066,26 3.711,27 3.529,28 5.522,29 3.559,30 4.257,31 4.361,32 3.824,33 3.62,34 5.738,35 3.665,36 4.322,37 4.43,38 3.794,39 3.503,40 6.111,41 3.563,42 4.197,43 4.33,44 3.424,45 3.303,46 5.722,47 3.34,48 3.863,49 3.983,50 3.286,51 3.126,52 5.544,53 3.133,54 3.734,55 3.878,56 3.061,57 2.99,58 5.131,59 2.985,60 3.667,61 3.79,62 3.062,63 2.663,64 5.716,65 2.727,66 0.19,67 0.381,68 3.332,69 2.537,70 5.2}
{0 CHEMBL1972840,1 8.592,2 7.94,3 0.068,4 0.032,5 0.194,7 4.439,8 4.439,9 5.959,10 1,11 1.564,12 12.621,13 3.582,14 12.83,15 116.579,16 8.174,17 0.788,18 4.011,19 4.119,20 3.711,21 3.658,22 5.129,23 3.616,24 4.507,25 4.644,26 4.088,27 4.071,28 5.555,29 4.001,30 4.733,31 4.915,32 4.081,33 4.155,34 5.737,35 4.041,36 4.774,37 4.993,38 3.953,39 4.078,40 5.677,41 3.947,42 4.657,43 4.879,44 3.845,45 3.942,46 5.613,47 3.836,48 4.659,49 4.882,50 3.77,51 3.898,52 5.664,53 3.794,54 4.638,55 4.893,56 3.667,57 3.822,58 5.573,59 3.701,60 4.422,61 4.632,62 3.633,63 3.72,64 5.405,65 3.609,66 0.034,67 0.71,68 9.126,69 4.308,70 5.8}
{0 CHEMBL1972849,1 8.912,2 6.882,3 -0.012,4 -0.096,5 0.813,7 4.52,8 4.52,11 1.829,12 10,13 3.977,14 15.818,15 104.357,16 8.922,17 0.735,18 3.999,19 4.103,20 3.712,21 3.494,22 5.267,23 3.535,24 4.511,25 4.653,26 4.145,27 3.906,28 5.771,29 3.946,30 4.721,31 4.886,32 4.209,33 4.004,34 6.018,35 4.031,36 4.881,37 5.109,38 4.212,39 3.994,40 6.243,41 4.019,42 4.738,43 4.931,44 4.155,45 3.978,46 6.006,47 3.999,48 4.665,49 4.815,50 4.151,51 3.981,52 6.02,53 3.99,54 4.719,55 4.911,56 4.061,57 3.918,58 5.976,59 3.915,60 4.626,61 4.84,62 3.952,63 3.778,64 5.934,65 3.78,66 0.23,67 0.89,68 6.387,69 3.859,70 5.2}
{0 CHEMBL1972937,1 13.776,2 15.016,3 0.025,4 -0.048,5 0.169,6 0.624,7 3.617,8 3.617,9 5.186,10 1,11 1.648,12 9.955,13 3.763,14 14.16,15 89.416,16 8.622,17 0.5,18 3.692,19 3.782,20 3.44,21 3.344,22 4.882,23 3.302,24 4.145,25 4.266,26 3.811,27 3.679,28 5.341,29 3.618,30 4.286,31 4.445,32 3.729,33 3.695,34 5.438,35 3.609,36 4.217,37 4.402,38 3.635,39 3.611,40 5.329,41 3.495,42 4.191,43 4.371,44 3.66,45 3.622,46 5.283,47 3.498,48 4.158,49 4.321,50 3.599,51 3.522,52 5.364,53 3.431,54 4.065,55 4.254,56 3.347,57 3.299,58 5.351,59 3.23,60 3.816,61 3.985,62 3.004,63 3.126,64 5.029,65 3.035,66 0.027,67 0.479,68 5.93,69 3.23,70 5.2}
{0 CHEMBL1973098,1 10.189,2 8.549,3 0.068,4 0.058,5 0.295,6 0.524,7 3.562,8 3.562,9 4.986,10 1,11 1.88,12 7.235,13 2.558,14 6.541,15 72.369,16 10.283,17 0.333,18 3.394,19 3.455,20 3.276,21 3.049,22 4.683,23 3.004,24 3.827,25 3.912,26 3.77,27 3.414,28 5.147,29 3.337,30 3.936,31 4.018,32 3.61,33 3.41,34 5.35,35 3.333,36 3.917,37 4.058,38 3.424,39 3.277,40 5.232,41 3.185,42 3.88,43 4.05,44 3.263,45 3.229,46 5.066,47 3.094,48 3.755,49 3.923,50 3.266,51 3.072,52 4.996,53 2.953,54 3.557,55 3.729,56 3.193,57 2.822,58 4.927,59 2.698,60 3.159,61 3.23,62 2.836,63 2.466,64 4.891,65 2.343,66 0.111,67 0.336,68 2.716,69 2.334,70 5.2}
{0 CHEMBL1973142,1 11.831,2 15.227,3 0.128,4 0.211,5 0.366,7 3.551,8 3.551,11 2.083,12 5.833,13 2.435,14 5.927,15 72.492,16 11.661,17 0.526,18 3.395,19 3.47,20 3.372,21 3.099,22 4.703,23 3.053,24 3.843,25 3.934,26 3.848,27 3.505,28 5.259,29 3.429,30 4.037,31 4.115,32 4.113,33 3.602,34 5.467,35 3.523,36 3.994,37 4.083,38 4.004,39 3.57,40 5.391,41 3.468,42 3.949,43 4.044,44 3.899,45 3.399,46 5.433,47 3.342,48 3.976,49 4.096,50 3.699,51 3.2,52 5.798,53 3.149,54 3.792,55 3.976,56 3.054,57 2.765,58 5.374,59 2.613,60 3.079,61 3.411,62 1.018,63 1.894,64 3.862,65 1.491,66 0.137,67 0.362,68 0.91,69 1.924,70 5.2}
{0 CHEMBL1973145,1 20.473,2 29.218,3 0.114,4 0.09,5 0.355,7 3.702,8 3.702,11 1.676,12 12.429,13 3.237,14 10.478,15 114.23,16 8.489,17 0.71,18 3.95,19 4.074,20 3.662,21 3.555,22 5.164,23 3.527,24 4.396,25 4.54,26 4.046,27 3.936,28 5.64,29 3.883,30 4.601,31 4.775,32 4.038,33 4.025,34 5.743,35 3.959,36 4.673,37 4.876,38 4.096,39 4.01,40 5.846,41 3.921,42 4.655,43 4.863,44 3.848,45 3.91,46 5.832,47 3.803,48 4.511,49 4.748,50 3.657,51 3.721,52 5.631,53 3.632,54 4.324,55 4.541,56 3.508,57 3.59,58 5.437,59 3.514,60 4.254,61 4.476,62 3.469,63 3.573,64 5.33,65 3.462,66 0.08,67 0.746,68 8.137,69 3.684,70 5.2}
{0 CHEMBL1973211,1 27.434,2 33.376,3 0.06,4 0.001,5 0.269,6 0.247,7 3.74,8 3.74,11 1.525,12 15.314,13 5.156,14 26.586,15 145.456,16 7.769,17 0.564,18 4.221,19 4.343,20 3.864,21 3.844,22 5.319,23 3.796,24 4.735,25 4.904,26 4.218,27 4.245,28 5.798,29 4.167,30 4.958,31 5.161,32 4.235,33 4.357,34 5.961,35 4.244,36 4.992,37 5.224,38 4.257,39 4.318,40 6.019,41 4.197,42 4.887,43 5.098,44 4.11,45 4.211,46 5.987,47 4.096,48 4.778,49 4.985,50 4.052,51 4.124,52 5.873,53 4.029,54 4.741,55 4.928,56 4.03,57 4.142,58 5.786,59 4.039,60 4.815,61 5.033,62 4.024,63 4.184,64 5.773,65 4.04,66 0.056,67 0.917,68 12.489,69 5.481,70 5.2}
{0 CHEMBL1973348,1 14.646,2 12.518,3 0.084,4 0.125,5 0.39,7 4.144,8 4.144,9 5.971,10 1,11 1.554,12 14.833,13 4.901,14 24.023,15 143.655,16 8.148,17 0.7,18 4.212,19 4.324,20 3.853,21 3.832,22 5.379,23 3.808,24 4.697,25 4.832,26 4.222,27 4.232,28 5.814,29 4.187,30 4.975,31 5.15,32 4.292,33 4.362,34 6.099,35 4.286,36 5.05,37 5.259,38 4.227,39 4.325,40 6.158,41 4.237,42 5,43 5.207,44 4.219,45 4.274,46 6.14,47 4.195,48 4.988,49 5.198,50 4.165,51 4.255,52 6.088,53 4.169,54 4.987,55 5.218,56 4.138,57 4.215,58 6.072,59 4.114,60 4.859,61 5.08,62 4.021,63 4.132,64 5.934,65 4.023,66 0.053,67 0.841,68 10.678,69 5.133,70 5.2}
{0 CHEMBL1973395,1 11.835,2 17.894,3 0.03,4 -0.178,5 0.163,7 3.538,8 3.538,11 1.508,12 8.364,13 2.057,14 4.23,15 87.396,16 7.36,17 0.64,18 3.811,19 3.935,20 3.381,21 3.353,22 4.875,23 3.337,24 4.352,25 4.527,26 3.74,27 3.774,28 5.359,29 3.73,30 4.625,31 4.848,32 3.769,33 3.892,34 5.551,35 3.814,36 4.629,37 4.869,38 3.727,39 3.856,40 5.57,41 3.768,42 4.559,43 4.797,44 3.68,45 3.828,46 5.458,47 3.742,48 4.543,49 4.775,50 3.601,51 3.771,52 5.516,53 3.679,54 4.471,55 4.731,56 3.315,57 3.616,58 5.376,59 3.486,60 4.293,61 4.567,62 2.968,63 3.369,64 5.228,65 3.191,66 0.033,67 0.625,68 8.405,69 3.44,70 5.2}
{0 CHEMBL1973483,1 20.633,2 28.555,3 0.029,4 -0.084,5 1.377,6 0.247,7 3.869,8 3.869,11 1.926,12 11.179,13 4.411,14 19.455,15 86.145,16 10.534,17 0.567,18 3.808,19 3.904,20 3.612,21 3.292,22 5.195,23 3.373,24 4.352,25 4.468,26 4.152,27 3.637,28 6.493,29 3.729,30 4.482,31 4.642,32 4.065,33 3.727,34 6.07,35 3.796,36 4.553,37 4.733,38 4.016,39 3.638,40 6.149,41 3.729,42 4.483,43 4.67,44 3.95,45 3.499,46 6.173,47 3.6,48 4.329,49 4.512,50 3.77,51 3.352,52 5.939,53 3.459,54 4.228,55 4.395,56 3.797,57 3.273,58 6.208,59 3.377,60 4.1,61 4.288,62 3.508,63 3.271,64 5.595,65 3.326,66 0.469,67 1.081,68 2.325,69 3.273,70 5.2}
{0 CHEMBL1973540,1 15.046,2 15.28,3 0.067,4 -0.077,5 0.533,7 4.707,8 4.707,11 1.845,12 12.742,13 4.01,14 16.076,15 121.292,16 9.773,17 0.743,18 3.986,19 4.062,20 3.939,21 3.658,22 5.19,23 3.623,24 4.456,25 4.55,26 4.263,27 4.038,28 5.882,29 3.995,30 4.655,31 4.796,32 4.285,33 4.104,34 5.929,35 4.045,36 4.697,37 4.847,38 4.256,39 4.064,40 6.065,41 3.991,42 4.617,43 4.78,44 4.091,45 3.914,46 5.929,47 3.866,48 4.494,49 4.66,50 3.917,51 3.819,52 5.872,53 3.771,54 4.41,55 4.581,56 3.789,57 3.808,58 5.606,59 3.722,60 4.379,61 4.569,62 3.73,63 3.765,64 5.478,65 3.635,66 0.159,67 0.726,68 7.489,69 4.169,70 5.5}
{0 CHEMBL1973711,1 15.547,2 14.7,3 0.14,4 0.143,5 0.531,6 0.8,7 3.687,8 3.687,9 5.338,10 1,11 1.888,12 5.95,13 1.001,14 1.002,15 69.79,16 11.064,17 0.273,18 3.444,19 3.51,20 3.314,21 3.064,22 4.87,23 3.108,24 3.886,25 3.946,26 3.755,27 3.467,28 5.353,29 3.5,30 4.158,31 4.228,32 3.903,33 3.615,34 5.641,35 3.66,36 4.173,37 4.253,38 3.925,39 3.557,40 5.968,41 3.604,42 4.105,43 4.22,44 3.79,45 3.417,46 5.713,47 3.461,48 3.96,49 4.108,50 3.602,51 3.133,52 5.817,53 3.141,54 3.53,55 3.715,56 3.245,57 2.455,58 5.399,59 2.462,60 2.406,61 2.63,62 0.814,63 1.325,64 3.659,65 1.089,66 0.182,67 0.373,68 1.261,69 1.713,70 5.3}
{0 CHEMBL1973808,1 9.121,2 11.333,3 0.065,4 0.164,5 0.269,7 3.762,8 3.762,11 1.71,12 8.632,13 2.923,14 8.543,15 74.133,16 9.37,17 0.762,18 3.505,19 3.61,20 3.265,21 3.14,22 4.737,23 3.132,24 3.948,25 4.065,26 3.633,27 3.513,28 5.199,29 3.486,30 4.159,31 4.321,32 3.593,33 3.551,34 5.378,35 3.489,36 4.13,37 4.337,38 3.353,39 3.338,40 5.351,41 3.274,42 3.887,43 4.096,44 3.168,45 3.115,46 5.119,47 3.067,48 3.7,49 3.862,50 3.254,51 3.087,52 5.061,53 3.046,54 3.679,55 3.857,56 3.051,57 3.069,58 4.929,59 2.982,60 3.552,61 3.756,62 2.944,63 2.93,64 4.614,65 2.82,66 0.075,67 0.428,68 3.527,69 2.134,70 5.2}
{0 CHEMBL1973860,1 7.215,2 11.409,3 0.074,4 0.04,5 0.154,7 3.717,8 3.717,11 1.593,12 8.526,13 2.577,14 6.639,15 81.244,16 8.193,17 0.762,18 3.605,19 3.707,20 3.316,21 3.267,22 4.723,23 3.206,24 4.076,25 4.216,26 3.594,27 3.634,28 5.144,29 3.547,30 4.272,31 4.477,32 3.507,33 3.662,34 5.278,35 3.556,36 4.236,37 4.449,38 3.456,39 3.614,40 5.202,41 3.486,42 4.19,43 4.417,44 3.365,45 3.53,46 5.156,47 3.377,48 4.011,49 4.225,50 3.224,51 3.365,52 4.969,53 3.219,54 3.901,55 4.118,56 3.096,57 3.211,58 4.878,59 3.055,60 3.764,61 4.004,62 2.915,63 2.931,64 4.74,65 2.782,66 0.032,67 0.457,68 6.459,69 3.082,70 5.2}
{0 CHEMBL1973893,1 12.295,2 13.234,3 0.05,4 0.02,5 0.495,7 4.488,8 4.488,11 1.735,12 11.577,13 2.908,14 8.455,15 102.713,16 8.098,17 0.571,18 3.931,19 4.041,20 3.717,21 3.506,22 5.033,23 3.464,24 4.454,25 4.605,26 3.973,27 3.872,28 5.787,29 3.816,30 4.69,31 4.882,32 3.969,33 3.971,34 5.851,35 3.89,36 4.689,37 4.892,38 3.934,39 3.953,40 5.889,41 3.863,42 4.656,43 4.856,44 3.794,45 3.872,46 5.892,47 3.793,48 4.539,49 4.752,50 3.634,51 3.778,52 5.638,53 3.677,54 4.452,55 4.691,56 3.554,57 3.663,58 5.471,59 3.54,60 4.358,61 4.6,62 3.46,63 3.534,64 5.453,65 3.404,66 0.133,67 0.725,68 11.462,69 4.404,70 5.5}
{0 CHEMBL1973937,1 18.955,2 24.276,3 0.093,4 0.186,5 0.299,7 3.72,8 3.72,11 1.634,12 11.929,13 4.435,14 19.667,15 114.011,16 9.486,17 0.71,18 3.945,19 4.068,20 3.716,21 3.558,22 5.132,23 3.535,24 4.402,25 4.544,26 4.134,27 3.957,28 5.585,29 3.907,30 4.637,31 4.809,32 4.174,33 4.076,34 5.763,35 4.001,36 4.709,37 4.918,38 4.15,39 4.032,40 5.822,41 3.951,42 4.676,43 4.883,44 3.938,45 3.939,46 5.837,47 3.853,48 4.588,49 4.82,50 3.962,51 3.805,52 5.724,53 3.717,54 4.439,55 4.69,56 3.595,57 3.695,58 5.386,59 3.561,60 4.287,61 4.529,62 3.698,63 3.585,64 5.29,65 3.454,66 0.087,67 0.7,68 6.228,69 3.586,70 5.2}
{0 CHEMBL1974157,1 12.962,2 12.805,3 0.084,4 0.103,5 0.215,7 3.549,8 3.549,11 1.571,12 10.045,13 2.394,14 5.73,15 82.833,16 8.176,17 0.522,18 3.674,19 3.767,20 3.286,21 3.258,22 5.01,23 3.254,24 4.083,25 4.205,26 3.582,27 3.589,28 5.376,29 3.56,30 4.368,31 4.53,32 3.651,33 3.673,34 5.753,35 3.627,36 4.399,37 4.608,38 3.468,39 3.547,40 5.759,41 3.483,42 4.215,43 4.431,44 3.417,45 3.437,46 5.516,47 3.389,48 4.131,49 4.314,50 3.422,51 3.344,52 5.612,53 3.346,54 4.009,55 4.16,56 3.371,57 3.269,58 5.687,59 3.258,60 3.965,61 4.161,62 3.132,63 3.186,64 5.525,65 3.121,66 0.088,67 0.467,68 5.984,69 3.11,70 5.2}
{0 CHEMBL1974254,1 23.439,2 29.144,3 0.05,4 0.023,5 0.443,7 3.88,8 3.88,9 5.424,10 1,11 1.649,12 16,13 4.046,14 16.368,15 140.7,16 8.214,17 0.692,18 4.194,19 4.31,20 3.88,21 3.781,22 5.359,23 3.755,24 4.675,25 4.827,26 4.242,27 4.167,28 5.827,29 4.121,30 4.863,31 5.037,32 4.274,33 4.279,34 5.953,35 4.21,36 4.908,37 5.085,38 4.347,39 4.321,40 6.02,41 4.228,42 4.962,43 5.167,44 4.252,45 4.28,46 6.068,47 4.171,48 4.853,49 5.065,50 4.066,51 4.142,52 5.922,53 4.048,54 4.768,55 4.993,56 3.941,57 4.049,58 5.833,59 3.946,60 4.706,61 4.928,62 3.839,63 3.979,64 5.729,65 3.871,66 0.083,67 0.914,68 10.876,69 5.071,70 5.2}
{0 CHEMBL1974288,1 8.463,2 11.475,3 0.051,4 0.014,5 0.332,7 3.577,8 3.577,11 1.452,12 10.833,13 2.479,14 6.144,15 93.09,16 7.581,17 0.692,18 3.822,19 3.93,20 3.397,21 3.431,22 5,23 3.403,24 4.288,25 4.43,26 3.693,27 3.792,28 5.43,29 3.737,30 4.561,31 4.758,32 3.758,33 3.912,34 5.647,35 3.83,36 4.6,37 4.803,38 3.688,39 3.854,40 5.737,41 3.768,42 4.611,43 4.833,44 3.636,45 3.791,46 5.835,47 3.701,48 4.484,49 4.717,50 3.477,51 3.668,52 5.604,53 3.57,54 4.294,55 4.511,56 3.346,57 3.506,58 5.463,59 3.421,60 4.145,61 4.361,62 3.158,63 3.37,64 5.269,65 3.272,66 0.032,67 0.554,68 7.931,69 3.768,70 5.2}
{0 CHEMBL1974310,1 4.452,2 3.014,3 0.104,4 0.096,5 0.176,7 3.708,8 3.708,11 1.813,12 7.684,13 2.559,14 6.547,15 72.996,16 9.726,17 0.762,18 3.472,19 3.556,20 3.316,21 3.182,22 4.775,23 3.146,24 3.908,25 4.005,26 3.728,27 3.578,28 5.286,29 3.518,30 4.104,31 4.227,32 3.763,33 3.615,34 5.435,35 3.552,36 4.073,37 4.226,38 3.538,39 3.526,40 5.315,41 3.445,42 3.995,43 4.184,44 3.421,45 3.414,46 5.157,47 3.322,48 3.915,49 4.084,50 3.367,51 3.257,52 5.306,53 3.175,54 3.717,55 3.926,56 2.986,57 2.875,58 5.15,59 2.794,60 3.319,61 3.518,62 2.744,63 2.252,64 4.933,65 2.31,66 0.073,67 0.446,68 3.148,69 2.307,70 5.2}
{0 CHEMBL1974328,1 25.341,2 44.488,3 0.071,4 -0.015,5 0.37,7 3.631,8 3.631,11 1.521,12 9.48,13 2.485,14 6.173,15 98.333,16 6.949,17 0.444,18 3.978,19 4.13,20 3.469,21 3.465,22 5.07,23 3.442,24 4.508,25 4.703,26 3.821,27 3.861,28 5.572,29 3.802,30 4.827,31 5.075,32 3.884,33 3.993,34 5.849,35 3.901,36 4.872,37 5.158,38 3.793,39 3.926,40 5.866,41 3.816,42 4.746,43 5.021,44 3.723,45 3.841,46 5.749,47 3.759,48 4.636,49 4.888,50 3.771,51 3.808,52 5.725,53 3.743,54 4.598,55 4.825,56 3.677,57 3.78,58 5.71,59 3.717,60 4.603,61 4.846,62 3.556,63 3.752,64 5.642,65 3.652,66 0.061,67 0.769,68 11.132,69 3.9,70 5.2}
{0 CHEMBL1974416,1 9.723,2 12.115,3 0.056,4 -0.015,5 0.638,7 4.07,8 4.07,11 1.662,12 10.231,13 3.746,14 14.036,15 93.764,16 8.958,17 0.759,18 3.801,19 3.901,20 3.515,21 3.418,22 5.089,23 3.429,24 4.262,25 4.379,26 3.891,27 3.793,28 5.586,29 3.794,30 4.515,31 4.681,32 3.981,33 3.856,34 5.977,35 3.852,36 4.5,37 4.683,38 3.874,39 3.759,40 5.968,41 3.753,42 4.425,43 4.61,44 3.759,45 3.68,46 5.878,47 3.659,48 4.322,49 4.52,50 3.634,51 3.621,52 5.554,53 3.591,54 4.278,55 4.484,56 3.6,57 3.514,58 5.63,59 3.496,60 4.127,61 4.324,62 3.446,63 3.371,64 5.488,65 3.357,66 0.106,67 0.694,68 4.914,69 3.179,70 5.2}
{0 CHEMBL1974457,1 3.905,2 2.313,3 0.079,4 0.038,5 0.268,7 3.734,8 3.734,11 1.818,12 7.105,13 3.161,14 9.991,15 71.174,16 10.122,17 0.762,18 3.448,19 3.506,20 3.319,21 3.162,22 4.787,23 3.135,24 3.879,25 3.952,26 3.735,27 3.556,28 5.358,29 3.506,30 4.073,31 4.185,32 3.773,33 3.588,34 5.419,35 3.536,36 4.048,37 4.187,38 3.578,39 3.482,40 5.367,41 3.433,42 3.968,43 4.133,44 3.477,45 3.369,46 5.28,47 3.315,48 3.912,49 4.051,50 3.441,51 3.204,52 5.487,53 3.163,54 3.63,55 3.804,56 3.097,57 2.779,58 5.124,59 2.748,60 3.197,61 3.361,62 2.327,63 2.116,64 4.749,65 2.144,66 0.106,67 0.387,68 2.498,69 2.294,70 5.2}
{0 CHEMBL1974664,1 12.326,2 10.44,3 -0.001,4 -0.092,5 0.467,7 3.925,8 3.925,9 10.536,10 2,11 1.617,12 11.154,13 3.933,14 15.472,15 101.44,16 8.079,17 0.724,18 3.897,19 4.008,20 3.54,21 3.414,22 5.093,23 3.429,24 4.368,25 4.52,26 3.861,27 3.766,28 5.496,29 3.771,30 4.486,31 4.642,32 3.949,33 3.856,34 5.64,35 3.844,36 4.57,37 4.765,38 3.835,39 3.808,40 5.662,41 3.776,42 4.553,43 4.78,44 3.609,45 3.697,46 5.584,47 3.63,48 4.387,49 4.627,50 3.459,51 3.57,52 5.392,53 3.479,54 4.307,55 4.585,56 3.338,57 3.423,58 5.255,59 3.347,60 4.059,61 4.262,62 3.354,63 3.365,64 5.129,65 3.332,66 0.083,67 0.669,68 7.585,69 3.499,70 5.2}
{0 CHEMBL1974702,1 11.76,2 13.388,3 0.001,4 -0.075,5 0.288,7 3.585,8 3.585,9 4.985,10 1,11 2.111,12 5.529,13 4.043,14 16.343,15 70.518,16 15.027,17 0.526,18 3.281,19 3.306,20 3.487,21 3.081,22 4.528,23 3.032,24 3.766,25 3.816,26 4.013,27 3.507,28 5.121,29 3.435,30 3.894,31 3.937,32 4.367,33 3.614,34 5.229,35 3.517,36 3.768,37 3.799,38 4.172,39 3.49,40 5.234,41 3.384,42 3.567,43 3.634,44 4.052,45 3.15,46 4.968,47 3.05,48 3.428,49 3.47,50 3.83,51 2.835,52 5.088,53 2.782,54 2.959,55 3.123,56 2.353,57 2.184,58 4.069,59 1.947,60 2.374,61 2.64,62 1.111,63 1.597,64 3.008,65 1.188,66 0.116,67 0.228,68 4.697,69 1.108,70 5.2}
{0 CHEMBL1974803,1 15.484,2 17.351,3 0.137,4 0.193,5 0.757,7 3.887,8 3.887,11 1.836,12 7.045,13 3.894,14 15.162,15 85.665,16 11.886,17 0.5,18 3.567,19 3.616,20 3.494,21 3.251,22 4.914,23 3.251,24 3.997,25 4.048,26 3.963,27 3.668,28 5.403,29 3.654,30 4.308,31 4.383,32 4.126,33 3.832,34 5.801,35 3.802,36 4.323,37 4.412,38 4.254,39 3.796,40 5.78,41 3.774,42 4.324,43 4.402,44 4.189,45 3.739,46 5.947,47 3.733,48 4.307,49 4.388,50 4.169,51 3.606,52 6.067,53 3.589,54 4.049,55 4.206,56 3.844,57 3.272,58 5.573,59 3.157,60 3.394,61 3.607,62 2.841,63 2.58,64 4.658,65 2.351,66 0.22,67 0.347,68 0.904,69 2.028,70 5.2}
{0 CHEMBL1974870,1 12.618,2 11.022,3 0.054,4 0.116,5 0.197,7 3.816,8 3.816,9 5.89,10 1,11 1.567,12 12,13 3.877,14 15.028,15 111.899,16 8.019,17 0.71,18 3.994,19 4.113,20 3.627,21 3.59,22 5.118,23 3.562,24 4.494,25 4.648,26 3.987,27 3.979,28 5.555,29 3.93,30 4.733,31 4.919,32 4.002,33 4.093,34 5.779,35 4.003,36 4.805,37 5.044,38 3.873,39 4.036,40 5.727,41 3.917,42 4.689,43 4.914,44 3.79,45 3.948,46 5.659,47 3.837,48 4.671,49 4.895,50 3.82,51 3.886,52 5.698,53 3.787,54 4.606,55 4.845,56 3.685,57 3.785,58 5.604,59 3.678,60 4.424,61 4.659,62 3.552,63 3.677,64 5.396,65 3.571,66 0.054,67 0.708,68 9.072,69 4.23,70 6.4}
{0 CHEMBL1974935,1 8.592,2 7.94,3 0.045,4 -0.013,5 0.212,7 3.726,8 3.726,9 5.88,10 1,11 1.441,12 13.214,13 2.897,14 8.39,15 111.736,16 7.41,17 0.71,18 4.006,19 4.128,20 3.576,21 3.59,22 5.131,23 3.565,24 4.49,25 4.646,26 3.877,27 3.961,28 5.539,29 3.911,30 4.734,31 4.939,32 3.859,33 4.056,34 5.726,35 3.959,36 4.77,37 5.015,38 3.71,39 3.983,40 5.649,41 3.859,42 4.678,43 4.921,44 3.679,45 3.901,46 5.608,47 3.789,48 4.67,49 4.907,50 3.671,51 3.877,52 5.651,53 3.768,54 4.65,55 4.911,56 3.615,57 3.806,58 5.59,59 3.699,60 4.478,61 4.713,62 3.508,63 3.686,64 5.457,65 3.592,66 0.044,67 0.721,68 10.006,69 4.32,70 5.2}
{0 CHEMBL1975121,1 13.021,2 18.055,3 0.012,4 -0.067,5 0.301,7 3.724,8 3.724,9 5.233,10 1,11 1.432,12 11.56,13 3.351,14 11.226,15 98.009,16 7.387,17 0.667,18 3.884,19 3.994,20 3.445,21 3.476,22 5.028,23 3.446,24 4.369,25 4.527,26 3.749,27 3.827,28 5.47,29 3.777,30 4.586,31 4.77,32 3.805,33 3.962,34 5.647,35 3.885,36 4.661,37 4.862,38 3.719,39 3.94,40 5.74,41 3.838,42 4.7,43 4.94,44 3.627,45 3.88,46 5.723,47 3.761,48 4.555,49 4.788,50 3.483,51 3.751,52 5.551,53 3.632,54 4.429,55 4.676,56 3.406,57 3.611,58 5.505,59 3.498,60 4.305,61 4.553,62 3.297,63 3.473,64 5.357,65 3.374,66 0.02,67 0.594,68 8.816,69 4.13,70 5.2}
{0 CHEMBL1975128,1 11.612,2 14.467,3 0.065,4 0.275,5 0.175,7 4.124,8 4.124,11 1.625,12 9.391,13 3.392,14 11.508,15 99.612,16 11.562,17 0.808,18 3.731,19 3.859,20 3.683,21 3.384,22 4.922,23 3.335,24 4.186,25 4.333,26 4.157,27 3.781,28 5.304,29 3.715,30 4.371,31 4.555,32 4.427,33 3.912,34 5.47,35 3.772,36 4.418,37 4.648,38 4.2,39 3.851,40 5.428,41 3.661,42 4.238,43 4.461,44 4.303,45 3.779,46 5.28,47 3.568,48 4.092,49 4.288,50 4.287,51 3.723,52 5.223,53 3.489,54 3.983,55 4.194,56 4.284,57 3.527,58 5.134,59 3.324,60 3.779,61 3.98,62 3.049,63 3.279,64 4.724,65 3.077,66 0.111,67 0.617,68 1.415,69 2.692,70 5.4}
{0 CHEMBL1975138,1 18.565,2 21.497,3 0.078,4 0.13,5 0.581,6 0.142,7 3.629,8 3.629,11 1.74,12 11.214,13 3.813,14 14.542,15 109.528,16 8.598,17 0.6,18 3.93,19 4.039,20 3.598,21 3.526,22 5.176,23 3.507,24 4.378,25 4.499,26 3.979,27 3.879,28 5.668,29 3.849,30 4.693,31 4.863,32 4.092,33 4.015,34 6.061,35 3.963,36 4.738,37 4.918,38 4.078,39 3.991,40 6.062,41 3.94,42 4.75,43 4.932,44 4.121,45 3.995,46 6.117,47 3.936,48 4.726,49 4.936,50 3.974,51 3.948,52 5.973,53 3.853,54 4.604,55 4.838,56 3.877,57 3.852,58 5.798,59 3.722,60 4.42,61 4.635,62 3.726,63 3.74,64 5.635,65 3.601,66 0.116,67 0.708,68 7.319,69 3.925,70 5.2}
{0 CHEMBL1975208,1 19.939,2 27.31,3 0.028,4 -0.177,5 1.135,6 0.149,7 3.763,8 3.763,11 1.833,12 9.88,13 0.893,14 0.798,15 84.745,16 8.295,17 0.407,18 3.871,19 3.978,20 3.494,21 3.321,22 5.136,23 3.353,24 4.4,25 4.567,26 3.911,27 3.717,28 5.726,29 3.738,30 4.662,31 4.841,32 4.033,33 3.858,34 5.977,35 3.873,36 4.758,37 4.953,38 4.07,39 3.846,40 6.229,41 3.865,42 4.733,43 4.93,44 3.905,45 3.785,46 6.145,47 3.786,48 4.622,49 4.852,50 3.694,51 3.666,52 5.899,53 3.617,54 4.512,55 4.751,56 3.528,57 3.485,58 5.94,59 3.429,60 4.267,61 4.504,62 3.321,63 3.263,64 5.625,65 3.22,66 0.216,67 0.703,68 7.333,69 3.507,70 5.2}
{0 CHEMBL1975233,1 20.274,2 26.657,3 -0.022,4 -0.261,5 0.679,6 0.247,7 3.698,8 3.698,9 5.197,10 1,11 1.854,12 10.136,13 2.202,14 4.851,15 80.166,16 9.346,17 0.522,18 3.645,19 3.752,20 3.384,21 3.157,22 4.97,23 3.182,24 4.093,25 4.245,26 3.727,27 3.471,28 5.404,29 3.48,30 4.24,31 4.382,32 3.831,33 3.591,34 5.609,35 3.583,36 4.313,37 4.488,38 3.71,39 3.519,40 5.659,41 3.483,42 4.265,43 4.459,44 3.621,45 3.368,46 5.643,47 3.352,48 4.116,49 4.312,50 3.544,51 3.291,52 5.466,53 3.258,54 4.089,55 4.315,56 3.315,57 3.222,58 5.352,59 3.164,60 3.839,61 4.017,62 3.323,63 3.072,64 5.343,65 3.056,66 0.128,67 0.521,68 4.197,69 2.486,70 5.3}
{0 CHEMBL1975256,1 12.198,2 8.953,3 0.096,4 0.285,5 0.485,7 3.778,8 3.778,11 1.989,12 9.731,13 2.724,14 7.418,15 103.978,16 10.735,17 0.69,18 3.782,19 3.881,20 3.724,21 3.373,22 5.134,23 3.36,24 4.175,25 4.283,26 4.066,27 3.73,28 5.484,29 3.695,30 4.248,31 4.397,32 3.933,33 3.585,34 5.619,35 3.567,36 4.276,37 4.425,38 4.088,39 3.586,40 5.7,41 3.627,42 4.287,43 4.428,44 4.088,45 3.621,46 5.699,47 3.658,48 4.278,49 4.413,50 4.044,51 3.574,52 5.719,53 3.592,54 4.257,55 4.414,56 3.828,57 3.445,58 5.789,59 3.453,60 4.068,61 4.262,62 3.516,63 3.31,64 5.304,65 3.234,66 0.251,67 0.683,68 2.883,69 2.812,70 5.2}
{0 CHEMBL1975357,1 15.768,2 18.04,3 -0.018,4 -0.248,5 0.467,7 3.916,8 3.916,9 5.611,10 1,11 1.436,12 9.333,13 5.449,14 29.694,15 106.016,16 6.769,17 0.5,18 4.072,19 4.198,20 3.572,21 3.601,22 5.063,23 3.564,24 4.663,25 4.851,26 3.982,27 4.032,28 5.634,29 3.973,30 4.948,31 5.167,32 3.973,33 4.185,34 5.823,35 4.085,36 5.042,37 5.308,38 4.058,39 4.179,40 5.963,41 4.086,42 4.919,43 5.136,44 4.014,45 4.123,46 5.981,47 4.063,48 4.863,49 5.064,50 3.972,51 4.164,52 5.858,53 4.069,54 4.936,55 5.17,56 3.837,57 4.148,58 5.857,59 4.013,60 4.85,61 5.097,62 3.615,63 4.024,64 5.676,65 3.861,66 0.031,67 0.783,68 12.379,69 5.153,70 5.2}
{0 CHEMBL1975418,1 11.401,2 14.466,3 0.044,4 0.208,5 0.211,7 4.151,8 4.151,11 1.411,12 9.167,13 4.09,14 16.728,15 96.138,16 7.693,17 0.75,18 3.85,19 3.977,20 3.477,21 3.454,22 4.931,23 3.432,24 4.339,25 4.505,26 3.774,27 3.822,28 5.328,29 3.775,30 4.515,31 4.728,32 3.769,33 3.875,34 5.439,35 3.802,36 4.576,37 4.807,38 3.769,39 3.85,40 5.514,41 3.786,42 4.529,43 4.765,44 3.675,45 3.811,46 5.452,47 3.736,48 4.481,49 4.706,50 3.665,51 3.818,52 5.4,53 3.73,54 4.492,55 4.732,56 3.531,57 3.785,58 5.35,59 3.66,60 4.395,61 4.654,62 3.225,63 3.621,64 5.183,65 3.459,66 0.098,67 0.666,68 7.852,69 3.512,70 5.2}
{0 CHEMBL1975490,1 24.205,2 35.393,3 0.06,4 0.007,5 0.44,6 0.4,7 4.279,8 4.279,9 5.821,10 1,11 1.56,12 13,13 3.144,14 9.887,15 117.129,16 7.821,17 0.629,18 4.096,19 4.205,20 3.707,21 3.649,22 5.231,23 3.649,24 4.608,25 4.75,26 4.075,27 4.044,28 5.743,29 4.022,30 4.83,31 5.023,32 4.072,33 4.123,34 5.878,35 4.076,36 4.809,37 5,38 4.01,39 4.079,40 5.879,41 4.025,42 4.779,43 4.979,44 3.985,45 4.04,46 5.846,47 3.984,48 4.751,49 4.943,50 3.907,51 4.042,52 5.791,53 3.972,54 4.741,55 4.949,56 3.801,57 3.997,58 5.775,59 3.903,60 4.713,61 4.95,62 3.706,63 3.894,64 5.694,65 3.786,66 0.065,67 0.777,68 9.974,69 4.589,70 5.2}
{0 CHEMBL1975500,1 29.191,2 39.986,3 0.059,4 -0.013,5 0.769,6 0.86,7 3.98,8 3.98,9 5.194,10 1,11 1.621,12 14.294,13 1.97,14 3.881,15 125.906,16 7.94,17 0.486,18 4.171,19 4.28,20 3.771,21 3.691,22 5.383,23 3.697,24 4.663,25 4.81,26 4.135,27 4.069,28 5.888,29 4.058,30 4.941,31 5.106,32 4.287,33 4.254,34 6.185,35 4.234,36 5.018,37 5.201,38 4.212,39 4.255,40 6.237,41 4.211,42 5.023,43 5.233,44 4.115,45 4.221,46 6.185,47 4.148,48 4.896,49 5.11,50 4.041,51 4.11,52 6.025,53 4.048,54 4.837,55 5.031,56 4.064,57 4.041,58 6.198,59 4.001,60 4.79,61 4.993,62 3.945,63 3.978,64 5.99,65 3.929,66 0.138,67 0.842,68 10.645,69 4.97,70 5.2}
{0 CHEMBL1975534,1 10.63,2 9.918,3 0.082,4 -0.122,5 0.446,7 3.148,8 3.148,11 1.871,12 7.222,13 -0.87,14 0.756,15 75.987,16 11.35,17 0.526,18 3.598,19 3.732,20 3.497,21 3.087,22 4.817,23 3.05,24 4.083,25 4.256,26 3.969,27 3.519,28 5.247,29 3.436,30 4.357,31 4.551,32 4.221,33 3.671,34 5.652,35 3.538,36 4.419,37 4.648,38 4.331,39 3.633,40 5.652,41 3.482,42 4.311,43 4.566,44 3.845,45 3.562,46 5.391,47 3.309,48 4.069,49 4.309,50 3.839,51 3.296,52 5.244,53 3.12,54 3.91,55 4.138,56 3.771,57 3.15,58 5.236,59 2.949,60 3.704,61 3.952,62 3.251,63 2.845,64 5.003,65 2.578,66 0.146,67 0.506,68 2.51,69 2.7,70 5.2}
{0 CHEMBL1975647,1 13.35,2 18.993,3 0.009,4 -0.19,5 0.498,7 3.48,8 3.48,11 1.789,12 8.81,13 1.153,14 1.328,15 72.629,16 9.138,17 0.739,18 3.586,19 3.7,20 3.312,21 3.115,22 4.908,23 3.155,24 4.02,25 4.159,26 3.648,27 3.443,28 5.406,29 3.469,30 4.232,31 4.415,32 3.681,33 3.498,34 5.599,35 3.52,36 4.16,37 4.346,38 3.578,39 3.377,40 5.563,41 3.395,42 4.124,43 4.318,44 3.449,45 3.252,46 5.583,47 3.272,48 3.983,49 4.189,50 3.248,51 3.092,52 5.382,53 3.103,54 3.777,55 3.972,56 3.176,57 3.003,58 5.328,59 3.006,60 3.658,61 3.854,62 3.022,63 2.962,64 4.919,65 2.946,66 0.122,67 0.585,68 3.775,69 2.217,70 5.2}
{0 CHEMBL1975787,1 6.079,2 4.338,3 0.11,4 0.068,5 0.413,7 3.912,8 3.912,11 1.904,12 7.7,13 2.764,14 7.641,15 73.213,16 10.368,17 0.727,18 3.488,19 3.566,20 3.369,21 3.179,22 4.857,23 3.163,24 3.929,25 4.018,26 3.798,27 3.574,28 5.399,29 3.541,30 4.137,31 4.248,32 3.865,33 3.61,34 5.594,35 3.587,36 4.119,37 4.255,38 3.723,39 3.519,40 5.714,41 3.492,42 4.042,43 4.214,44 3.572,45 3.407,46 5.448,47 3.366,48 3.955,49 4.107,50 3.586,51 3.247,52 5.506,53 3.228,54 3.741,55 3.94,56 3.065,57 2.87,58 5.234,59 2.823,60 3.365,61 3.543,62 2.96,63 2.245,64 5.371,65 2.365,66 0.137,67 0.533,68 2.252,69 2.343,70 5.2}
{0 CHEMBL1975900,1 17.812,2 27.533,3 0.043,4 -0.043,5 0.449,7 3.868,8 3.868,11 1.828,12 10.087,13 2.027,14 4.107,15 91.283,16 10.241,17 0.48,18 3.659,19 3.748,20 3.482,21 3.297,22 4.918,23 3.293,24 4.095,25 4.212,26 3.84,27 3.62,28 5.376,29 3.602,30 4.321,31 4.472,32 4.022,33 3.71,34 5.746,35 3.645,36 4.287,37 4.482,38 3.645,39 3.576,40 5.473,41 3.49,42 4.206,43 4.386,44 3.608,45 3.497,46 5.46,47 3.453,48 4.118,49 4.247,50 3.652,51 3.448,52 5.554,53 3.439,54 4.078,55 4.211,56 3.609,57 3.362,58 5.576,59 3.351,60 3.962,61 4.125,62 3.584,63 3.235,64 5.441,65 3.195,66 0.116,67 0.475,68 2.863,69 2.453,70 5.2}
{0 CHEMBL1976090,1 6.325,2 5,3 0.168,4 -0.078,5 0.211,7 3.731,8 3.731,11 1.772,12 5.067,13 0.407,14 0.166,15 60.671,16 10.394,17 0.882,18 3.258,19 3.381,20 3.16,21 2.848,22 4.588,23 2.85,24 3.661,25 3.798,26 3.597,27 3.246,28 4.988,29 3.221,30 3.715,31 3.837,32 3.666,33 3.263,34 5.015,35 3.242,36 3.735,37 3.888,38 3.46,39 3.15,40 5.101,41 3.088,42 3.598,43 3.834,44 2.784,45 2.739,46 4.778,47 2.658,48 3.129,49 3.369,50 2.394,51 2.187,52 4.598,53 2.181,54 2.86,55 3.192,56 0.847,57 1.647,58 3.829,59 1.432,60 1.975,61 2.417,62 0.048,63 0.7,64 2.079,65 0.396,66 0.102,67 0.429,68 2.133,69 1.449,70 5.2}
{0 CHEMBL1976093,1 14.469,2 21.18,3 -0.043,4 -0.306,5 0.195,7 3.7,8 3.7,11 1.519,12 11.548,13 3.976,14 15.812,15 120.439,16 7.361,17 0.647,18 4.138,19 4.276,20 3.7,21 3.64,22 5.25,23 3.626,24 4.67,25 4.879,26 4.071,27 4.029,28 5.731,29 4.004,30 4.89,31 5.089,32 4.112,33 4.202,34 5.939,35 4.13,36 5.121,37 5.423,38 4.096,39 4.22,40 5.992,41 4.129,42 4.923,43 5.135,44 4.119,45 4.23,46 5.928,47 4.15,48 5.117,49 5.409,50 4.121,51 4.228,52 6.094,53 4.138,54 4.872,55 5.099,56 4.018,57 4.115,58 5.916,59 4.033,60 4.844,61 5.107,62 3.839,63 3.959,64 5.902,65 3.869,66 0.014,67 0.975,68 11.762,69 4.658,70 5.2}
{0 CHEMBL1976134,3 0.071,4 0.1,5 0.086,7 4.323,8 4.323,11 1.432,12 7.222,13 2.332,14 5.436,15 69.842,16 8.367,17 0.952,18 3.497,19 3.616,20 3.188,21 3.121,22 4.663,23 3.119,24 3.956,25 4.092,26 3.544,27 3.528,28 5.081,29 3.509,30 4.111,31 4.296,32 3.443,33 3.546,34 5.155,35 3.481,36 4.059,37 4.274,38 3.219,39 3.406,40 5.049,41 3.317,42 3.911,43 4.162,44 2.995,45 3.19,46 4.812,47 3.087,48 3.644,49 3.852,50 2.985,51 3.022,52 4.693,53 2.97,54 3.57,55 3.782,56 2.78,57 2.861,58 4.595,59 2.79,60 3.397,61 3.685,62 2.412,63 2.501,64 4.295,65 2.41,66 0.047,67 0.457,68 4.426,69 2.059,70 5.2}
{0 CHEMBL1976220,1 16.529,2 22.806,3 0.094,4 0.112,5 0.294,7 3.686,8 3.686,11 1.748,12 11.852,13 4.293,14 18.433,15 113.392,16 10.461,17 0.733,18 3.861,19 3.964,20 3.757,21 3.555,22 5.061,23 3.508,24 4.303,25 4.417,26 4.172,27 3.952,28 5.527,29 3.873,30 4.535,31 4.697,32 4.187,33 4.039,34 5.66,35 3.938,36 4.547,37 4.725,38 4.199,39 3.971,40 5.719,41 3.867,42 4.523,43 4.716,44 3.904,45 3.861,46 5.693,47 3.738,48 4.364,49 4.567,50 3.929,51 3.682,52 5.55,53 3.592,54 4.218,55 4.427,56 3.598,57 3.589,58 5.249,59 3.471,60 4.146,61 4.364,62 3.698,63 3.533,64 5.181,65 3.393,66 0.061,67 0.601,68 3.899,69 3.226,70 5.2}
{0 CHEMBL1976240,1 12.88,2 17.698,3 0.043,4 0.017,5 0.356,7 3.729,8 3.729,9 5.236,10 1,11 1.486,12 11.577,13 2.173,14 4.721,15 101.21,16 7.393,17 0.643,18 3.932,19 4.052,20 3.485,21 3.498,22 5.093,23 3.474,24 4.411,25 4.571,26 3.783,27 3.855,28 5.517,29 3.808,30 4.646,31 4.84,32 3.862,33 3.996,34 5.711,35 3.922,36 4.722,37 4.928,38 3.805,39 3.985,40 5.812,41 3.894,42 4.777,43 5.014,44 3.761,45 3.952,46 5.878,47 3.846,48 4.681,49 4.917,50 3.64,51 3.844,52 5.747,53 3.738,54 4.554,55 4.796,56 3.538,57 3.712,58 5.672,59 3.611,60 4.457,61 4.714,62 3.371,63 3.586,64 5.519,65 3.476,66 0.033,67 0.657,68 9.398,69 4.163,70 5.2}
{0 CHEMBL1976328,1 19.736,2 29.077,3 0.078,4 0.052,5 0.247,7 3.819,8 3.819,11 1.574,12 11.464,13 5.018,14 25.183,15 116.937,16 8.094,17 0.71,18 3.971,19 4.088,20 3.66,21 3.609,22 5.126,23 3.566,24 4.436,25 4.586,26 4.021,27 4.005,28 5.581,29 3.932,30 4.652,31 4.821,32 4.04,33 4.112,34 5.737,35 4.02,36 4.759,37 4.977,38 3.991,39 4.089,40 5.809,41 3.977,42 4.692,43 4.892,44 3.858,45 3.982,46 5.843,47 3.88,48 4.695,49 4.959,50 3.735,51 3.869,52 5.719,53 3.733,54 4.424,55 4.651,56 3.453,57 3.649,58 5.495,59 3.532,60 4.242,61 4.48,62 3.45,63 3.547,64 5.232,65 3.444,66 0.055,67 0.708,68 9.39,69 4.033,70 5.2}
{0 CHEMBL1976420,1 9.966,2 11.206,3 0.039,4 -0.073,5 0.21,7 3.851,8 3.851,11 1.448,12 8.048,13 3.04,14 9.244,15 82.939,16 7.035,17 0.696,18 3.776,19 3.902,20 3.295,21 3.335,22 4.863,23 3.301,24 4.293,25 4.474,26 3.692,27 3.728,28 5.349,29 3.682,30 4.534,31 4.725,32 3.738,33 3.863,34 5.614,35 3.79,36 4.621,37 4.854,38 3.635,39 3.887,40 5.579,41 3.773,42 4.623,43 4.884,44 3.423,45 3.801,46 5.506,47 3.648,48 4.44,49 4.725,50 3.218,51 3.593,52 5.267,53 3.432,54 4.166,55 4.422,56 3.071,57 3.36,58 5.083,59 3.22,60 4.051,61 4.305,62 2.948,63 3.207,64 4.953,65 3.088,66 0.043,67 0.583,68 8.697,69 3.643,70 5.4}
{0 CHEMBL1976455,1 16.178,2 22.484,3 0.009,4 -0.151,5 0.785,7 3.581,8 3.581,11 1.905,12 9.583,13 1.889,14 3.57,15 78.386,16 9.803,17 0.654,18 3.689,19 3.796,20 3.454,21 3.186,22 5.037,23 3.248,24 4.182,25 4.314,26 3.902,27 3.523,28 6.065,29 3.584,30 4.327,31 4.495,32 3.835,33 3.607,34 5.752,35 3.647,36 4.371,37 4.56,38 3.77,39 3.514,40 5.86,41 3.559,42 4.287,43 4.473,44 3.712,45 3.389,46 5.786,47 3.457,48 4.204,49 4.388,50 3.732,51 3.258,52 5.921,53 3.347,54 4.087,55 4.276,56 3.492,57 3.168,58 5.628,59 3.251,60 3.967,61 4.146,62 3.47,63 3.076,64 5.916,65 3.129,66 0.254,67 0.778,68 3.155,69 2.596,70 5.2}
{0 CHEMBL1976732,1 8.643,2 6.358,3 -0.012,4 -0.096,5 0.717,7 4.476,8 4.476,11 1.829,12 10.067,13 3.68,14 13.545,15 104.337,16 8.922,17 0.735,18 3.999,19 4.103,20 3.712,21 3.494,22 5.262,23 3.535,24 4.511,25 4.652,26 4.154,27 3.892,28 5.804,29 3.938,30 4.735,31 4.902,32 4.139,33 3.974,34 6.042,35 3.997,36 4.803,37 5.043,38 4.162,39 3.948,40 6.123,41 3.956,42 4.638,43 4.803,44 4.184,45 3.924,46 5.971,47 3.976,48 4.732,49 4.908,50 4.16,51 3.983,52 6.072,53 3.998,54 4.67,55 4.845,56 4.055,57 3.91,58 5.963,59 3.914,60 4.616,61 4.826,62 3.881,63 3.752,64 5.915,65 3.729,66 0.23,67 0.89,68 6.387,69 3.859,70 5.2}
{0 CHEMBL1977041,1 20.575,2 25.071,3 0.033,4 -0.034,5 0.611,7 3.692,8 3.692,9 4.975,10 1,11 1.657,12 12.097,13 2.95,14 8.705,15 117.464,16 8.166,17 0.647,18 4.055,19 4.174,20 3.691,21 3.57,22 5.294,23 3.584,24 4.524,25 4.674,26 4.054,27 3.937,28 5.786,29 3.935,30 4.704,31 4.87,32 4.139,33 4.077,34 5.898,35 4.067,36 4.838,37 5.014,38 4.197,39 4.117,40 6.092,41 4.104,42 4.882,43 5.055,44 4.177,45 4.102,46 6.191,47 4.092,48 4.898,49 5.094,50 4.056,51 4.049,52 6.216,53 4.014,54 4.834,55 5.086,56 3.711,57 3.936,58 5.864,59 3.827,60 4.594,61 4.854,62 3.528,63 3.735,64 5.603,65 3.607,66 0.127,67 0.802,68 8.786,69 4.005,70 5.2}
{0 CHEMBL1977135,1 7.745,2 9.649,3 0.031,4 -0.022,5 0.139,7 3.517,8 3.517,11 1.387,12 10.773,13 2.989,14 8.937,15 87.127,16 7.589,17 0.75,18 3.718,19 3.83,20 3.309,21 3.364,22 4.874,23 3.329,24 4.176,25 4.323,26 3.592,27 3.713,28 5.306,29 3.651,30 4.416,31 4.611,32 3.599,33 3.803,34 5.472,35 3.707,36 4.425,37 4.642,38 3.435,39 3.682,40 5.504,41 3.572,42 4.339,43 4.581,44 3.333,45 3.572,46 5.371,47 3.458,48 4.202,49 4.447,50 3.225,51 3.435,52 5.246,53 3.331,54 3.97,55 4.172,56 3.164,57 3.295,58 5.137,59 3.222,60 3.897,61 4.084,62 3.028,63 3.223,64 5.061,65 3.136,66 0.023,67 0.492,68 6.938,69 3.281,70 5.2}
{0 CHEMBL1977148,1 23.252,2 27.981,3 0.065,4 0.041,5 0.55,7 3.889,8 3.889,9 5.133,10 1,11 1.698,12 16.417,13 3.158,14 9.97,15 142.245,16 8.344,17 0.675,18 4.218,19 4.329,20 3.908,21 3.787,22 5.414,23 3.77,24 4.694,25 4.836,26 4.262,27 4.176,28 5.867,29 4.137,30 4.889,31 5.063,32 4.312,33 4.297,34 6.002,35 4.233,36 4.959,37 5.139,38 4.387,39 4.342,40 6.111,41 4.256,42 5.001,43 5.209,44 4.277,45 4.286,46 6.126,47 4.183,48 4.837,49 5.04,50 4.1,51 4.136,52 5.932,53 4.057,54 4.77,55 4.972,56 4.055,57 4.097,58 5.893,59 4.01,60 4.81,61 5.022,62 4.016,63 4.077,64 5.9,65 3.974,66 0.131,67 0.929,68 10.874,69 5.178,70 5.2}
{0 CHEMBL1977223,1 16.433,2 24.041,3 0.023,4 0.129,5 0.348,7 3.878,8 3.878,11 1.546,12 12.074,13 3.692,14 13.629,15 105.211,16 7.669,17 0.7,18 3.963,19 4.096,20 3.564,21 3.506,22 5.103,23 3.493,24 4.461,25 4.635,26 3.895,27 3.885,28 5.544,29 3.849,30 4.674,31 4.893,32 3.858,33 3.939,34 5.711,35 3.873,36 4.689,37 4.931,38 3.828,39 3.863,40 5.75,41 3.804,42 4.579,43 4.805,44 3.788,45 3.772,46 5.717,47 3.74,48 4.499,49 4.724,50 3.727,51 3.747,52 5.574,53 3.696,54 4.462,55 4.694,56 3.619,57 3.699,58 5.522,59 3.627,60 4.376,61 4.605,62 3.425,63 3.644,64 5.389,65 3.537,66 0.1,67 0.761,68 9.097,69 3.933,70 7.1}
{0 CHEMBL1977346,1 16.723,2 26.983,3 0.055,4 0.078,5 0.271,7 3.733,8 3.733,11 1.847,12 6.294,13 2.361,14 5.575,15 72.832,16 14.088,17 0.632,18 3.351,19 3.456,20 3.462,21 3.045,22 4.611,23 3.002,24 3.788,25 3.899,26 3.97,27 3.423,28 5.078,29 3.363,30 4.079,31 4.235,32 4.067,33 3.566,34 5.333,35 3.496,36 4.054,37 4.24,38 3.917,39 3.43,40 5.395,41 3.339,42 3.874,43 4.071,44 4.089,45 3.23,46 5.228,47 3.135,48 3.398,49 3.581,50 3.528,51 3.013,52 4.621,53 2.735,54 2.898,55 3.111,56 3.267,57 2.578,58 3.941,59 2.243,60 2.27,61 2.484,62 3.186,63 2.369,64 3.093,65 1.768,66 0.083,67 0.402,68 2.916,69 1.61,70 5.2}
{0 CHEMBL1977374,1 14.656,2 9.534,3 -0.015,4 -0.08,5 0.448,7 4.375,8 4.375,11 1.632,12 9.25,13 4.555,14 20.749,15 102.338,16 8.27,17 0.656,18 3.973,19 4.096,20 3.639,21 3.512,22 5.136,23 3.519,24 4.524,25 4.698,26 4.062,27 3.922,28 5.667,29 3.924,30 4.752,31 4.97,32 4.102,33 3.991,34 5.918,35 3.982,36 4.743,37 4.97,38 4.095,39 3.956,40 6.058,41 3.956,42 4.636,43 4.823,44 4.027,45 3.977,46 5.779,47 3.961,48 4.697,49 4.881,50 4.055,51 4.037,52 5.876,53 3.996,54 4.824,55 5.058,56 3.978,57 4.002,58 5.948,59 3.94,60 4.713,61 4.969,62 3.794,63 3.832,64 5.811,65 3.767,66 0.112,67 0.905,68 7.634,69 3.988,70 5.2}
{0 CHEMBL1977604,1 22.324,2 29.257,3 0.073,4 -0.043,5 1.192,6 0.765,7 3.897,8 3.897,11 1.927,12 8.346,13 2.204,14 4.86,15 95.444,16 8.871,17 0.207,18 3.908,19 4.009,20 3.642,21 3.455,22 5.12,23 3.447,24 4.482,25 4.63,26 4.105,27 3.906,28 5.742,29 3.887,30 4.783,31 4.969,32 4.265,33 4.077,34 6.039,35 4.042,36 4.858,37 5.033,38 4.428,39 4.087,40 6.4,41 4.078,42 4.81,43 4.958,44 4.311,45 3.978,46 6.415,47 4.006,48 4.779,49 4.965,50 3.981,51 3.803,52 6.259,53 3.793,54 4.627,55 4.828,56 3.877,57 3.653,58 6.266,59 3.612,60 4.42,61 4.638,62 3.373,63 3.561,64 5.53,65 3.397,66 0.202,67 0.806,68 7.068,69 4.217,70 5.2}
{0 CHEMBL1977681,1 5.985,2 3.854,3 0.081,4 0.104,5 0.355,7 3.824,8 3.824,11 1.89,12 7.684,13 2.71,14 7.344,15 73.567,16 9.494,17 0.714,18 3.516,19 3.616,20 3.338,21 3.156,22 4.772,23 3.129,24 3.979,25 4.109,26 3.754,27 3.539,28 5.251,29 3.496,30 4.111,31 4.258,32 3.787,33 3.518,34 5.445,35 3.484,36 4.09,37 4.245,38 3.588,39 3.407,40 5.475,41 3.376,42 4.015,43 4.185,44 3.527,45 3.364,46 5.407,47 3.301,48 3.891,49 4.088,50 3.371,51 3.186,52 5.128,53 3.094,54 3.572,55 3.767,56 2.858,57 2.824,58 4.781,59 2.734,60 3.384,61 3.568,62 2.671,63 2.482,64 5.089,65 2.46,66 0.102,67 0.522,68 3.765,69 2.527,70 5.2}
{0 CHEMBL1977814,1 16.228,2 20.445,3 -0.03,4 -0.074,5 0.58,7 3.873,8 3.873,9 5.957,10 1,11 1.677,12 7.091,13 3.919,14 15.361,15 86.555,16 7.995,17 0.458,18 3.797,19 3.912,20 3.43,21 3.325,22 4.89,23 3.302,24 4.347,25 4.529,26 3.848,27 3.712,28 5.385,29 3.69,30 4.551,31 4.725,32 3.979,33 3.831,34 5.681,35 3.81,36 4.682,37 4.887,38 3.995,39 3.816,40 5.84,41 3.802,42 4.522,43 4.677,44 3.913,45 3.806,46 5.768,47 3.771,48 4.624,49 4.833,50 3.753,51 3.884,52 5.611,53 3.763,54 4.609,55 4.854,56 3.612,57 3.82,58 5.523,59 3.642,60 4.564,61 4.854,62 2.999,63 3.581,64 5.419,65 3.293,66 0.097,67 0.584,68 7.695,69 3.645,70 5.2}
{0 CHEMBL1978014,1 25.777,2 38.364,3 0.013,4 0.026,5 0.507,7 3.905,8 3.905,11 1.525,12 13.484,13 3.596,14 12.929,15 124.203,16 7.421,17 0.6,18 4.14,19 4.277,20 3.719,21 3.666,22 5.232,23 3.65,24 4.683,25 4.869,26 4.086,27 4.087,28 5.69,29 4.05,30 4.94,31 5.155,32 4.115,33 4.223,34 5.947,35 4.146,36 5.05,37 5.306,38 4.063,39 4.17,40 6.046,41 4.089,42 4.909,43 5.161,44 4.017,45 4.053,46 6.003,47 3.995,48 4.767,49 4.981,50 3.952,51 4.021,52 5.859,53 3.957,54 4.765,55 5.005,56 3.82,57 3.965,58 5.781,59 3.871,60 4.687,61 4.949,62 3.65,63 3.881,64 5.628,65 3.762,66 0.096,67 0.917,68 11.616,69 4.762,70 5.2}
{0 CHEMBL1978099,1 30.639,2 45.182,3 0.039,4 -0.133,5 1.036,6 0.4,7 3.923,8 3.923,9 5.314,10 1,11 1.913,12 14.094,13 2.988,14 8.93,15 117.971,16 8.689,17 0.529,18 4.09,19 4.198,20 3.891,21 3.594,22 5.307,23 3.594,24 4.582,25 4.728,26 4.162,27 3.922,28 6.06,29 3.92,30 4.787,31 4.949,32 4.22,33 4.036,34 6.182,35 4.013,36 4.822,37 5.006,38 4.112,39 4.02,40 6.085,41 3.971,42 4.863,43 5.089,44 4.055,45 3.958,46 6.167,47 3.919,48 4.705,49 4.91,50 4.002,51 3.863,52 5.996,53 3.847,54 4.635,55 4.843,56 3.973,57 3.799,58 6.012,59 3.766,60 4.573,61 4.797,62 3.871,63 3.72,64 5.856,65 3.681,66 0.227,67 0.907,68 11.206,69 4.6,70 5.5}
{0 CHEMBL1978200,1 16.821,2 21.151,3 -0.003,4 -0.187,5 0.586,7 3.942,8 3.942,11 1.695,12 10.839,13 3.517,14 12.37,15 113.817,16 8.009,17 0.647,18 4.086,19 4.208,20 3.703,21 3.59,22 5.285,23 3.598,24 4.605,25 4.783,26 4.113,27 3.966,28 5.828,29 3.971,30 4.86,31 5.053,32 4.156,33 4.096,34 6.086,35 4.08,36 4.944,37 5.192,38 4.165,39 4.097,40 6.184,41 4.061,42 4.835,43 5.06,44 4.127,45 4.097,46 5.944,47 4.066,48 4.825,49 5.02,50 4.243,51 4.125,52 6.123,53 4.107,54 4.904,55 5.117,56 4.156,57 4.103,58 6.18,59 4.079,60 4.869,61 5.107,62 3.911,63 3.976,64 6.095,65 3.895,66 0.118,67 0.969,68 9.554,69 4.477,70 5.2}
{0 CHEMBL1978448,1 23.193,2 34.46,3 0.015,4 -0.248,5 0.538,7 4.27,8 4.27,11 1.747,12 8.13,13 2.09,14 4.37,15 86.96,16 8.286,17 0.423,18 3.824,19 3.921,20 3.659,21 3.412,22 4.849,23 3.375,24 4.378,25 4.528,26 3.912,27 3.771,28 5.677,29 3.725,30 4.599,31 4.779,32 3.965,33 3.915,34 5.73,35 3.846,36 4.671,37 4.841,38 3.941,39 3.958,40 5.86,41 3.88,42 4.711,43 4.941,44 3.705,45 3.875,46 5.819,47 3.745,48 4.501,49 4.73,50 3.548,51 3.678,52 5.548,53 3.546,54 4.358,55 4.612,56 3.494,57 3.475,58 5.313,59 3.34,60 4.159,61 4.371,62 3.531,63 3.386,64 5.358,65 3.3,66 0.097,67 0.644,68 9.976,69 3.956,70 6.5}
{0 CHEMBL1978656,1 8.785,2 10.379,3 0.038,4 0.002,5 0.298,7 3.987,8 3.987,11 1.572,12 10.077,13 3.296,14 10.864,15 98.458,16 8.2,17 0.759,18 3.864,19 3.971,20 3.514,21 3.447,22 5.09,23 3.446,24 4.319,25 4.457,26 3.878,27 3.814,28 5.523,29 3.802,30 4.541,31 4.707,32 3.958,33 3.907,34 5.749,35 3.889,36 4.621,37 4.806,38 3.912,39 3.884,40 5.91,41 3.85,42 4.599,43 4.821,44 3.776,45 3.83,46 5.745,47 3.776,48 4.463,49 4.656,50 3.724,51 3.719,52 5.771,53 3.684,54 4.321,55 4.516,56 3.574,57 3.578,58 5.522,59 3.541,60 4.253,61 4.472,62 3.416,63 3.421,64 5.508,65 3.382,66 0.079,67 0.626,68 6.97,69 3.443,70 5.2}
{0 CHEMBL1979057,1 17.232,2 27.874,3 0.073,4 0.006,5 0.166,7 4.224,8 4.224,11 1.482,12 11.038,13 3.917,14 15.345,15 100.096,16 8.105,17 0.733,18 3.874,19 3.987,20 3.528,21 3.5,22 5.016,23 3.49,24 4.363,25 4.499,26 3.913,27 3.911,28 5.513,29 3.88,30 4.592,31 4.78,32 3.895,33 3.984,34 5.662,35 3.925,36 4.58,37 4.779,38 3.768,39 3.91,40 5.642,41 3.832,42 4.517,43 4.745,44 3.621,45 3.803,46 5.526,47 3.711,48 4.429,49 4.668,50 3.477,51 3.698,52 5.409,53 3.594,54 4.237,55 4.466,56 3.319,57 3.509,58 5.259,59 3.411,60 4.044,61 4.264,62 3.187,63 3.322,64 5.072,65 3.239,66 0.03,67 0.624,68 7.081,69 3.31,70 5.2}
{0 CHEMBL1979093,1 21.901,2 28.768,3 0.061,4 0.045,5 0.636,7 3.875,8 3.875,9 5.293,10 1,11 1.705,12 13.2,13 4.163,14 17.331,15 112.132,16 8.295,17 0.667,18 4.021,19 4.128,20 3.667,21 3.551,22 5.277,23 3.565,24 4.487,25 4.623,26 4.034,27 3.921,28 5.739,29 3.923,30 4.687,31 4.837,32 4.113,33 4.037,34 5.957,35 4.029,36 4.797,37 4.98,38 4.056,39 4.031,40 6.025,41 4.004,42 4.772,43 4.974,44 3.933,45 3.957,46 5.986,47 3.91,48 4.703,49 4.928,50 3.776,51 3.824,52 5.852,53 3.772,54 4.497,55 4.707,56 3.626,57 3.663,58 5.793,59 3.611,60 4.397,61 4.627,62 3.515,63 3.614,64 5.468,65 3.532,66 0.168,67 0.783,68 8.236,69 4.157,70 5.2}
{0 CHEMBL1979176,1 20.491,2 29.053,3 0.002,4 -0.125,5 0.997,6 0.247,7 3.869,8 3.869,9 5.121,10 1,11 1.892,12 10.962,13 3.024,14 9.142,15 87.006,16 9.291,17 0.607,18 3.81,19 3.912,20 3.532,21 3.295,22 5.121,23 3.348,24 4.317,25 4.45,26 3.973,27 3.632,28 6.118,29 3.685,30 4.445,31 4.599,32 3.932,33 3.735,34 5.824,35 3.77,36 4.529,37 4.71,38 3.895,39 3.675,40 5.974,41 3.703,42 4.504,43 4.719,44 3.816,45 3.545,46 6.001,47 3.569,48 4.315,49 4.517,50 3.606,51 3.384,52 5.717,53 3.415,54 4.17,55 4.334,56 3.612,57 3.325,58 5.979,59 3.351,60 4.098,61 4.298,62 3.414,63 3.337,64 5.422,65 3.317,66 0.258,67 0.806,68 4.617,69 3.255,70 5.2}
{0 CHEMBL1979252,1 20.099,2 31.28,3 0.043,4 -0.049,5 0.767,7 3.863,8 3.863,11 1.858,12 10.32,13 1.64,14 2.69,15 87.647,16 9.387,17 0.444,18 3.751,19 3.85,20 3.48,21 3.292,22 5.064,23 3.33,24 4.242,25 4.371,26 3.895,27 3.595,28 6.06,29 3.638,30 4.402,31 4.569,32 3.842,33 3.663,34 5.901,35 3.668,36 4.477,37 4.687,38 3.718,39 3.591,40 5.859,41 3.589,42 4.363,43 4.549,44 3.717,45 3.526,46 5.781,47 3.556,48 4.348,49 4.528,50 3.672,51 3.453,52 5.912,53 3.496,54 4.195,55 4.35,56 3.557,57 3.35,58 5.741,59 3.393,60 4.09,61 4.259,62 3.495,63 3.223,64 5.606,65 3.273,66 0.232,67 0.772,68 4.093,69 3.196,70 5.2}
{0 CHEMBL1979318,1 14.138,2 15.449,3 0.075,4 0.21,5 0.219,7 3.772,8 3.772,9 5.438,10 1,11 1.749,12 5.95,13 2.569,14 6.599,15 84.418,16 12.2,17 0.5,18 3.568,19 3.677,20 3.562,21 3.243,22 4.823,23 3.191,24 4.035,25 4.164,26 4.036,27 3.669,28 5.192,29 3.582,30 4.249,31 4.388,32 4.264,33 3.867,34 5.386,35 3.735,36 4.386,37 4.561,38 4.301,39 3.936,40 5.648,41 3.771,42 4.342,43 4.524,44 4.383,45 3.897,46 5.591,47 3.729,48 4.261,49 4.442,50 4.62,51 3.717,52 5.66,53 3.548,54 4.069,55 4.347,56 2.819,57 3.202,58 5.177,59 2.859,60 3.373,61 3.77,62 0.798,63 2.001,64 3.951,65 1.625,66 0.074,67 0.476,68 0.735,69 2.366,70 5.2}
{0 CHEMBL1979357,1 11.192,2 16.54,3 0.033,4 -0.065,5 0.24,7 3.771,8 3.771,11 1.326,12 10.889,13 2.793,14 7.801,15 110.977,16 7.234,17 0.733,18 3.976,19 4.104,20 3.533,21 3.586,22 5.083,23 3.548,24 4.465,25 4.639,26 3.847,27 3.98,28 5.465,29 3.918,30 4.695,31 4.893,32 3.901,33 4.135,34 5.629,35 4.033,36 4.809,37 5.036,38 3.865,39 4.148,40 5.711,41 4.024,42 4.831,43 5.07,44 3.855,45 4.126,46 5.77,47 4.002,48 4.848,49 5.103,50 3.808,51 4.097,52 5.768,53 3.964,54 4.774,55 5.041,56 3.65,57 3.979,58 5.701,59 3.834,60 4.629,61 4.925,62 3.415,63 3.781,64 5.456,65 3.625,66 0.049,67 0.707,68 9.979,69 4.219,70 5.2}
{0 CHEMBL1979516,1 22.451,2 28.471,3 0.087,4 0.035,5 0.52,7 3.753,8 3.753,11 1.776,12 13.813,13 3.307,14 10.939,15 124.211,16 8.645,17 0.629,18 4.065,19 4.179,20 3.78,21 3.665,22 5.299,23 3.643,24 4.534,25 4.675,26 4.152,27 4.046,28 5.81,29 4,30 4.773,31 4.954,32 4.226,33 4.148,34 5.993,35 4.096,36 4.803,37 4.976,38 4.323,39 4.141,40 6.126,41 4.087,42 4.796,43 4.975,44 4.119,45 4.09,46 6.06,47 4.015,48 4.707,49 4.9,50 4.013,51 4.006,52 6.056,53 3.922,54 4.652,55 4.859,56 3.82,57 3.935,58 5.783,59 3.842,60 4.59,61 4.808,62 3.748,63 3.834,64 5.753,65 3.737,66 0.115,67 0.862,68 8.544,69 4.433,70 5.2}
{0 CHEMBL1979554,1 17.502,2 25.951,3 0.079,4 0.136,5 0.479,7 4.15,8 4.15,11 1.825,12 10.846,13 2.821,14 7.958,15 103.455,16 10.191,17 0.552,18 3.79,19 3.885,20 3.61,21 3.423,22 5.034,23 3.424,24 4.24,25 4.354,26 3.993,27 3.784,28 5.5,29 3.772,30 4.459,31 4.607,32 4.046,33 3.864,34 5.819,35 3.807,36 4.478,37 4.667,38 3.986,39 3.77,40 5.699,41 3.687,42 4.33,43 4.525,44 3.693,45 3.613,46 5.537,47 3.564,48 4.242,49 4.386,50 3.816,51 3.6,52 5.612,53 3.591,54 4.212,55 4.329,56 3.887,57 3.548,58 5.725,59 3.562,60 4.181,61 4.329,62 3.769,63 3.439,64 5.702,65 3.429,66 0.145,67 0.565,68 3.359,69 2.701,70 5.2}
{0 CHEMBL1979577,1 23.654,2 31.4,3 0.097,4 0.134,5 0.242,7 3.752,8 3.752,11 1.549,12 14,13 4.31,14 18.576,15 136.903,16 7.856,17 0.611,18 4.146,19 4.272,20 3.789,21 3.771,22 5.312,23 3.722,24 4.619,25 4.78,26 4.172,27 4.164,28 5.78,29 4.092,30 4.853,31 5.031,32 4.202,33 4.293,34 5.99,35 4.193,36 4.945,37 5.181,38 4.221,39 4.262,40 5.993,41 4.142,42 4.801,43 4.991,44 4.103,45 4.17,46 5.95,47 4.069,48 4.795,49 4.997,50 4.114,51 4.149,52 5.942,53 4.044,54 4.81,55 5.025,56 3.917,57 4.125,58 5.86,59 3.996,60 4.688,61 4.906,62 3.782,63 4.014,64 5.724,65 3.876,66 0.066,67 0.856,68 11.537,69 5.002,70 5.2}
{0 CHEMBL1979718,1 17.353,2 24.385,3 0.018,4 -0.061,5 0.209,7 3.632,8 3.632,11 1.519,12 10.577,13 3.61,14 13.034,15 102.598,16 7.676,17 0.724,18 3.918,19 4.045,20 3.521,21 3.479,22 5.059,23 3.465,24 4.414,25 4.589,26 3.881,27 3.867,28 5.523,29 3.833,30 4.583,31 4.766,32 3.88,33 3.981,34 5.639,35 3.918,36 4.724,37 4.93,38 3.827,39 4.021,40 5.785,41 3.925,42 4.748,43 4.994,44 3.817,45 4.003,46 5.728,47 3.898,48 4.697,49 4.93,50 3.776,51 3.967,52 5.712,53 3.863,54 4.608,55 4.837,56 3.593,57 3.848,58 5.612,59 3.732,60 4.533,61 4.805,62 3.352,63 3.617,64 5.483,65 3.482,66 0.045,67 0.707,68 8.575,69 3.701,70 5.2}
{0 CHEMBL1979855,1 26.894,2 34.309,3 0.026,4 -0.015,5 0.533,6 0.247,7 4.224,8 4.224,11 1.536,12 12.829,13 4.763,14 22.689,15 133.542,16 7.649,17 0.579,18 4.198,19 4.323,20 3.782,21 3.762,22 5.38,23 3.743,24 4.696,25 4.864,26 4.155,27 4.149,28 5.846,29 4.111,30 4.965,31 5.154,32 4.221,33 4.295,34 6.11,35 4.235,36 5.11,37 5.354,38 4.218,39 4.28,40 6.212,41 4.214,42 4.994,43 5.209,44 4.211,45 4.209,46 6.227,47 4.166,48 4.949,49 5.16,50 4.17,51 4.206,52 6.136,53 4.157,54 5.011,55 5.218,56 4.192,57 4.241,58 6.225,59 4.184,60 5.069,61 5.302,62 4.1,63 4.247,64 6.187,65 4.171,66 0.06,67 0.92,68 11.5,69 5.121,70 5.2}
{0 CHEMBL1979883,1 24.272,2 29.841,3 0.05,4 -0.017,5 0.242,6 0.247,7 3.74,8 3.74,11 1.549,12 14.545,13 4.695,14 22.045,15 137.916,16 7.856,17 0.611,18 4.147,19 4.27,20 3.795,21 3.76,22 5.296,23 3.714,24 4.627,25 4.802,26 4.14,27 4.138,28 5.737,29 4.067,30 4.8,31 4.968,32 4.194,33 4.274,34 5.9,35 4.175,36 4.945,37 5.181,38 4.221,39 4.262,40 5.992,41 4.142,42 4.8,43 4.994,44 4.073,45 4.151,46 5.939,47 4.044,48 4.745,49 4.954,50 4.014,51 4.078,52 5.85,53 3.983,54 4.706,55 4.899,56 3.957,57 4.076,58 5.777,59 3.966,60 4.747,61 4.981,62 3.834,63 4.062,64 5.719,65 3.912,66 0.05,67 0.859,68 11.463,69 5.013,70 5.2}
{0 CHEMBL1979970,1 10.255,2 11.42,3 0.033,4 0.032,5 0.684,7 4.061,8 4.061,11 1.828,12 9.304,13 2.914,14 8.494,15 78.801,16 8.815,17 0.64,18 3.724,19 3.845,20 3.412,21 3.23,22 5.019,23 3.258,24 4.21,25 4.368,26 3.779,27 3.584,28 5.514,29 3.602,30 4.443,31 4.644,32 3.871,33 3.607,34 5.93,35 3.638,36 4.388,37 4.599,38 3.76,39 3.499,40 5.813,41 3.538,42 4.274,43 4.466,44 3.66,45 3.418,46 5.763,47 3.457,48 4.178,49 4.374,50 3.578,51 3.383,52 5.536,53 3.399,54 4.154,55 4.365,56 3.518,57 3.288,58 5.564,59 3.301,60 4.074,61 4.313,62 3.236,63 3.111,64 5.447,65 3.087,66 0.175,67 0.725,68 5.13,69 2.99,70 5.2}
{0 CHEMBL1980091,1 20.248,2 28.787,3 -0.032,4 -0.35,5 0.441,6 0.547,7 3.219,8 3.219,11 1.413,12 9.458,13 1.187,14 1.408,15 96.178,16 6.064,17 0.192,18 4.073,19 4.232,20 3.465,21 3.511,22 4.961,23 3.461,24 4.704,25 4.942,26 3.832,27 3.961,28 5.487,29 3.879,30 5.006,31 5.258,32 3.924,33 4.176,34 5.82,35 4.048,36 5.18,37 5.47,38 3.91,39 4.21,40 5.974,41 4.066,42 5.092,43 5.373,44 3.836,45 4.141,46 5.904,47 3.99,48 5.088,49 5.398,50 3.734,51 4.029,52 5.933,53 3.878,54 4.862,55 5.131,56 3.485,57 3.926,58 5.7,59 3.751,60 4.919,61 5.248,62 3.199,63 3.818,64 5.602,65 3.585,66 0.064,67 0.82,68 14.124,69 4.741,70 5.5}
{0 CHEMBL1980142,1 20.633,2 28.555,3 0.029,4 -0.084,5 1.457,6 0.247,7 3.869,8 3.869,11 1.926,12 10.571,13 4.411,14 19.455,15 86.145,16 10.534,17 0.567,18 3.808,19 3.904,20 3.612,21 3.292,22 5.196,23 3.373,24 4.352,25 4.468,26 4.152,27 3.637,28 6.492,29 3.729,30 4.483,31 4.642,32 4.082,33 3.731,34 6.052,35 3.804,36 4.564,37 4.735,38 4.117,39 3.666,40 6.246,41 3.773,42 4.525,43 4.696,44 4.029,45 3.545,46 6.224,47 3.669,48 4.44,49 4.641,50 3.784,51 3.36,52 6.098,53 3.465,54 4.214,55 4.392,56 3.705,57 3.248,58 6.123,59 3.342,60 4.07,61 4.228,62 3.648,63 3.254,64 6.008,65 3.317,66 0.469,67 1.081,68 2.325,69 3.273,70 5.2}
{0 CHEMBL1980144,1 22.999,2 30.732,3 0.082,4 0.004,5 0.615,7 3.79,8 3.79,11 1.735,12 13.367,13 2.729,14 7.446,15 117.735,16 8.719,17 0.667,18 3.994,19 4.11,20 3.724,21 3.59,22 5.23,23 3.571,24 4.444,25 4.582,26 4.094,27 3.959,28 5.71,29 3.918,30 4.652,31 4.818,32 4.114,33 4.035,34 5.864,35 3.989,36 4.736,37 4.932,38 4.131,39 3.977,40 5.988,41 3.928,42 4.7,43 4.917,44 3.908,45 3.855,46 6.045,47 3.79,48 4.507,49 4.702,50 3.766,51 3.753,52 5.763,53 3.704,54 4.398,55 4.592,56 3.748,57 3.804,58 5.53,59 3.701,60 4.406,61 4.602,62 3.621,63 3.741,64 5.532,65 3.642,66 0.1,67 0.77,68 7.777,69 3.844,70 5.2}
{0 CHEMBL1980163,1 17.031,2 26.812,3 0.016,4 -0.096,5 0.225,7 3.643,8 3.643,9 5.814,10 1,11 1.428,12 11.72,13 5.045,14 25.447,15 98.708,16 7.795,17 0.821,18 3.845,19 3.952,20 3.469,21 3.465,22 4.988,23 3.447,24 4.31,25 4.448,26 3.777,27 3.813,28 5.424,29 3.775,30 4.528,31 4.715,32 3.789,33 3.882,34 5.552,35 3.818,36 4.527,37 4.749,38 3.612,39 3.766,40 5.501,41 3.68,42 4.422,43 4.658,44 3.53,45 3.714,46 5.375,47 3.621,48 4.303,49 4.506,50 3.475,51 3.701,52 5.283,53 3.605,54 4.296,55 4.512,56 3.366,57 3.64,58 5.264,59 3.52,60 4.204,61 4.461,62 3.118,63 3.393,64 5.066,65 3.258,66 0.02,67 0.572,68 7.496,69 3.539,70 5.2}
{0 CHEMBL1980297,1 20.566,2 25.279,3 0.084,4 0.053,5 0.608,7 3.889,8 3.889,11 1.774,12 15.143,13 3.379,14 11.42,15 135.998,16 8.725,17 0.692,18 4.157,19 4.268,20 3.881,21 3.747,22 5.389,23 3.733,24 4.626,25 4.762,26 4.249,27 4.142,28 5.871,29 4.106,30 4.856,31 5.037,32 4.289,33 4.248,34 6.029,35 4.189,36 4.893,37 5.076,38 4.378,39 4.271,40 6.122,41 4.197,42 4.911,43 5.104,44 4.257,45 4.213,46 6.108,47 4.132,48 4.765,49 4.954,50 4.115,51 4.09,52 6.048,53 4.022,54 4.725,55 4.929,56 4.004,57 4.059,58 5.841,59 3.972,60 4.745,61 4.955,62 3.996,63 4.027,64 5.883,65 3.93,66 0.156,67 0.945,68 9.078,69 4.748,70 5.2}
{0 CHEMBL1980391,1 22.242,2 35.694,3 0.034,4 0.007,5 0.54,7 3.993,8 3.993,9 5.103,10 1,11 1.789,12 7.72,13 4.496,14 20.214,15 94.81,16 9.149,17 0.607,18 3.81,19 3.915,20 3.549,21 3.389,22 5.029,23 3.396,24 4.297,25 4.436,26 3.953,27 3.77,28 5.497,29 3.773,30 4.511,31 4.657,32 4.147,33 3.932,34 5.814,35 3.927,36 4.577,37 4.746,38 4.082,39 3.947,40 5.787,41 3.918,42 4.591,43 4.77,44 4.086,45 3.968,46 5.82,47 3.933,48 4.613,49 4.784,50 4.158,51 3.967,52 5.842,53 3.927,54 4.578,55 4.765,56 4.037,57 3.794,58 5.907,59 3.738,60 4.435,61 4.692,62 3.323,63 3.39,64 5.608,65 3.267,66 0.118,67 0.654,68 5.182,69 3.167,70 5.2}
{0 CHEMBL1980489,1 17.245,2 26.297,3 0.042,4 -0.046,5 0.316,7 3.613,8 3.613,11 1.741,12 10,13 1.362,14 1.856,15 86.478,16 9.228,17 0.5,18 3.65,19 3.75,20 3.39,21 3.265,22 4.891,23 3.262,24 4.084,25 4.214,26 3.709,27 3.573,28 5.336,29 3.555,30 4.302,31 4.475,32 3.722,33 3.63,34 5.66,35 3.57,36 4.274,37 4.484,38 3.476,39 3.517,40 5.421,41 3.431,42 4.186,43 4.389,44 3.491,45 3.45,46 5.388,47 3.412,48 4.107,49 4.249,50 3.568,51 3.409,52 5.526,53 3.405,54 4.067,55 4.213,56 3.44,57 3.3,58 5.55,59 3.291,60 3.94,61 4.129,62 3.258,63 3.162,64 5.294,65 3.107,66 0.08,67 0.487,68 4.255,69 2.619,70 5.2}
{0 CHEMBL1980540,1 17.779,2 25.042,3 0.029,4 -0.095,5 0.89,7 3.869,8 3.869,11 1.987,12 9.76,13 4.133,14 17.081,15 84.976,16 10.479,17 0.63,18 3.712,19 3.809,20 3.533,21 3.265,22 5.045,23 3.307,24 4.211,25 4.327,26 4.011,27 3.616,28 6.083,29 3.654,30 4.392,31 4.555,32 4.027,33 3.702,34 5.883,35 3.721,36 4.371,37 4.539,38 3.951,39 3.612,40 5.86,41 3.636,42 4.333,43 4.507,44 3.831,45 3.465,46 5.896,47 3.5,48 4.218,49 4.411,50 3.561,51 3.293,52 5.702,53 3.321,54 4.02,55 4.18,56 3.688,57 3.191,58 5.98,59 3.237,60 3.876,61 4.049,62 3.355,63 3.226,64 5.227,65 3.212,66 0.267,67 0.756,68 2.391,69 2.742,70 5.2}
{0 CHEMBL1980704,1 7.704,2 5.981,3 -0.006,4 -0.134,5 0.199,7 4.401,8 4.401,11 1.549,12 9.68,13 4.693,14 22.024,15 101.199,16 8.636,17 0.862,18 3.834,19 3.942,20 3.601,21 3.486,22 4.953,23 3.449,24 4.33,25 4.474,26 4,27 3.88,28 5.393,29 3.832,30 4.49,31 4.665,32 4.042,33 3.988,34 5.5,35 3.904,36 4.54,37 4.744,38 3.955,39 3.956,40 5.497,41 3.842,42 4.441,43 4.652,44 3.805,45 3.831,46 5.419,47 3.687,48 4.336,49 4.568,50 3.635,51 3.668,52 5.269,53 3.506,54 4.08,55 4.295,56 3.365,57 3.44,58 5.017,59 3.338,60 3.971,61 4.162,62 3.369,63 3.367,64 5.027,65 3.334,66 0.026,67 0.637,68 6.491,69 3.298,70 5.2}
{0 CHEMBL1980715,1 18.012,2 26.48,3 0.029,4 0.024,5 0.44,6 0.135,7 3.057,8 3.057,9 5.839,10 1,11 1.405,12 14.926,13 5.1,14 26.011,15 112.982,16 5.978,17 0.222,18 4.175,19 4.344,20 3.501,21 3.597,22 5.198,23 3.54,24 4.708,25 4.934,26 3.743,27 3.949,28 5.677,29 3.828,30 5.004,31 5.297,32 3.731,33 4.059,34 5.816,35 3.908,36 4.989,37 5.28,38 3.742,39 4.062,40 5.764,41 3.902,42 4.982,43 5.262,44 3.752,45 4.06,46 5.866,47 3.903,48 5.013,49 5.307,50 3.673,51 4.025,52 5.85,53 3.852,54 4.941,55 5.242,56 3.547,57 3.945,58 5.77,59 3.767,60 4.905,61 5.215,62 3.492,63 3.883,64 5.776,65 3.695,66 0.108,67 0.876,68 15.844,69 5.394,70 5.2}
{0 CHEMBL1980802,1 24.489,2 32.673,3 0.036,4 -0.196,5 1.245,6 0.86,7 3.91,8 3.91,9 10.733,10 2,11 1.93,12 9.259,13 1.036,14 1.074,15 91.857,16 9.556,17 0.414,18 3.873,19 3.958,20 3.612,21 3.32,22 5.194,23 3.378,24 4.361,25 4.471,26 3.995,27 3.673,28 5.704,29 3.719,30 4.673,31 4.815,32 4.137,33 3.819,34 6.115,35 3.855,36 4.728,37 4.892,38 4.124,39 3.825,40 6.118,41 3.851,42 4.743,43 4.91,44 4.156,45 3.88,46 6.108,47 3.902,48 4.772,49 4.928,50 4.279,51 3.966,52 6.219,53 3.99,54 4.829,55 5,56 4.159,57 3.94,58 6.265,59 3.943,60 4.657,61 4.858,62 3.926,63 3.651,64 6.212,65 3.62,66 0.304,67 0.613,68 5.136,69 3.189,70 5.2}
{0 CHEMBL1980896,1 16.823,2 19.516,3 0.074,4 0.067,5 0.417,7 3.689,8 3.689,11 1.875,12 11.893,13 4.335,14 18.795,15 118.155,16 11.281,17 0.71,18 3.864,19 3.956,20 3.821,21 3.583,22 5.077,23 3.534,24 4.323,25 4.433,26 4.402,27 3.999,28 5.545,29 3.914,30 4.545,31 4.688,32 4.349,33 4.089,34 5.716,35 3.992,36 4.585,37 4.756,38 4.443,39 4.066,40 5.77,41 3.952,42 4.563,43 4.724,44 4.403,45 4,46 5.797,47 3.862,48 4.397,49 4.576,50 3.934,51 3.759,52 5.65,53 3.644,54 4.215,55 4.422,56 3.692,57 3.575,58 5.284,59 3.475,60 4.125,61 4.321,62 3.687,63 3.565,64 5.204,65 3.428,66 0.079,67 0.581,68 2.024,69 3.032,70 5.2}
{0 CHEMBL1980995,1 28.268,2 43.083,3 0.039,4 -0.127,5 0.654,6 0.473,7 4.71,8 4.71,9 13.258,10 2,11 1.512,12 8.057,13 3.82,14 14.59,15 131.874,16 7.649,17 0.571,18 4.263,19 4.37,20 3.882,21 3.832,22 5.286,23 3.826,24 4.873,25 5.021,26 4.374,27 4.318,28 5.859,29 4.309,30 5.178,31 5.337,32 4.61,33 4.573,34 6.149,35 4.556,36 5.369,37 5.531,38 4.757,39 4.756,40 6.333,41 4.727,42 5.532,43 5.717,44 4.778,45 4.847,46 6.495,47 4.794,48 5.585,49 5.797,50 4.686,51 4.848,52 6.518,53 4.761,54 5.533,55 5.767,56 4.425,57 4.709,58 6.463,59 4.58,60 5.314,61 5.575,62 3.935,63 4.389,64 6.201,65 4.21,66 0.027,67 0.917,68 12.149,69 5.573,70 6.7}
{0 CHEMBL1981045,1 41.719,2 59.321,3 0.028,4 -0.085,5 0.681,6 0.86,7 3.957,8 3.957,9 22.554,10 4,11 1.52,12 20.111,13 4.509,14 20.327,15 171.392,16 7.46,17 0.48,18 4.516,19 4.617,20 4.078,21 4.021,22 5.62,23 4.019,24 5.059,25 5.205,26 4.424,27 4.41,28 6.128,29 4.392,30 5.333,31 5.51,32 4.565,33 4.601,34 6.441,35 4.556,36 5.382,37 5.58,38 4.475,39 4.627,40 6.422,41 4.545,42 5.411,43 5.637,44 4.408,45 4.617,46 6.362,47 4.515,48 5.329,49 5.55,50 4.378,51 4.518,52 6.329,53 4.43,54 5.269,55 5.476,56 4.331,57 4.435,58 6.332,59 4.366,60 5.192,61 5.389,62 4.253,63 4.388,64 6.263,65 4.308,66 0.115,67 1.127,68 17.065,69 7.815,70 5.2}
{0 CHEMBL1981047,1 32.814,2 45.988,3 -0.016,4 -0.208,5 0.678,6 0.8,7 3.791,8 3.791,9 5.505,10 1,11 1.566,12 15.257,13 2.658,14 7.062,15 135.925,16 7.302,17 0.436,18 4.281,19 4.409,20 3.837,21 3.772,22 5.348,23 3.763,24 4.847,25 5.036,26 4.197,27 4.18,28 5.857,29 4.153,30 5.069,31 5.266,32 4.271,33 4.341,34 6.113,35 4.275,36 5.216,37 5.453,38 4.216,39 4.331,40 6.266,41 4.247,42 5.168,43 5.413,44 4.168,45 4.264,46 6.209,47 4.189,48 5.033,49 5.257,50 4.11,51 4.232,52 6.099,53 4.142,54 5.014,55 5.263,56 3.997,57 4.167,58 5.965,59 4.064,60 4.883,61 5.121,62 3.902,63 4.002,64 5.979,65 3.92,66 0.059,67 1.009,68 13.857,69 5.582,70 5.2}
{0 CHEMBL1981079,1 9.215,2 6.806,3 0.13,4 0.032,5 0.507,7 3.845,8 3.845,11 1.903,12 8.435,13 2.84,14 8.063,15 85.385,16 9.758,17 0.68,18 3.675,19 3.79,20 3.44,21 3.238,22 5.019,23 3.262,24 4.103,25 4.227,26 3.848,27 3.612,28 5.543,29 3.62,30 4.32,31 4.472,32 3.885,33 3.694,34 5.689,35 3.692,36 4.342,37 4.502,38 3.915,39 3.648,40 5.818,41 3.656,42 4.368,43 4.563,44 3.759,45 3.63,46 5.699,47 3.616,48 4.332,49 4.527,50 3.788,51 3.526,52 5.925,53 3.52,54 4.214,55 4.413,56 3.632,57 3.398,58 5.649,59 3.369,60 4.01,61 4.21,62 3.512,63 3.137,64 5.623,65 3.113,66 0.165,67 0.611,68 3.776,69 2.399,70 6.6}
{0 CHEMBL1981410,1 32.729,2 51.248,3 0.026,4 -0.14,5 0.951,6 0.4,7 3.869,8 3.869,11 1.785,12 13.636,13 3.893,14 15.158,15 121.45,16 8.594,17 0.5,18 4.1,19 4.227,20 3.765,21 3.589,22 5.329,23 3.618,24 4.621,25 4.786,26 4.193,27 3.957,28 6.251,29 3.972,30 4.841,31 5.037,32 4.238,33 4.114,34 6.094,35 4.11,36 4.908,37 5.121,38 4.17,39 4.076,40 6.192,41 4.064,42 4.878,43 5.09,44 4.119,45 4.033,46 6.188,47 4.015,48 4.852,49 5.094,50 3.919,51 3.967,52 6.015,53 3.916,54 4.709,55 4.938,56 3.906,57 3.868,58 6.185,59 3.807,60 4.616,61 4.87,62 3.68,63 3.765,64 5.726,65 3.684,66 0.213,67 1.065,68 8.179,69 4.179,70 5.2}
{0 CHEMBL1981720,1 11.723,2 18.33,3 0.007,4 -0.227,5 0.294,7 3.477,8 3.477,11 1.633,12 8.7,13 0.947,14 0.897,15 72.412,16 8.558,17 0.773,18 3.572,19 3.691,20 3.256,21 3.118,22 4.83,23 3.138,24 4.002,25 4.148,26 3.567,27 3.447,28 5.296,29 3.445,30 4.201,31 4.397,32 3.55,33 3.504,34 5.388,35 3.485,36 4.128,37 4.327,38 3.439,39 3.384,40 5.376,41 3.352,42 4.09,43 4.296,44 3.332,45 3.257,46 5.401,47 3.238,48 3.955,49 4.171,50 3.177,51 3.097,52 5.273,53 3.077,54 3.747,55 3.956,56 3.006,57 3.006,58 4.945,59 2.977,60 3.632,61 3.838,62 2.939,63 2.966,64 4.786,65 2.92,66 0.062,67 0.515,68 4.588,69 2.191,70 5.2}
{0 CHEMBL1981725,1 30.651,2 46.372,3 -0.002,4 -0.202,5 0.63,6 0.4,7 3.868,8 3.868,11 1.537,12 18,13 7.069,14 49.964,15 177.726,16 7.757,17 0.654,18 4.48,19 4.603,20 4.092,21 4.042,22 5.599,23 4.031,24 5.003,25 5.175,26 4.462,27 4.432,28 6.104,29 4.406,30 5.269,31 5.483,32 4.538,33 4.582,34 6.331,35 4.53,36 5.322,37 5.54,38 4.501,39 4.6,40 6.376,41 4.53,42 5.352,43 5.591,44 4.527,45 4.608,46 6.447,47 4.536,48 5.285,49 5.505,50 4.518,51 4.594,52 6.369,53 4.531,54 5.244,55 5.452,56 4.466,57 4.567,58 6.314,59 4.495,60 5.236,61 5.462,62 4.42,63 4.505,64 6.309,65 4.433,66 0.029,67 1.294,68 14.719,69 6.593,70 5.2}
{0 CHEMBL1981782,1 14.116,2 19.189,3 0.064,4 0.1,5 0.402,7 3.87,8 3.87,11 1.804,12 10.318,13 3.502,14 12.267,15 86.951,16 9.859,17 0.667,18 3.661,19 3.772,20 3.455,21 3.266,22 4.874,23 3.258,24 4.125,25 4.257,26 3.844,27 3.654,28 5.376,29 3.617,30 4.347,31 4.513,32 3.963,33 3.737,34 5.549,35 3.654,36 4.338,37 4.56,38 3.597,39 3.53,40 5.469,41 3.44,42 4.139,43 4.359,44 3.442,45 3.292,46 5.351,47 3.229,48 3.981,49 4.161,50 3.385,51 3.203,52 5.278,53 3.166,54 3.909,55 4.094,56 3.452,57 3.169,58 5.32,59 3.123,60 3.763,61 3.938,62 3.284,63 3.172,64 4.986,65 3.081,66 0.115,67 0.517,68 3.746,69 2.471,70 5.2}
{0 CHEMBL1982122,1 11.753,2 19.333,3 0.059,4 -0.003,5 0.174,7 3.711,8 3.711,11 1.543,12 10.846,13 3.767,14 14.192,15 107.253,16 8.033,17 0.759,18 3.908,19 4.014,20 3.592,21 3.566,22 5.025,23 3.512,24 4.393,25 4.535,26 3.962,27 3.949,28 5.454,29 3.867,30 4.635,31 4.84,32 3.922,33 4.047,34 5.57,35 3.926,36 4.655,37 4.864,38 3.913,39 4.038,40 5.605,41 3.895,42 4.665,43 4.883,44 3.948,45 4.027,46 5.634,47 3.878,48 4.637,49 4.851,50 3.93,51 3.977,52 5.665,53 3.824,54 4.455,55 4.663,56 3.672,57 3.788,58 5.465,59 3.658,60 4.253,61 4.467,62 3.336,63 3.574,64 5.256,65 3.46,66 0.039,67 0.623,68 8.697,69 4.111,70 5.2}
{0 CHEMBL1982135,1 21.187,2 24.899,3 0.089,4 0.051,5 0.254,7 3.912,8 3.912,11 1.618,12 11.724,13 3.933,14 15.471,15 117.722,16 8.365,17 0.667,18 3.997,19 4.111,20 3.709,21 3.639,22 5.142,23 3.602,24 4.493,25 4.639,26 4.132,27 4.064,28 5.63,29 3.999,30 4.721,31 4.888,32 4.185,33 4.203,34 5.78,35 4.116,36 4.801,37 4.991,38 4.163,39 4.186,40 5.873,41 4.083,42 4.798,43 5.017,44 3.997,45 4.054,46 5.888,47 3.957,48 4.672,49 4.893,50 3.793,51 3.882,52 5.794,53 3.799,54 4.534,55 4.779,56 3.592,57 3.746,58 5.546,59 3.643,60 4.37,61 4.598,62 3.505,63 3.671,64 5.373,65 3.548,66 0.044,67 0.741,68 8.548,69 4.058,70 5.2}
{0 CHEMBL1982167,1 14.378,2 19.112,3 -0.018,4 -0.116,5 0.528,7 3.922,8 3.922,9 10.547,10 2,11 1.609,12 10.821,13 3.044,14 9.268,15 104.649,16 8.14,17 0.71,18 3.955,19 4.058,20 3.603,21 3.489,22 5.163,23 3.501,24 4.433,25 4.574,26 3.938,27 3.833,28 5.605,29 3.84,30 4.577,31 4.729,32 4.028,33 3.938,34 5.761,35 3.934,36 4.665,37 4.832,38 4.021,39 3.96,40 5.909,41 3.938,42 4.717,43 4.922,44 3.933,45 3.951,46 5.881,47 3.903,48 4.651,49 4.86,50 3.884,51 3.85,52 5.838,53 3.817,54 4.541,55 4.723,56 3.762,57 3.7,58 5.763,59 3.688,60 4.393,61 4.571,62 3.617,63 3.602,64 5.61,65 3.566,66 0.083,67 0.68,68 7.807,69 3.895,70 5.2}
{0 CHEMBL1982361,1 15.921,2 24.705,3 0.044,4 -0.05,5 0.422,7 3.772,8 3.772,11 1.741,12 9.318,13 0.903,14 0.816,15 81.89,16 8.744,17 0.5,18 3.655,19 3.759,20 3.342,21 3.229,22 4.939,23 3.245,24 4.09,25 4.225,26 3.639,27 3.52,28 5.397,29 3.53,30 4.313,31 4.494,32 3.683,33 3.56,34 5.744,35 3.546,36 4.303,37 4.513,38 3.488,39 3.465,40 5.611,41 3.425,42 4.203,43 4.404,44 3.456,45 3.419,46 5.481,47 3.404,48 4.108,49 4.261,50 3.544,51 3.365,52 5.551,53 3.395,54 4.087,55 4.232,56 3.507,57 3.251,58 5.784,59 3.287,60 3.96,61 4.149,62 3.173,63 3.081,64 5.556,65 3.066,66 0.103,67 0.571,68 4.701,69 2.779,70 5.2}
{0 CHEMBL1982383,1 13.999,2 16.338,3 0.022,4 -0.165,5 0.407,7 3.792,8 3.792,11 1.618,12 10.906,13 2.868,14 8.223,15 121.363,16 7.51,17 0.629,18 4.163,19 4.298,20 3.726,21 3.658,22 5.317,23 3.652,24 4.682,25 4.87,26 4.099,27 4.053,28 5.789,29 4.028,30 4.94,31 5.152,32 4.184,33 4.204,34 6.034,35 4.151,36 5.096,37 5.364,38 4.155,39 4.203,40 6.128,41 4.144,42 4.922,43 5.146,44 4.204,45 4.212,46 5.977,47 4.166,48 4.963,49 5.173,50 4.248,51 4.257,52 6.141,53 4.214,54 4.985,55 5.197,56 4.142,57 4.265,58 6.049,59 4.184,60 5.014,61 5.262,62 4.025,63 4.157,64 6.085,65 4.055,66 0.081,67 0.982,68 11.853,69 4.748,70 5.2}
{0 CHEMBL1982465,1 28.21,2 34.917,3 0.048,4 -0.03,5 0.324,6 0.249,7 3.74,8 3.74,9 5.398,10 1,11 1.587,12 15.944,13 4.383,14 19.21,15 146.991,16 7.9,17 0.55,18 4.245,19 4.362,20 3.899,21 3.842,22 5.359,23 3.806,24 4.76,25 4.922,26 4.244,27 4.232,28 5.846,29 4.169,30 4.967,31 5.153,32 4.286,33 4.368,34 6,35 4.272,36 5.028,37 5.251,38 4.284,39 4.357,40 6.05,41 4.234,42 4.966,43 5.19,44 4.136,45 4.239,46 6.045,47 4.123,48 4.789,49 4.993,50 4.075,51 4.131,52 5.897,53 4.042,54 4.753,55 4.937,56 4.054,57 4.149,58 5.804,59 4.052,60 4.836,61 5.049,62 4.07,63 4.198,64 5.812,65 4.065,66 0.04,67 0.933,68 12.423,69 5.594,70 5.2}
{0 CHEMBL1982466,1 20.473,2 24.801,3 0.065,4 0.062,5 0.364,7 3.88,8 3.88,11 1.605,12 14.515,13 4.2,14 17.636,15 134.53,16 8.265,17 0.73,18 4.123,19 4.243,20 3.82,21 3.742,22 5.292,23 3.708,24 4.595,25 4.748,26 4.192,27 4.142,28 5.745,29 4.086,30 4.786,31 4.954,32 4.221,33 4.26,34 5.882,35 4.177,36 4.89,37 5.088,38 4.285,39 4.276,40 5.977,41 4.169,42 4.875,43 5.086,44 4.188,45 4.185,46 5.986,47 4.082,48 4.703,49 4.895,50 4.01,51 4.053,52 5.83,53 3.973,54 4.69,55 4.912,56 3.875,57 4.007,58 5.737,59 3.902,60 4.66,61 4.883,62 3.754,63 3.936,64 5.703,65 3.818,66 0.068,67 0.859,68 9.939,69 4.596,70 5.2}
{0 CHEMBL1982476,1 20.844,2 25.929,3 0.091,4 0.069,5 0.412,7 3.753,8 3.753,11 1.803,12 13.226,13 3.418,14 11.679,15 124.051,16 9.224,17 0.647,18 4.011,19 4.119,20 3.785,21 3.643,22 5.241,23 3.615,24 4.467,25 4.597,26 4.171,27 4.035,28 5.729,29 3.98,30 4.69,31 4.844,32 4.25,33 4.15,34 5.905,35 4.083,36 4.751,37 4.912,38 4.331,39 4.131,40 6.044,41 4.064,42 4.735,43 4.911,44 4.105,45 4.068,46 5.962,47 3.975,48 4.648,49 4.844,50 3.984,51 3.94,52 5.924,53 3.854,54 4.527,55 4.724,56 3.764,57 3.837,58 5.669,59 3.747,60 4.494,61 4.714,62 3.747,63 3.771,64 5.635,65 3.663,66 0.108,67 0.741,68 6.984,69 3.904,70 5.2}
{0 CHEMBL1982506,1 12.785,2 12.791,3 -0.01,4 -0.175,5 0.584,6 0.8,7 3.793,8 3.793,9 10.396,10 2,11 1.709,12 6.947,13 0.81,14 0.656,15 65.167,16 8.905,17 0.524,18 3.531,19 3.607,20 3.239,21 3.039,22 4.814,23 3.086,24 4.032,25 4.149,26 3.62,27 3.409,28 5.329,29 3.458,30 4.115,31 4.191,32 3.743,33 3.516,34 5.542,35 3.565,36 4.182,37 4.294,38 3.664,39 3.486,40 5.663,41 3.509,42 4.239,43 4.411,44 3.41,45 3.334,46 5.479,47 3.328,48 4.008,49 4.191,50 3.164,51 3.055,52 5.308,53 3.03,54 3.826,55 4.063,56 2.846,57 2.746,58 5.126,59 2.694,60 3.441,61 3.659,62 2.252,63 2.313,64 4.811,65 2.25,66 0.138,67 0.415,68 3.9,69 2.482,70 5.2}
{0 CHEMBL1982563,1 15.194,2 18.663,3 -0.033,4 -0.252,5 0.251,7 3.783,8 3.783,9 5.285,10 1,11 1.599,12 11.484,13 3.989,14 15.915,15 118.055,16 7.51,17 0.647,18 4.125,19 4.253,20 3.702,21 3.63,22 5.255,23 3.623,24 4.657,25 4.847,26 4.074,27 4.01,28 5.743,29 3.993,30 4.855,31 5.045,32 4.147,33 4.165,34 5.95,35 4.117,36 5.072,37 5.344,38 4.106,39 4.186,40 6.021,41 4.12,42 4.882,43 5.09,44 4.123,45 4.2,46 5.893,47 4.133,48 5.006,49 5.258,50 4.172,51 4.216,52 6.073,53 4.153,54 4.907,55 5.118,56 4.065,57 4.181,58 5.968,59 4.1,60 4.932,61 5.192,62 3.883,63 4.035,64 5.956,65 3.928,66 0.034,67 0.932,68 11.212,69 4.771,70 5.2}
{0 CHEMBL1982610,1 10.269,2 10.828,3 0.003,4 -0.183,5 0.191,7 3.7,8 3.7,11 1.947,12 6.611,13 2.692,14 7.248,15 76.921,16 14.863,17 0.55,18 3.383,19 3.47,20 3.544,21 3.119,22 4.615,23 3.067,24 3.845,25 3.951,26 4.044,27 3.547,28 5.142,29 3.456,30 4.04,31 4.175,32 4.28,33 3.606,34 5.32,35 3.496,36 3.931,37 4.082,38 4.125,39 3.54,40 5.256,41 3.357,42 3.677,43 3.844,44 3.88,45 3.233,46 4.899,47 3.081,48 3.482,49 3.613,50 3.759,51 3.159,52 4.761,53 2.995,54 3.452,55 3.593,56 3.691,57 3.121,58 4.741,59 2.864,60 3.204,61 3.366,62 4.066,63 2.849,64 4.723,65 2.518,66 0.073,67 0.364,68 5.054,69 1.428,70 5.2}
{0 CHEMBL1982660,1 20.491,2 29.053,3 0.002,4 -0.125,5 0.915,6 0.247,7 3.869,8 3.869,9 5.121,10 1,11 1.892,12 10.962,13 3.452,14 11.917,15 86.634,16 9.291,17 0.607,18 3.81,19 3.912,20 3.532,21 3.295,22 5.119,23 3.348,24 4.317,25 4.449,26 3.976,27 3.626,28 6.119,29 3.68,30 4.452,31 4.615,32 3.946,33 3.72,34 5.893,35 3.755,36 4.483,37 4.659,38 3.884,39 3.672,40 5.909,41 3.695,42 4.496,43 4.704,44 3.8,45 3.562,46 5.941,47 3.587,48 4.369,49 4.577,50 3.617,51 3.396,52 5.793,53 3.432,54 4.17,55 4.334,56 3.612,57 3.325,58 5.979,59 3.351,60 4.098,61 4.298,62 3.414,63 3.337,64 5.422,65 3.317,66 0.258,67 0.806,68 4.617,69 3.255,70 5.2}
{0 CHEMBL1982711,1 4.426,2 2.992,3 0.099,4 0.103,5 0.246,7 3.763,8 3.763,11 1.71,12 7.842,13 2.217,14 4.916,15 73.462,16 9.37,17 0.762,18 3.504,19 3.609,20 3.258,21 3.144,22 4.76,23 3.137,24 3.945,25 4.062,26 3.651,27 3.539,28 5.25,29 3.511,30 4.157,31 4.304,32 3.723,33 3.634,34 5.394,35 3.581,36 4.15,37 4.305,38 3.7,39 3.563,40 5.44,41 3.496,42 4.105,43 4.322,44 3.306,45 3.388,46 5.201,47 3.27,48 3.854,49 4.088,50 3.137,51 3.146,52 4.907,53 3.033,54 3.526,55 3.713,56 2.891,57 2.846,58 4.746,59 2.77,60 3.353,61 3.544,62 2.779,63 2.525,64 4.765,65 2.502,66 0.067,67 0.422,68 3.578,69 2.097,70 5.5}
{0 CHEMBL1982866,1 7.811,2 5.264,3 -0.046,4 -0.187,5 0.213,7 3.58,8 3.58,9 5.118,10 1,11 1.68,12 8.318,13 3.129,14 9.788,15 86.715,16 8.508,17 0.708,18 3.726,19 3.837,20 3.415,21 3.282,22 4.88,23 3.272,24 4.221,25 4.386,26 3.733,27 3.629,28 5.321,29 3.604,30 4.343,31 4.53,32 3.73,33 3.726,34 5.391,35 3.656,36 4.374,37 4.584,38 3.678,39 3.689,40 5.41,41 3.617,42 4.362,43 4.576,44 3.684,45 3.666,46 5.364,47 3.618,48 4.357,49 4.559,50 3.675,51 3.683,52 5.417,53 3.611,54 4.391,55 4.612,56 3.595,57 3.65,58 5.38,59 3.525,60 4.322,61 4.575,62 3.398,63 3.416,64 5.293,65 3.28,66 0.053,67 0.556,68 5.999,69 3.078,70 5.2}
{0 CHEMBL1982874,1 7.489,2 4.198,3 0.047,4 -0.085,5 0.214,7 4.548,8 4.548,11 1.623,12 10,13 5.392,14 29.077,15 113.348,16 8.586,17 0.735,18 4,19 4.111,20 3.745,21 3.639,22 5.115,23 3.61,24 4.505,25 4.654,26 4.132,27 4.023,28 5.611,29 3.98,30 4.691,31 4.888,32 4.105,33 4.087,34 5.759,35 4.029,36 4.72,37 4.925,38 4.08,39 4.112,40 5.754,41 4.049,42 4.737,43 4.922,44 4.184,45 4.202,46 5.759,47 4.117,48 4.824,49 5.025,50 4.125,51 4.223,52 5.836,53 4.094,54 4.755,55 4.985,56 4.036,57 4.076,58 5.729,59 3.96,60 4.598,61 4.82,62 3.965,63 3.884,64 5.685,65 3.797,66 0.04,67 0.813,68 7.852,69 4.051,70 5.2}
{0 CHEMBL1982880,1 16.345,2 25.92,3 -0.024,4 -0.052,5 0.474,7 3.921,8 3.921,9 10.691,10 2,11 1.617,12 10.154,13 3.941,14 15.531,15 100.01,16 8.079,17 0.759,18 3.898,19 4.009,20 3.546,21 3.411,22 5.09,23 3.425,24 4.369,25 4.518,26 3.874,27 3.747,28 5.502,29 3.756,30 4.501,31 4.673,32 3.926,33 3.826,34 5.635,35 3.819,36 4.552,37 4.745,38 3.844,39 3.807,40 5.631,41 3.783,42 4.573,43 4.796,44 3.801,45 3.79,46 5.636,47 3.745,48 4.514,49 4.733,50 3.734,51 3.743,52 5.555,53 3.699,54 4.436,55 4.628,56 3.615,57 3.666,58 5.481,59 3.622,60 4.386,61 4.609,62 3.493,63 3.597,64 5.393,65 3.521,66 0.094,67 0.673,68 7.569,69 3.561,70 5.2}
{0 CHEMBL1982924,1 11.833,2 15.343,3 0.034,4 -0.049,5 0.414,7 3.808,8 3.808,9 5.171,10 1,11 1.508,12 10.808,13 3.319,14 11.016,15 99.795,16 7.986,17 0.759,18 3.876,19 3.982,20 3.51,21 3.475,22 5.059,23 3.467,24 4.345,25 4.479,26 3.846,27 3.845,28 5.508,29 3.82,30 4.537,31 4.705,32 3.879,33 3.932,34 5.672,35 3.884,36 4.569,37 4.759,38 3.802,39 3.881,40 5.703,41 3.824,42 4.559,43 4.765,44 3.764,45 3.818,46 5.742,47 3.752,48 4.452,49 4.661,50 3.629,51 3.734,52 5.543,53 3.666,54 4.399,55 4.625,56 3.536,57 3.613,58 5.529,59 3.552,60 4.219,61 4.422,62 3.404,63 3.501,64 5.331,65 3.437,66 0.029,67 0.599,68 7.426,69 3.604,70 5.2}
{0 CHEMBL1982957,1 2.824,2 2.351,3 0.089,4 0.112,5 0.122,7 3.898,8 3.898,11 1.444,12 9.333,13 3.071,14 9.433,15 93.793,16 8.035,17 0.815,18 3.777,19 3.888,20 3.417,21 3.43,22 4.978,23 3.41,24 4.228,25 4.355,26 3.772,27 3.824,28 5.44,29 3.783,30 4.462,31 4.631,32 3.801,33 3.924,34 5.588,35 3.857,36 4.487,37 4.678,38 3.715,39 3.878,40 5.591,41 3.798,42 4.478,43 4.698,44 3.657,45 3.81,46 5.527,47 3.726,48 4.368,49 4.578,50 3.571,51 3.702,52 5.468,53 3.626,54 4.27,55 4.485,56 3.41,57 3.568,58 5.418,59 3.483,60 4.108,61 4.337,62 3.215,63 3.422,64 5.127,65 3.321,66 0.031,67 0.537,68 6.539,69 3.101,70 5.2}
{0 CHEMBL1982980,1 16.577,2 14.81,3 0.038,4 0.026,5 0.405,7 3.979,8 3.979,9 5.74,10 1,11 1.569,12 11.172,13 7.539,14 56.843,15 117.745,16 8.315,17 0.516,18 4.03,19 4.129,20 3.677,21 3.636,22 5.163,23 3.597,24 4.546,25 4.698,26 4.079,27 4.025,28 5.698,29 3.964,30 4.768,31 4.924,32 4.328,33 4.189,34 5.907,35 4.108,36 4.904,37 5.089,38 4.16,39 4.218,40 5.958,41 4.118,42 4.985,43 5.213,44 4.001,45 4.206,46 5.956,47 4.075,48 4.964,49 5.185,50 3.952,51 4.13,52 6.019,53 4.004,54 4.866,55 5.097,56 3.793,57 3.983,58 5.938,59 3.839,60 4.646,61 4.86,62 3.798,63 3.847,64 5.747,65 3.744,66 0.054,67 0.646,68 9.254,69 4.896,70 5.2}
{0 CHEMBL1982992,1 13.245,2 22.275,3 0.078,4 -0.032,5 0.244,7 3.653,8 3.653,11 1.94,12 6.722,13 3.459,14 11.963,15 73.29,16 10.683,17 0.8,18 3.424,19 3.503,20 3.344,21 3.111,22 4.686,23 3.077,24 3.841,25 3.937,26 3.738,27 3.475,28 5.12,29 3.424,30 4.011,31 4.147,32 3.825,33 3.493,34 5.242,35 3.418,36 3.966,37 4.148,38 3.653,39 3.291,40 5.231,41 3.236,42 3.801,43 3.981,44 3.283,45 3.217,46 4.935,47 3.12,48 3.665,49 3.818,50 3.368,51 3.194,52 4.906,53 3.095,54 3.635,55 3.779,56 3.252,57 3.092,58 4.868,59 2.958,60 3.336,61 3.485,62 3.031,63 2.589,64 4.827,65 2.464,66 0.095,67 0.385,68 2.09,69 1.967,70 5.2}
{0 CHEMBL1983006,1 21.471,2 26.739,3 0.022,4 -0.227,5 0.951,6 0.86,7 3.698,8 3.698,9 5.044,10 1,11 1.966,12 10.833,13 1.321,14 1.744,15 81.883,16 10.228,17 0.48,18 3.673,19 3.758,20 3.466,21 3.155,22 5.107,23 3.216,24 4.09,25 4.202,26 3.825,27 3.469,28 5.629,29 3.517,30 4.266,31 4.385,32 3.934,33 3.593,34 5.754,35 3.63,36 4.328,37 4.456,38 3.973,39 3.517,40 5.93,41 3.562,42 4.311,43 4.472,44 3.776,45 3.4,46 5.861,47 3.424,48 4.159,49 4.331,50 3.689,51 3.303,52 5.655,53 3.32,54 4.109,55 4.256,56 3.431,57 3.223,58 5.594,59 3.236,60 3.923,61 4.087,62 3.523,63 3.104,64 5.733,65 3.124,66 0.258,67 0.517,68 2.959,69 2.41,70 5.2}
{0 CHEMBL1983025,1 23.654,2 31.4,3 0.087,4 0.12,5 0.315,7 3.757,8 3.757,11 1.514,12 14.743,13 5.357,14 28.702,15 145.951,16 7.558,17 0.579,18 4.234,19 4.363,20 3.84,21 3.849,22 5.364,23 3.793,24 4.725,25 4.895,26 4.213,27 4.244,28 5.82,29 4.161,30 4.975,31 5.173,32 4.294,33 4.388,34 6.058,35 4.286,36 5.069,37 5.293,38 4.292,39 4.393,40 6.138,41 4.266,42 5.039,43 5.279,44 4.152,45 4.304,46 6.074,47 4.171,48 4.904,49 5.121,50 4.181,51 4.24,52 5.99,53 4.13,54 4.902,55 5.105,56 4.099,57 4.262,58 5.946,59 4.132,60 4.887,61 5.111,62 3.949,63 4.211,64 5.872,65 4.056,66 0.075,67 0.937,68 13.484,69 5.723,70 5.2}
{0 CHEMBL1983111,1 36.698,2 62.329,3 0.026,4 -0.132,5 0.954,6 0.847,7 4.044,8 4.044,11 1.774,12 13.235,13 3.237,14 10.476,15 120.65,16 8.043,17 0.316,18 4.206,19 4.332,20 3.823,21 3.691,22 5.321,23 3.704,24 4.804,25 4.982,26 4.279,27 4.103,28 6.291,29 4.095,30 5.031,31 5.255,32 4.23,33 4.203,34 6.147,35 4.167,36 5.049,37 5.268,38 4.317,39 4.175,40 6.402,41 4.154,42 5.011,43 5.234,44 4.195,45 4.149,46 6.231,47 4.115,48 5.001,49 5.224,50 4.197,51 4.117,52 6.215,53 4.093,54 5.018,55 5.255,56 4.103,57 4.055,58 6.272,59 4.035,60 4.878,61 5.114,62 3.942,63 3.975,64 6.096,65 3.925,66 0.189,67 1.145,68 10.785,69 5.168,70 5.8}
{0 CHEMBL1983195,1 12.346,2 15.857,3 -0.027,4 -0.255,5 0.597,7 3.886,8 3.886,11 1.597,12 10.321,13 3.998,14 15.986,15 102.809,16 7.843,17 0.677,18 3.99,19 4.097,20 3.607,21 3.508,22 5.145,23 3.515,24 4.496,25 4.656,26 3.961,27 3.857,28 5.634,29 3.853,30 4.673,31 4.877,32 3.975,33 3.916,34 5.764,35 3.897,36 4.674,37 4.849,38 4.035,39 3.945,40 5.901,41 3.938,42 4.778,43 4.981,44 4.007,45 3.995,46 5.932,47 3.969,48 4.703,49 4.89,50 3.953,51 4,52 5.798,53 3.952,54 4.686,55 4.881,56 3.758,57 3.962,58 5.719,59 3.859,60 4.618,61 4.885,62 3.458,63 3.71,64 5.513,65 3.573,66 0.052,67 0.711,68 8.872,69 4.121,70 5.2}
{0 CHEMBL1983309,1 17.748,2 22.442,3 0.006,4 -0.103,5 0.404,7 4.011,8 4.011,9 10.372,10 2,11 1.868,12 10,13 3.872,14 14.991,15 89.626,16 9.69,17 0.64,18 3.716,19 3.79,20 3.548,21 3.336,22 4.935,23 3.312,24 4.193,25 4.305,26 3.96,27 3.686,28 5.42,29 3.652,30 4.286,31 4.392,32 3.952,33 3.754,34 5.533,35 3.702,36 4.336,37 4.458,38 4.012,39 3.702,40 5.688,41 3.629,42 4.306,43 4.493,44 3.725,45 3.54,46 5.498,47 3.475,48 4.228,49 4.404,50 3.645,51 3.443,52 5.485,53 3.376,54 4.047,55 4.204,56 3.511,57 3.413,58 5.249,59 3.327,60 4.033,61 4.216,62 3.448,63 3.318,64 5.264,65 3.233,66 0.103,67 0.486,68 4.341,69 3.187,70 5.2}
{0 CHEMBL1983449,1 18.479,2 25.885,3 0.042,4 -0.076,5 0.195,7 3.869,8 3.869,11 1.539,12 10.087,13 2.317,14 5.368,15 90.445,16 7.684,17 0.48,18 3.79,19 3.896,20 3.372,21 3.357,22 5.001,23 3.343,24 4.22,25 4.388,26 3.667,27 3.658,28 5.366,29 3.631,30 4.379,31 4.545,32 3.706,33 3.745,34 5.663,35 3.687,36 4.476,37 4.701,38 3.501,39 3.705,40 5.544,41 3.594,42 4.423,43 4.672,44 3.488,45 3.609,46 5.44,47 3.527,48 4.294,49 4.488,50 3.539,51 3.52,52 5.531,53 3.493,54 4.291,55 4.491,56 3.456,57 3.46,58 5.567,59 3.424,60 4.176,61 4.378,62 3.273,63 3.39,64 5.357,65 3.316,66 0.049,67 0.564,68 7.614,69 3.552,70 5.2}
{0 CHEMBL1983534,1 9.712,2 15.848,3 0.042,4 -0.035,5 0.102,7 3.709,8 3.709,11 1.457,12 10.696,13 4.216,14 17.77,15 96.425,16 8.354,17 0.846,18 3.747,19 3.851,20 3.485,21 3.454,22 4.862,23 3.395,24 4.213,25 4.349,26 3.858,27 3.826,28 5.284,29 3.744,30 4.405,31 4.594,32 3.766,33 3.887,34 5.36,35 3.759,36 4.39,37 4.603,38 3.623,39 3.797,40 5.296,41 3.637,42 4.286,43 4.511,44 3.613,45 3.689,46 5.196,47 3.536,48 4.183,49 4.394,50 3.584,51 3.634,52 5.124,53 3.476,54 4.024,55 4.224,56 3.39,57 3.458,58 4.99,59 3.329,60 3.806,61 3.995,62 3.053,63 3.243,64 4.82,65 3.149,66 0.025,67 0.514,68 6.625,69 3.182,70 5.2}
{0 CHEMBL1983923,1 24.019,2 41.924,3 -0.024,4 -0.242,5 0.306,7 3.694,8 3.694,11 1.426,12 10.286,13 4.016,14 16.124,15 113.771,16 7.085,17 0.548,18 4.068,19 4.214,20 3.606,21 3.566,22 5.117,23 3.545,24 4.596,25 4.806,26 3.933,27 3.933,28 5.588,29 3.891,30 4.802,31 5.04,32 3.877,33 4.053,34 5.704,35 3.96,36 4.87,37 5.148,38 3.787,39 4.017,40 5.705,41 3.886,42 4.75,43 5.023,44 3.828,45 3.922,46 5.639,47 3.84,48 4.662,49 4.893,50 3.882,51 3.923,52 5.646,53 3.867,54 4.717,55 4.953,56 3.87,57 3.968,58 5.683,59 3.896,60 4.764,61 5.01,62 3.812,63 4.009,64 5.635,65 3.907,66 0.068,67 0.861,68 11.686,69 4.229,70 5.2}
{0 CHEMBL1983932,1 17.68,2 24.957,3 0.003,4 -0.173,5 0.341,7 3.662,8 3.662,9 5.181,10 1,11 1.778,12 10.043,13 3.064,14 9.387,15 89.497,16 10.368,17 0.68,18 3.713,19 3.816,20 3.558,21 3.287,22 4.939,23 3.288,24 4.169,25 4.302,26 3.976,27 3.624,28 5.438,29 3.61,30 4.342,31 4.506,32 3.975,33 3.725,34 5.52,35 3.688,36 4.334,37 4.508,38 3.941,39 3.651,40 5.579,41 3.596,42 4.339,43 4.547,44 3.704,45 3.544,46 5.536,47 3.486,48 4.201,49 4.4,50 3.824,51 3.366,52 5.539,53 3.346,54 3.993,55 4.17,56 3.444,57 3.324,58 5.141,59 3.26,60 3.953,61 4.149,62 3.599,63 3.342,64 5.122,65 3.247,66 0.087,67 0.538,68 3.204,69 2.816,70 5.2}
{0 CHEMBL1983945,1 11.193,2 13.185,3 0.063,4 0.007,5 0.26,7 3.737,8 3.737,11 1.486,12 13.138,13 2.114,14 4.469,15 113.915,16 7.67,17 0.688,18 4.01,19 4.137,20 3.601,21 3.597,22 5.181,23 3.578,24 4.478,25 4.633,26 3.921,27 3.976,28 5.599,29 3.93,30 4.739,31 4.941,32 3.928,33 4.075,34 5.853,35 3.991,36 4.785,37 5.022,38 3.797,39 4.002,40 5.822,41 3.901,42 4.699,43 4.934,44 3.794,45 3.922,46 5.794,47 3.834,48 4.672,49 4.901,50 3.805,51 3.89,52 5.829,53 3.815,54 4.659,55 4.905,56 3.706,57 3.83,58 5.764,59 3.749,60 4.498,61 4.728,62 3.578,63 3.726,64 5.593,65 3.642,66 0.042,67 0.752,68 9.418,69 4.064,70 5.6}
{0 CHEMBL1983963,1 17.311,2 24.218,3 0.057,4 -0.04,5 0.421,7 3.686,8 3.686,11 1.606,12 11.852,13 2.904,14 8.435,15 103.173,16 8.169,17 0.733,18 3.913,19 4.029,20 3.555,21 3.462,22 5.137,23 3.472,24 4.368,25 4.51,26 3.914,27 3.838,28 5.607,29 3.824,30 4.559,31 4.728,32 3.915,33 3.931,34 5.709,35 3.896,36 4.643,37 4.849,38 3.884,39 3.881,40 5.825,41 3.832,42 4.601,43 4.814,44 3.704,45 3.75,46 5.778,47 3.704,48 4.431,49 4.658,50 3.574,51 3.605,52 5.588,53 3.558,54 4.272,55 4.485,56 3.384,57 3.525,58 5.387,59 3.452,60 4.194,61 4.423,62 3.332,63 3.459,64 5.227,65 3.367,66 0.077,67 0.681,68 7.505,69 3.433,70 5.2}
{0 CHEMBL1984038,1 29.987,2 41.012,3 0.029,4 -0.082,5 0.831,6 0.86,7 4.208,8 4.208,9 16.409,10 3,11 1.658,12 13.949,13 4.706,14 22.145,15 150.239,16 8.268,17 0.558,18 4.306,19 4.393,20 4.067,21 3.878,22 5.453,23 3.861,24 4.822,25 4.949,26 4.346,27 4.247,28 6.118,29 4.231,30 5.04,31 5.171,32 4.501,33 4.446,34 6.253,35 4.421,36 5.152,37 5.307,38 4.544,39 4.523,40 6.331,41 4.469,42 5.282,43 5.459,44 4.501,45 4.56,46 6.414,47 4.487,48 5.24,49 5.428,50 4.388,51 4.49,52 6.359,53 4.401,54 5.211,55 5.436,56 4.305,57 4.393,58 6.288,59 4.3,60 5.096,61 5.317,62 4.273,63 4.281,64 6.226,65 4.199,66 0.153,67 0.937,68 14.274,69 6.38,70 5.2}
{0 CHEMBL1984039,1 17.489,2 18.462,3 0.039,4 0.032,5 0.317,7 4.43,8 4.43,9 6.089,10 1,11 1.464,12 12.647,13 5.869,14 34.44,15 133.815,16 7.436,17 0.684,18 4.21,19 4.32,20 3.78,21 3.79,22 5.325,23 3.766,24 4.73,25 4.89,26 4.161,27 4.19,28 5.845,29 4.151,30 4.945,31 5.124,32 4.251,33 4.34,34 5.985,35 4.283,36 5.067,37 5.246,38 4.244,39 4.403,40 6.09,41 4.326,42 5.144,43 5.354,44 4.181,45 4.399,46 6.13,47 4.293,48 5.209,49 5.457,50 4.109,51 4.334,52 6.186,53 4.219,54 5.074,55 5.319,56 3.93,57 4.197,58 6.066,59 4.067,60 4.894,61 5.126,62 3.951,63 4.08,64 5.963,65 3.985,66 0.06,67 0.845,68 12.259,69 5.716,70 5.2}
{0 CHEMBL1984044,1 14.545,2 16.245,3 0.011,4 -0.127,5 0.4,7 3.756,8 3.756,9 5.807,10 1,11 1.514,12 11.846,13 3.093,14 9.565,15 102.141,16 7.05,17 0.571,18 3.995,19 4.127,20 3.508,21 3.499,22 5.085,23 3.476,24 4.519,25 4.709,26 3.839,27 3.856,28 5.591,29 3.814,30 4.733,31 4.953,32 3.882,33 3.97,34 5.738,35 3.907,36 4.776,37 4.996,38 3.831,39 3.987,40 5.819,41 3.892,42 4.861,43 5.143,44 3.664,45 3.906,46 5.789,47 3.774,48 4.634,49 4.904,50 3.5,51 3.754,52 5.523,53 3.632,54 4.371,55 4.572,56 3.494,57 3.696,58 5.383,59 3.596,60 4.476,61 4.714,62 3.33,63 3.644,64 5.479,65 3.506,66 0.034,67 0.738,68 10.974,69 4.352,70 5.2}
{0 CHEMBL1984162,1 31.057,2 36.87,3 0.007,4 -0.12,5 0.612,7 4.542,8 4.542,9 11.061,10 2,11 1.562,12 16.333,13 5.189,14 26.922,15 150.581,16 7.329,17 0.591,18 4.391,19 4.514,20 3.954,21 3.887,22 5.459,23 3.881,24 4.953,25 5.128,26 4.334,27 4.293,28 5.965,29 4.268,30 5.171,31 5.372,32 4.393,33 4.427,34 6.14,35 4.377,36 5.28,37 5.516,38 4.379,39 4.458,40 6.22,41 4.386,42 5.256,43 5.496,44 4.288,45 4.429,46 6.171,47 4.348,48 5.208,49 5.442,50 4.244,51 4.408,52 6.126,53 4.32,54 5.18,55 5.42,56 4.163,57 4.386,58 6.081,59 4.277,60 5.185,61 5.454,62 4.063,63 4.322,64 6.036,65 4.184,66 0.068,67 1.109,68 15.427,69 6.361,70 5.5}
{0 CHEMBL1984191,1 2.167,2 0.907,3 0.019,4 0.009,5 0.25,7 3.781,8 3.781,11 1.714,12 7.684,13 3.581,14 12.822,15 75.829,16 10.783,17 0.81,18 3.451,19 3.547,20 3.33,21 3.114,22 4.709,23 3.107,24 3.882,25 4.001,26 3.712,27 3.488,28 5.125,29 3.463,30 4.034,31 4.169,32 3.878,33 3.581,34 5.263,35 3.509,36 4.014,37 4.181,38 3.597,39 3.459,40 5.196,41 3.396,42 4.006,43 4.198,44 3.54,45 3.375,46 5.158,47 3.32,48 3.923,49 4.131,50 3.535,51 3.248,52 5.135,53 3.171,54 3.598,55 3.784,56 3.295,57 2.988,58 4.84,59 2.873,60 3.265,61 3.471,62 2.942,63 2.606,64 4.476,65 2.466,66 0.086,67 0.412,68 1.582,69 1.697,70 5.2}
{0 CHEMBL1984206,1 16.608,2 17.782,3 0.012,4 -0.129,5 0.549,6 0.473,7 3.453,8 3.453,9 5.26,10 1,11 1.674,12 9.455,13 0.753,14 0.567,15 81.425,16 8.036,17 0.522,18 3.71,19 3.831,20 3.319,21 3.205,22 4.992,23 3.218,24 4.17,25 4.337,26 3.612,27 3.514,28 5.396,29 3.509,30 4.36,31 4.548,32 3.701,33 3.602,34 5.635,35 3.593,36 4.369,37 4.564,38 3.655,39 3.538,40 5.766,41 3.523,42 4.346,43 4.559,44 3.552,45 3.491,46 5.711,47 3.464,48 4.25,49 4.439,50 3.425,51 3.439,52 5.594,53 3.403,54 4.254,55 4.479,56 3.282,57 3.334,58 5.664,59 3.277,60 4.095,61 4.361,62 3.052,63 3.206,64 5.154,65 3.112,66 0.082,67 0.568,68 6.484,69 2.828,70 5.2}
{0 CHEMBL1984274,1 19.153,2 15.702,3 0.065,4 0.196,5 0.685,7 4.213,8 4.213,11 1.662,12 10.406,13 4.442,14 19.727,15 120.012,16 8.843,17 0.639,18 4.022,19 4.126,20 3.729,21 3.598,22 5.308,23 3.616,24 4.466,25 4.582,26 4.099,27 3.97,28 5.755,29 3.979,30 4.723,31 4.887,32 4.214,33 4.049,34 6.056,35 4.059,36 4.713,37 4.885,38 4.18,39 3.959,40 6.099,41 3.992,42 4.659,43 4.822,44 4.122,45 3.907,46 6.143,47 3.944,48 4.605,49 4.773,50 4.009,51 3.917,52 5.914,53 3.922,54 4.607,55 4.767,56 4.031,57 3.985,58 5.849,59 3.977,60 4.69,61 4.851,62 4.099,63 4.059,64 6.031,65 4.031,66 0.176,67 0.764,68 6.606,69 3.705,70 5.2}
{0 CHEMBL1984363,1 16.28,2 20.515,3 0.091,4 0.145,5 0.356,7 3.875,8 3.875,11 1.58,12 12.071,13 4.296,14 18.455,15 109.285,16 7.967,17 0.71,18 3.959,19 4.081,20 3.577,21 3.554,22 5.166,23 3.54,24 4.434,25 4.581,26 3.946,27 3.942,28 5.626,29 3.91,30 4.677,31 4.851,32 3.992,33 4.055,34 5.88,35 4.004,36 4.766,37 4.984,38 3.9,39 4.019,40 5.921,41 3.945,42 4.692,43 4.914,44 3.78,45 3.92,46 5.854,47 3.836,48 4.615,49 4.858,50 3.621,51 3.806,52 5.702,53 3.709,54 4.44,55 4.674,56 3.455,57 3.664,58 5.63,59 3.554,60 4.313,61 4.56,62 3.368,63 3.553,64 5.321,65 3.45,66 0.081,67 0.762,68 8.332,69 4.004,70 5.2}
{0 CHEMBL1984367,1 14.261,2 19.434,3 0.039,4 0.029,5 0.235,7 3.683,8 3.683,11 1.583,12 12.333,13 4.25,14 18.064,15 112.392,16 8.011,17 0.7,18 3.953,19 4.071,20 3.635,21 3.579,22 5.069,23 3.53,24 4.447,25 4.613,26 4.017,27 3.97,28 5.512,29 3.9,30 4.617,31 4.79,32 4.036,33 4.042,34 5.668,35 3.945,36 4.717,37 4.943,38 3.843,39 3.988,40 5.723,41 3.866,42 4.65,43 4.892,44 3.82,45 3.925,46 5.659,47 3.785,48 4.48,49 4.705,50 3.766,51 3.795,52 5.531,53 3.659,54 4.246,55 4.411,56 3.616,57 3.65,58 5.376,59 3.529,60 4.302,61 4.539,62 3.447,63 3.537,64 5.35,65 3.43,66 0.051,67 0.707,68 9.152,69 4.209,70 5.2}
{0 CHEMBL1984432,1 11.664,2 16.546,3 0.024,4 0.186,5 0.189,7 3.928,8 3.928,11 1.418,12 10.13,13 4.159,14 17.298,15 93.98,16 7.585,17 0.808,18 3.807,19 3.938,20 3.413,21 3.389,22 4.927,23 3.365,24 4.299,25 4.477,26 3.757,27 3.781,28 5.32,29 3.743,30 4.451,31 4.634,32 3.696,33 3.871,34 5.444,35 3.785,36 4.591,37 4.842,38 3.589,39 3.804,40 5.494,41 3.689,42 4.468,43 4.744,44 3.464,45 3.617,46 5.354,47 3.518,48 4.279,49 4.537,50 3.386,51 3.469,52 5.252,53 3.389,54 4.162,55 4.442,56 3.196,57 3.33,58 5.068,59 3.238,60 3.837,61 4.032,62 3.034,63 3.277,64 4.788,65 3.179,66 0.099,67 0.645,68 7.808,69 3.398,70 5.2}
{0 CHEMBL1984541,1 14.204,2 16.519,3 0.069,4 0.053,5 0.272,7 3.673,8 3.673,11 1.669,12 6.611,13 3.405,14 11.596,15 78.272,16 8.744,17 0.3,18 3.571,19 3.662,20 3.338,21 3.272,22 4.638,23 3.191,24 4.111,25 4.257,26 3.823,27 3.729,28 5.107,29 3.624,30 4.424,31 4.57,32 3.958,33 3.912,34 5.461,35 3.764,36 4.583,37 4.854,38 3.703,39 3.769,40 5.507,41 3.577,42 4.128,43 4.298,44 3.569,45 3.478,46 5.272,47 3.343,48 3.972,49 4.174,50 3.133,51 3.337,52 4.895,53 3.143,54 3.799,55 4.006,56 2.844,57 3.084,58 4.75,59 2.893,60 3.634,61 3.912,62 2.856,63 2.783,64 4.63,65 2.547,66 0.02,67 0.411,68 5.765,69 3.129,70 5.2}
{0 CHEMBL1984586,1 15.479,2 20.04,3 0.057,4 -0.04,5 0.398,7 3.79,8 3.79,11 1.606,12 11.815,13 2.904,14 8.435,15 103.173,16 8.169,17 0.733,18 3.913,19 4.029,20 3.555,21 3.462,22 5.138,23 3.472,24 4.368,25 4.51,26 3.914,27 3.838,28 5.604,29 3.824,30 4.559,31 4.727,32 3.934,33 3.934,34 5.71,35 3.903,36 4.65,37 4.848,38 3.89,39 3.901,40 5.838,41 3.852,42 4.649,43 4.874,44 3.735,45 3.776,46 5.817,47 3.722,48 4.449,49 4.669,50 3.547,51 3.601,52 5.636,53 3.559,54 4.25,55 4.474,56 3.4,57 3.546,58 5.292,59 3.464,60 4.198,61 4.408,62 3.345,63 3.496,64 5.262,65 3.4,66 0.077,67 0.681,68 7.505,69 3.433,70 5.2}
{0 CHEMBL1984633,1 13.021,2 18.055,3 0.008,4 -0.112,5 0.338,7 3.722,8 3.722,9 5.221,10 1,11 1.667,12 10.792,13 2.504,14 6.271,15 94.516,16 8.279,17 0.654,18 3.812,19 3.914,20 3.52,21 3.426,22 4.982,23 3.384,24 4.294,25 4.444,26 3.881,27 3.778,28 5.427,29 3.714,30 4.451,31 4.621,32 3.898,33 3.849,34 5.548,35 3.765,36 4.518,37 4.705,38 3.813,39 3.845,40 5.654,41 3.731,42 4.53,43 4.747,44 3.729,45 3.792,46 5.587,47 3.662,48 4.389,49 4.581,50 3.594,51 3.657,52 5.513,53 3.545,54 4.314,55 4.538,56 3.491,57 3.512,58 5.492,59 3.404,60 4.153,61 4.383,62 3.392,63 3.384,64 5.262,65 3.282,66 0.027,67 0.586,68 7.464,69 3.782,70 5.2}
{0 CHEMBL1984700,1 19.097,2 24.619,3 -0.018,4 -0.211,5 0.634,7 3.947,8 3.947,9 5.796,10 1,11 1.735,12 10.303,13 4.421,14 19.546,15 120.303,16 7.974,17 0.611,18 4.159,19 4.278,20 3.77,21 3.635,22 5.356,23 3.65,24 4.685,25 4.859,26 4.185,27 4.001,28 5.916,29 4.017,30 4.937,31 5.121,32 4.231,33 4.125,34 6.183,35 4.121,36 4.992,37 5.243,38 4.262,39 4.127,40 6.222,41 4.117,42 4.859,43 5.044,44 4.308,45 4.173,46 6.087,47 4.177,48 4.988,49 5.181,50 4.356,51 4.259,52 6.259,53 4.252,54 5.032,55 5.226,56 4.282,57 4.24,58 6.277,59 4.202,60 4.98,61 5.204,62 4.145,63 4.116,64 6.192,65 4.063,66 0.147,67 1.009,68 10.484,69 4.853,70 5.2}
{0 CHEMBL1984711,1 33.976,2 57.097,3 -0.031,4 -0.213,5 0.833,6 0.4,7 3.822,8 3.822,9 16.148,10 3,11 1.615,12 13.226,13 5.15,14 26.523,15 115.833,16 7.337,17 0.5,18 4.174,19 4.29,20 3.73,21 3.613,22 5.278,23 3.62,24 4.715,25 4.891,26 4.05,27 3.982,28 5.739,29 3.965,30 4.903,31 5.11,32 4.103,33 4.102,34 5.874,35 4.055,36 4.966,37 5.183,38 4.116,39 4.107,40 5.969,41 4.052,42 4.987,43 5.202,44 4.027,45 4.044,46 5.991,47 4.007,48 4.865,49 5.078,50 3.907,51 3.962,52 5.89,53 3.897,54 4.819,55 5.094,56 3.806,57 3.857,58 5.734,59 3.777,60 4.659,61 4.903,62 3.758,63 3.79,64 5.634,65 3.737,66 0.119,67 0.851,68 12.595,69 5.055,70 5.4}
{0 CHEMBL1984788,1 15.397,2 13.8,3 0.086,4 0.033,5 0.63,7 3.99,8 3.99,11 1.737,12 10.231,13 3.366,14 11.327,15 98.527,16 8.474,17 0.552,18 3.906,19 4.027,20 3.572,21 3.486,22 5.056,23 3.473,24 4.444,25 4.599,26 3.986,27 3.919,28 5.62,29 3.88,30 4.745,31 4.949,32 4.051,33 4.052,34 5.849,35 3.985,36 4.77,37 4.996,38 4.081,39 3.987,40 5.982,41 3.922,42 4.691,43 4.919,44 4.029,45 3.87,46 5.968,47 3.811,48 4.486,49 4.707,50 3.639,51 3.698,52 5.673,53 3.617,54 4.316,55 4.527,56 3.665,57 3.545,58 5.575,59 3.505,60 4.268,61 4.474,62 3.666,63 3.427,64 5.817,65 3.383,66 0.091,67 0.733,68 7.408,69 3.747,70 5.2}
{0 CHEMBL1984842,1 16.003,2 20.681,3 -0.017,4 -0.224,5 0.362,7 3.792,8 3.792,9 5.929,10 1,11 1.62,12 11.529,13 5.013,14 25.128,15 129.233,16 7.375,17 0.595,18 4.238,19 4.364,20 3.789,21 3.726,22 5.365,23 3.717,24 4.775,25 4.962,26 4.166,27 4.113,28 5.862,29 4.089,30 5.021,31 5.223,32 4.248,33 4.26,34 6.116,35 4.205,36 5.202,37 5.478,38 4.199,39 4.235,40 6.19,41 4.178,42 4.929,43 5.138,44 4.266,45 4.239,46 5.981,47 4.21,48 5.036,49 5.236,50 4.356,51 4.323,52 6.226,53 4.295,54 5.094,55 5.3,56 4.261,57 4.346,58 6.166,59 4.283,60 5.102,61 5.336,62 4.116,63 4.264,64 6.142,65 4.162,66 0.062,67 1.018,68 13.152,69 5.483,70 5.2}
{0 CHEMBL1985074,1 10.33,2 8.139,3 0.05,4 -0.005,5 0.33,7 3.654,8 3.654,11 1.818,12 6.889,13 2.934,14 8.607,15 74.105,16 9.613,17 0.55,18 3.493,19 3.583,20 3.34,21 3.2,22 4.611,23 3.137,24 4.014,25 4.148,26 3.719,27 3.602,28 5.133,29 3.518,30 4.222,31 4.373,32 3.895,33 3.731,34 5.41,35 3.644,36 4.207,37 4.355,38 3.826,39 3.655,40 5.414,41 3.543,42 4.066,43 4.234,44 3.761,45 3.456,46 5.327,47 3.321,48 3.795,49 3.984,50 3.134,51 3.152,52 4.888,53 2.996,54 3.661,55 3.88,56 2.7,57 2.904,58 4.647,59 2.673,60 3.192,61 3.426,62 2.414,63 2.44,64 4.009,65 2.192,66 0.036,67 0.402,68 3.744,69 2.48,70 5.3}
{0 CHEMBL1985092,1 15.401,2 21.733,3 0.105,4 0.216,5 0.288,7 3.664,8 3.664,11 1.636,12 9.185,13 5.821,14 33.884,15 106.888,16 8.787,17 0.767,18 3.89,19 3.988,20 3.586,21 3.509,22 5.13,23 3.498,24 4.316,25 4.427,26 3.96,27 3.891,28 5.546,29 3.861,30 4.58,31 4.742,32 3.984,33 3.982,34 5.749,35 3.923,36 4.605,37 4.801,38 3.947,39 3.929,40 5.705,41 3.869,42 4.584,43 4.79,44 3.935,45 3.938,46 5.656,47 3.888,48 4.577,49 4.76,50 3.981,51 3.969,52 5.713,53 3.916,54 4.619,55 4.802,56 3.991,57 3.991,58 5.824,59 3.91,60 4.603,61 4.809,62 3.803,63 3.919,64 5.721,65 3.801,66 0.114,67 0.591,68 6.584,69 3.48,70 5.2}
{0 CHEMBL1985095,1 9.628,2 10.917,3 0.106,4 0.116,5 0.318,7 4.555,8 4.555,11 1.672,12 10.25,13 3.655,14 13.357,15 126.486,16 8.97,17 0.811,18 4.049,19 4.162,20 3.815,21 3.683,22 5.264,23 3.668,24 4.523,25 4.653,26 4.24,27 4.121,28 5.741,29 4.083,30 4.719,31 4.87,32 4.25,33 4.233,34 5.854,35 4.16,36 4.788,37 4.966,38 4.26,39 4.252,40 5.85,41 4.17,42 4.783,43 4.967,44 4.263,45 4.212,46 5.901,47 4.145,48 4.762,49 4.923,50 4.244,51 4.206,52 5.98,53 4.151,54 4.837,55 5.044,56 4.236,57 4.17,58 5.973,59 4.113,60 4.773,61 4.979,62 4.11,63 4.087,64 5.95,65 4.011,66 0.108,67 0.814,68 7.279,69 3.772,70 5.3}
{0 CHEMBL1985311,1 19.558,2 26.018,3 0.12,4 0.134,5 0.658,7 3.901,8 3.901,11 1.706,12 12.103,13 2.801,14 7.846,15 108.379,16 8.329,17 0.688,18 3.981,19 4.101,20 3.621,21 3.524,22 5.243,23 3.535,24 4.434,25 4.567,26 3.986,27 3.912,28 5.715,29 3.901,30 4.681,31 4.86,32 4.046,33 4.019,34 5.943,35 3.992,36 4.749,37 4.952,38 3.983,39 3.98,40 5.974,41 3.942,42 4.705,43 4.909,44 3.925,45 3.887,46 6.078,47 3.849,48 4.642,49 4.873,50 3.73,51 3.758,52 5.935,53 3.705,54 4.447,55 4.681,56 3.548,57 3.589,58 5.72,59 3.528,60 4.275,61 4.497,62 3.483,63 3.474,64 5.497,65 3.429,66 0.159,67 0.795,68 7.948,69 3.79,70 5.2}
{0 CHEMBL1985406,1 10.255,2 11.42,3 0.051,4 0.049,5 0.528,7 4.061,8 4.061,11 1.699,12 9.304,13 3.908,14 15.275,15 82.956,16 8.299,17 0.64,18 3.753,19 3.87,20 3.395,21 3.311,22 4.99,23 3.312,24 4.251,25 4.406,26 3.763,27 3.68,28 5.496,29 3.667,30 4.502,31 4.702,32 3.852,33 3.737,34 5.917,35 3.725,36 4.47,37 4.677,38 3.741,39 3.661,40 5.789,41 3.647,42 4.393,43 4.591,44 3.643,45 3.583,46 5.747,47 3.571,48 4.317,49 4.528,50 3.57,51 3.523,52 5.562,53 3.498,54 4.26,55 4.477,56 3.516,57 3.402,58 5.602,59 3.379,60 4.154,61 4.394,62 3.232,63 3.224,64 5.47,65 3.16,66 0.111,67 0.705,68 6.201,69 3.433,70 5.3}
{0 CHEMBL1985566,1 40.342,2 57.472,3 0.016,4 -0.094,5 0.485,6 0.86,7 3.958,8 3.958,9 16.954,10 3,11 1.494,12 18.762,13 5.489,14 30.126,15 162.961,16 7.577,17 0.511,18 4.407,19 4.512,20 3.996,21 3.972,22 5.517,23 3.958,24 4.947,25 5.098,26 4.34,27 4.365,28 5.992,29 4.333,30 5.212,31 5.39,32 4.477,33 4.564,34 6.244,35 4.509,36 5.289,37 5.485,38 4.413,39 4.592,40 6.326,41 4.502,42 5.338,43 5.574,44 4.324,45 4.558,46 6.323,47 4.443,48 5.209,49 5.449,50 4.215,51 4.412,52 6.163,53 4.309,54 5.062,55 5.268,56 4.172,57 4.312,58 6.103,59 4.236,60 5.011,61 5.205,62 4.146,63 4.276,64 6.094,65 4.198,66 0.025,67 1.025,68 14.394,69 6.789,70 5.2}
{0 CHEMBL1985580,1 11.193,2 13.185,3 0.057,4 0.03,5 0.228,7 3.737,8 3.737,11 1.427,12 13.233,13 2.729,14 7.447,15 119.279,16 7.587,17 0.697,18 4.036,19 4.157,20 3.621,21 3.658,22 5.201,23 3.628,24 4.503,25 4.654,26 3.933,27 4.031,28 5.616,29 3.975,30 4.783,31 4.981,32 3.979,33 4.159,34 5.886,35 4.069,36 4.833,37 5.062,38 3.859,39 4.1,40 5.861,41 3.99,42 4.777,43 5.004,44 3.863,45 4.044,46 5.854,47 3.944,48 4.767,49 5,50 3.854,51 3.991,52 5.889,53 3.901,54 4.738,55 4.986,56 3.77,57 3.902,58 5.855,59 3.817,60 4.56,61 4.792,62 3.605,63 3.792,64 5.647,65 3.7,66 0.042,67 0.73,68 9.738,69 4.39,70 5.2}
{0 CHEMBL1986139,1 11.088,2 19.407,3 0.034,4 -0.08,5 0.139,7 3.461,8 3.461,11 1.773,12 6.647,13 3.726,14 13.884,15 71.596,16 10.47,17 0.842,18 3.369,19 3.458,20 3.295,21 3.099,22 4.562,23 3.047,24 3.804,25 3.913,26 3.674,27 3.458,28 4.995,29 3.385,30 3.948,31 4.108,32 3.76,33 3.463,34 5.066,35 3.361,36 3.87,37 4.06,38 3.572,39 3.246,40 5.044,41 3.172,42 3.706,43 3.898,44 3.219,45 3.18,46 4.76,47 3.064,48 3.57,49 3.723,50 3.266,51 3.161,52 4.699,53 3.039,54 3.547,55 3.714,56 3.088,57 3.053,58 4.631,59 2.858,60 3.143,61 3.366,62 2.364,63 2.469,64 4.096,65 2.199,66 0.038,67 0.363,68 2.058,69 1.755,70 5.2}
{0 CHEMBL1986186,1 14.61,2 22.014,3 0.014,4 -0.146,5 0.155,7 3.468,8 3.468,11 1.54,12 7.95,13 1.604,14 2.573,15 78.31,16 7.009,17 0.286,18 3.741,19 3.863,20 3.231,21 3.238,22 4.905,23 3.212,24 4.213,25 4.413,26 3.562,27 3.552,28 5.281,29 3.516,30 4.45,31 4.648,32 3.602,33 3.694,34 5.678,35 3.611,36 4.654,37 4.955,38 3.396,39 3.686,40 5.587,41 3.537,42 4.425,43 4.687,44 3.48,45 3.59,46 5.401,47 3.505,48 4.33,49 4.489,50 3.532,51 3.52,52 5.638,53 3.493,54 4.424,55 4.629,56 3.255,57 3.405,58 5.716,59 3.339,60 4.261,61 4.517,62 2.864,63 3.308,64 5.284,65 3.144,66 0.04,67 0.559,68 8.617,69 3.527,70 5.2}
{0 CHEMBL1986263,1 21.932,2 31.6,3 -0.022,4 -0.245,5 0.454,6 0.4,7 3.692,8 3.692,9 5.213,10 1,11 1.713,12 10.083,13 3.318,14 11.007,15 97.172,16 8.154,17 0.462,18 3.843,19 3.955,20 3.537,21 3.401,22 4.988,23 3.368,24 4.344,25 4.516,26 3.934,27 3.74,28 5.462,29 3.696,30 4.466,31 4.648,32 3.948,33 3.845,34 5.548,35 3.786,36 4.537,37 4.704,38 3.881,39 3.897,40 5.656,41 3.78,42 4.594,43 4.811,44 3.748,45 3.784,46 5.706,47 3.683,48 4.432,49 4.668,50 3.609,51 3.64,52 5.491,53 3.55,54 4.32,55 4.553,56 3.507,57 3.554,58 5.402,59 3.45,60 4.202,61 4.425,62 3.382,63 3.477,64 5.188,65 3.353,66 0.038,67 0.645,68 8.091,69 3.809,70 6.3}
{0 CHEMBL1986328,1 9.184,2 12.321,3 -0.032,4 -0.276,5 0.407,7 3.886,8 3.886,11 1.643,12 9.5,13 3.301,14 10.894,15 93.313,16 8.295,17 0.724,18 3.877,19 3.977,20 3.542,21 3.396,22 5.085,23 3.419,24 4.361,25 4.508,26 3.902,27 3.748,28 5.561,29 3.767,30 4.495,31 4.656,32 3.89,33 3.797,34 5.707,35 3.79,36 4.556,37 4.751,38 3.905,39 3.783,40 5.777,41 3.79,42 4.481,43 4.641,44 3.935,45 3.831,46 5.686,47 3.836,48 4.512,49 4.65,50 3.868,51 3.864,52 5.712,53 3.839,54 4.572,55 4.78,56 3.635,57 3.797,58 5.616,59 3.702,60 4.369,61 4.622,62 3.278,63 3.468,64 5.334,65 3.355,66 0.08,67 0.632,68 6.855,69 3.45,70 5.2}
{0 CHEMBL1986499,1 13.171,2 16.72,3 0.074,4 0.192,5 0.283,7 4.264,8 4.264,11 1.543,12 9.345,13 4.717,14 22.25,15 112.832,16 8.358,17 0.818,18 3.969,19 4.092,20 3.641,21 3.563,22 5.189,23 3.561,24 4.433,25 4.576,26 4.007,27 3.955,28 5.614,29 3.94,30 4.656,31 4.843,32 4.023,33 4.035,34 5.81,35 3.995,36 4.723,37 4.945,38 3.972,39 3.998,40 5.794,41 3.952,42 4.656,43 4.871,44 3.988,45 3.989,46 5.725,47 3.955,48 4.664,49 4.862,50 4.021,51 4.044,52 5.794,53 3.997,54 4.705,55 4.912,56 4.025,57 4.055,58 5.898,59 3.994,60 4.673,61 4.886,62 3.836,63 3.998,64 5.779,65 3.912,66 0.122,67 0.811,68 7.388,69 3.667,70 6}
{0 CHEMBL1986530,1 28.588,2 33.148,3 -0.004,4 -0.143,5 0.686,6 0.8,7 3.943,8 3.943,11 1.657,12 13.182,13 2.758,14 7.604,15 123.023,16 7.734,17 0.324,18 4.175,19 4.299,20 3.778,21 3.701,22 5.283,23 3.696,24 4.748,25 4.931,26 4.15,27 4.12,28 5.834,29 4.09,30 5.034,31 5.248,32 4.258,33 4.284,34 6.112,35 4.232,36 5.096,37 5.318,38 4.196,39 4.244,40 6.278,41 4.185,42 5.048,43 5.277,44 4.102,45 4.209,46 6.124,47 4.136,48 5.01,49 5.245,50 3.992,51 4.16,52 6.083,53 4.072,54 4.914,55 5.162,56 3.976,57 4.06,58 6.052,59 3.97,60 4.788,61 5.027,62 3.942,63 3.929,64 5.923,65 3.87,66 0.083,67 0.986,68 11.069,69 5.085,70 5.2}
{0 CHEMBL1986597,1 20.29,2 24.357,3 0.05,4 -0.088,5 1.02,6 0.4,7 4.567,8 4.567,9 5.231,10 1,11 1.758,12 14.917,13 2.387,14 5.696,15 132.841,16 8.569,17 0.55,18 4.208,19 4.304,20 4.002,21 3.78,22 5.362,23 3.767,24 4.739,25 4.867,26 4.345,27 4.178,28 6.082,29 4.151,30 4.986,31 5.145,32 4.419,33 4.327,34 6.21,35 4.271,36 5.075,37 5.252,38 4.377,39 4.281,40 6.395,41 4.24,42 5,43 5.184,44 4.267,45 4.189,46 6.341,47 4.154,48 4.863,49 5.047,50 4.086,51 4.153,52 6.2,53 4.072,54 4.838,55 5.05,56 4.013,57 4.097,58 5.914,59 4.003,60 4.784,61 4.991,62 3.969,63 3.943,64 6.029,65 3.868,66 0.176,67 0.92,68 12.199,69 5.382,70 5.2}
{0 CHEMBL1986603,1 27.537,2 34.462,3 0.011,4 -0.076,5 0.556,6 0.149,7 3.842,8 3.842,11 1.787,12 15.438,13 2.286,14 5.224,15 121.184,16 8.52,17 0.6,18 4.097,19 4.214,20 3.808,21 3.622,22 5.299,23 3.613,24 4.579,25 4.739,26 4.191,27 3.975,28 5.788,29 3.947,30 4.744,31 4.938,32 4.086,33 4.016,34 5.875,35 3.954,36 4.751,37 4.938,38 4.125,39 4.043,40 5.963,41 3.958,42 4.706,43 4.897,44 3.971,45 3.96,46 5.894,47 3.89,48 4.701,49 4.933,50 3.874,51 3.858,52 5.884,53 3.761,54 4.584,55 4.793,56 3.835,57 3.749,58 5.746,59 3.678,60 4.487,61 4.681,62 3.943,63 3.744,64 5.743,65 3.684,66 0.176,67 0.867,68 9.25,69 4.425,70 5.2}
{0 CHEMBL1986781,1 18.58,2 30.45,3 -0.031,4 -0.277,5 0.623,7 3.711,8 3.711,11 1.703,12 12.194,13 2.847,14 8.107,15 113.137,16 8.086,17 0.6,18 4.088,19 4.204,20 3.73,21 3.591,22 5.236,23 3.607,24 4.634,25 4.803,26 4.121,27 3.991,28 5.79,29 3.989,30 4.871,31 5.085,32 4.114,33 4.107,34 5.946,35 4.075,36 4.887,37 5.109,38 4.067,39 4.097,40 5.949,41 4.048,42 4.899,43 5.134,44 4.095,45 4.091,46 5.94,47 4.048,48 4.825,49 5.037,50 4.076,51 4.049,52 5.956,53 4.012,54 4.755,55 4.967,56 3.94,57 3.96,58 5.836,59 3.903,60 4.689,61 4.928,62 3.851,63 3.835,64 5.861,65 3.777,66 0.095,67 0.901,68 9.153,69 4.296,70 5.2}
{0 CHEMBL1986869,1 13.107,2 17.525,3 0.083,4 0.017,5 0.35,7 3.784,8 3.784,11 1.795,12 10.6,13 2.006,14 4.025,15 100.796,16 9.671,17 0.75,18 3.779,19 3.877,20 3.654,21 3.472,22 5.003,23 3.418,24 4.228,25 4.349,26 4.076,27 3.841,28 5.445,29 3.775,30 4.36,31 4.506,32 4.067,33 3.857,34 5.581,35 3.785,36 4.395,37 4.549,38 3.961,39 3.838,40 5.691,41 3.725,42 4.309,43 4.487,44 3.941,45 3.73,46 5.575,47 3.627,48 4.232,49 4.406,50 3.879,51 3.7,52 5.422,53 3.581,54 4.105,55 4.252,56 3.681,57 3.57,58 5.321,59 3.467,60 4.001,61 4.158,62 3.463,63 3.424,64 5.223,65 3.325,66 0.07,67 0.605,68 4.906,69 3.102,70 5.2}
{0 CHEMBL1986943,1 13.245,2 20.57,3 0.045,4 -0.141,5 0.378,7 3.816,8 3.816,11 1.674,12 9.958,13 3.025,14 9.152,15 95.057,16 8.187,17 0.593,18 3.866,19 3.988,20 3.512,21 3.411,22 4.951,23 3.399,24 4.411,25 4.576,26 3.916,27 3.832,28 5.495,29 3.789,30 4.713,31 4.945,32 3.895,33 3.933,34 5.671,35 3.85,36 4.675,37 4.928,38 3.854,39 3.834,40 5.651,41 3.744,42 4.529,43 4.781,44 3.775,45 3.73,46 5.531,47 3.645,48 4.378,49 4.583,50 3.861,51 3.688,52 5.478,53 3.62,54 4.322,55 4.508,56 3.72,57 3.655,58 5.475,59 3.543,60 4.247,61 4.456,62 3.425,63 3.541,64 5.208,65 3.409,66 0.068,67 0.664,68 7.815,69 3.484,70 6.8}
{0 CHEMBL1986970,1 16.403,2 22.285,3 -0.023,4 -0.01,5 0.579,6 0.293,7 4.191,8 4.191,9 5.118,10 1,11 1.597,12 9.414,13 2.761,14 7.624,15 113.192,16 7.657,17 0.656,18 4.046,19 4.172,20 3.645,21 3.549,22 5.193,23 3.546,24 4.56,25 4.74,26 3.963,27 3.92,28 5.616,29 3.904,30 4.711,31 4.897,32 4.004,33 4.037,34 5.778,35 3.984,36 4.871,37 5.099,38 4.043,39 4.018,40 5.992,41 3.973,42 4.807,43 5.032,44 4.048,45 3.976,46 5.933,47 3.964,48 4.783,49 4.973,50 4.07,51 4.05,52 5.949,53 4.023,54 4.9,55 5.124,56 4.038,57 4.079,58 6.004,59 4.019,60 4.835,61 5.05,62 3.897,63 4.076,64 5.887,65 3.979,66 0.105,67 0.809,68 9.999,69 4.337,70 5.2}
{0 CHEMBL1987007,1 14.036,2 22.977,3 0.044,4 0.015,5 0.306,7 3.617,8 3.617,11 1.607,12 10.667,13 2.615,14 6.84,15 98.802,16 7.738,17 0.556,18 3.894,19 4.018,20 3.553,21 3.492,22 4.929,23 3.438,24 4.446,25 4.624,26 3.952,27 3.915,28 5.425,29 3.833,30 4.688,31 4.906,32 3.949,33 3.994,34 5.608,35 3.876,36 4.742,37 5.005,38 3.75,39 3.911,40 5.642,41 3.77,42 4.593,43 4.843,44 3.795,45 3.818,46 5.607,47 3.685,48 4.37,49 4.555,50 3.708,51 3.745,52 5.454,53 3.592,54 4.253,55 4.452,56 3.493,57 3.584,58 5.253,59 3.44,60 4.16,61 4.368,62 3.301,63 3.374,64 5.246,65 3.286,66 0.052,67 0.693,68 9.454,69 4.148,70 5.2}
{0 CHEMBL1987009,1 12.058,2 15.608,3 0.053,4 0.113,5 0.333,7 3.673,8 3.673,9 5.209,10 1,11 1.643,12 11.577,13 4.072,14 16.578,15 104.427,16 8.453,17 0.724,18 3.88,19 3.98,20 3.606,21 3.519,22 5.04,23 3.48,24 4.36,25 4.491,26 3.982,27 3.898,28 5.489,29 3.839,30 4.515,31 4.674,32 3.992,33 3.933,34 5.607,35 3.855,36 4.552,37 4.746,38 3.813,39 3.858,40 5.629,41 3.768,42 4.523,43 4.732,44 3.817,45 3.834,46 5.617,47 3.724,48 4.41,49 4.605,50 3.749,51 3.754,52 5.518,53 3.629,54 4.274,55 4.472,56 3.617,57 3.6,58 5.445,59 3.483,60 4.109,61 4.281,62 3.503,63 3.444,64 5.294,65 3.373,66 0.058,67 0.614,68 7.479,69 3.853,70 5.2}
{0 CHEMBL1987034,1 27.039,2 42.574,3 0.046,4 -0.107,5 0.609,6 0.4,7 3.922,8 3.922,9 5.218,10 1,11 1.961,12 13.103,13 3.716,14 13.807,15 112.596,16 10.804,17 0.581,18 3.916,19 4.006,20 3.913,21 3.514,22 5.158,23 3.497,24 4.38,25 4.491,26 4.217,27 3.848,28 5.897,29 3.821,30 4.591,31 4.743,32 4.338,33 3.93,34 5.922,35 3.887,36 4.58,37 4.762,38 4.132,39 3.885,40 5.811,41 3.815,42 4.562,43 4.769,44 4.207,45 3.866,46 5.839,47 3.797,48 4.481,49 4.664,50 4.168,51 3.826,52 5.728,53 3.743,54 4.369,55 4.559,56 4.134,57 3.707,58 5.751,59 3.625,60 4.257,61 4.434,62 4.093,63 3.619,64 5.505,65 3.545,66 0.18,67 0.711,68 5.012,69 3.79,70 7.4}
{0 CHEMBL1987054,1 30.233,2 35.541,3 0.007,4 -0.122,5 0.792,7 4.542,8 4.542,9 11.05,10 2,11 1.671,12 16.333,13 5.367,14 28.803,15 150.344,16 7.943,17 0.591,18 4.359,19 4.476,20 3.987,21 3.868,22 5.448,23 3.866,24 4.918,25 5.081,26 4.38,27 4.278,28 5.964,29 4.256,30 5.145,31 5.341,32 4.467,33 4.408,34 6.152,35 4.36,36 5.223,37 5.453,38 4.466,39 4.43,40 6.209,41 4.361,42 5.2,43 5.434,44 4.313,45 4.385,46 6.146,47 4.311,48 5.132,49 5.342,50 4.268,51 4.382,52 6.095,53 4.302,54 5.152,55 5.385,56 4.218,57 4.372,58 6.082,59 4.265,60 5.159,61 5.425,62 4.125,63 4.3,64 6.038,65 4.163,66 0.107,67 1.061,68 13.35,69 5.999,70 5.6}
{0 CHEMBL1987359,1 19.67,2 25.315,3 0.03,4 -0.095,5 0.408,6 0.4,7 3.574,8 3.574,11 1.515,12 11.308,13 1.972,14 3.887,15 102.75,16 6.97,17 0.393,18 4.012,19 4.14,20 3.506,21 3.519,22 5.078,23 3.491,24 4.568,25 4.758,26 3.84,27 3.919,28 5.585,29 3.86,30 4.852,31 5.087,32 4.012,33 4.085,34 5.88,35 4.018,36 4.879,37 5.089,38 4.025,39 4.082,40 6.075,41 4.025,42 4.867,43 5.086,44 3.91,45 4.037,46 5.996,47 3.955,48 4.807,49 5.037,50 3.736,51 3.962,52 5.871,53 3.844,54 4.733,55 4.965,56 3.603,57 3.88,58 5.737,59 3.757,60 4.664,61 4.895,62 3.503,63 3.751,64 5.871,65 3.626,66 0.038,67 0.738,68 11.374,69 4.665,70 5.2}
{0 CHEMBL1987533,1 10.672,2 13.943,3 0.057,4 0.147,5 0.356,7 3.788,8 3.788,11 1.676,12 8.8,13 3.095,14 9.578,15 78.433,16 8.93,17 0.727,18 3.589,19 3.698,20 3.309,21 3.214,22 4.781,23 3.196,24 4.051,25 4.183,26 3.668,27 3.589,28 5.243,29 3.549,30 4.276,31 4.454,32 3.668,33 3.649,34 5.421,35 3.57,36 4.243,37 4.449,38 3.506,39 3.497,40 5.395,41 3.398,42 4.085,43 4.295,44 3.411,45 3.236,46 5.41,47 3.187,48 3.887,49 4.09,50 3.17,51 3.145,52 5.127,53 3.087,54 3.755,55 3.941,56 3.209,57 3.159,58 4.961,59 3.084,60 3.732,61 3.91,62 3.081,63 3.137,64 4.833,65 3.02,66 0.067,67 0.468,68 4.566,69 2.501,70 5.2}
{0 CHEMBL1987648,1 13.037,2 16.338,3 -0.003,4 -0.211,5 0.312,7 3.783,8 3.783,11 1.621,12 10.733,13 3.581,14 12.823,15 113.304,16 7.67,17 0.667,18 4.077,19 4.203,20 3.665,21 3.592,22 5.238,23 3.587,24 4.594,25 4.778,26 4.052,27 3.981,28 5.721,29 3.965,30 4.831,31 5.026,32 4.126,33 4.129,34 5.965,35 4.085,36 5.018,37 5.286,38 4.054,39 4.125,40 6.047,41 4.063,42 4.812,43 5.036,44 4.083,45 4.111,46 5.835,47 4.059,48 4.825,49 5.03,50 4.149,51 4.139,52 6.028,53 4.102,54 4.864,55 5.073,56 4.022,57 4.144,58 5.955,59 4.064,60 4.882,61 5.141,62 3.832,63 3.987,64 5.93,65 3.874,66 0.064,67 0.898,68 10.307,69 4.448,70 5.2}
{0 CHEMBL1987679,1 16.738,2 18.936,3 0.064,4 0.009,5 0.34,7 4.068,8 4.068,9 11.043,10 2,11 1.579,12 13.233,13 3.09,14 9.545,15 112,16 8.009,17 0.647,18 4.046,19 4.153,20 3.678,21 3.603,22 5.209,23 3.608,24 4.549,25 4.679,26 4.051,27 4.007,28 5.725,29 3.99,30 4.782,31 4.962,32 4.022,33 4.105,34 5.856,35 4.046,36 4.822,37 5.042,38 3.901,39 4.053,40 5.803,41 3.968,42 4.754,43 4.976,44 3.843,45 3.943,46 5.797,47 3.868,48 4.706,49 4.925,50 3.781,51 3.862,52 5.758,53 3.792,54 4.634,55 4.872,56 3.702,57 3.782,58 5.663,59 3.707,60 4.491,61 4.706,62 3.62,63 3.698,64 5.578,65 3.629,66 0.077,67 0.737,68 8.985,69 4.239,70 5.2}
{0 CHEMBL1987756,1 10.974,2 8.718,3 0.033,4 -0.08,5 0.442,7 4.133,8 4.133,11 1.733,12 13.519,13 3.096,14 9.585,15 112.684,16 9.498,17 0.586,18 3.938,19 4.038,20 3.852,21 3.594,22 4.999,23 3.526,24 4.45,25 4.595,26 4.151,27 3.963,28 5.74,29 3.871,30 4.699,31 4.894,32 4.206,33 4.1,34 5.765,35 3.959,36 4.721,37 4.918,38 4.065,39 4,40 5.858,41 3.863,42 4.673,43 4.884,44 3.92,45 3.842,46 5.894,47 3.729,48 4.582,49 4.82,50 3.686,51 3.718,52 5.687,53 3.571,54 4.435,55 4.681,56 3.547,57 3.635,58 5.38,59 3.47,60 4.36,61 4.606,62 3.552,63 3.567,64 5.308,65 3.401,66 0.087,67 0.678,68 8.776,69 4.535,70 5.2}
{0 CHEMBL1987793,1 14.838,2 14.016,3 0.039,4 -0.025,5 0.238,7 4.43,8 4.43,9 6.103,10 1,11 1.345,12 11.97,13 6.833,14 46.687,15 130.722,16 7.509,17 0.73,18 4.153,19 4.251,20 3.737,21 3.784,22 5.274,23 3.753,24 4.661,25 4.8,26 4.099,27 4.179,28 5.791,29 4.129,30 4.918,31 5.098,32 4.206,33 4.332,34 5.916,35 4.263,36 5.001,37 5.176,38 4.238,39 4.374,40 6.031,41 4.302,42 5.077,43 5.259,44 4.229,45 4.398,46 6.156,47 4.314,48 5.161,49 5.363,50 4.157,51 4.356,52 6.283,53 4.259,54 5.124,55 5.361,56 3.865,57 4.212,58 6.177,59 4.067,60 4.904,61 5.188,62 3.676,63 4.024,64 5.698,65 3.869,66 0.035,67 0.704,68 11.13,69 5.467,70 5.2}
{0 CHEMBL1987910,1 17.508,2 22.606,3 0.099,4 0.027,5 0.926,7 4,8 4,11 1.856,12 12.133,13 4.487,14 20.136,15 111.743,16 9.522,17 0.667,18 3.945,19 4.047,20 3.735,21 3.562,22 5.222,23 3.556,24 4.435,25 4.55,26 4.186,27 3.948,28 6.167,29 3.926,30 4.618,31 4.776,32 4.16,33 4.04,34 5.904,35 4.004,36 4.717,37 4.89,38 4.238,39 4.01,40 6.162,41 3.982,42 4.725,43 4.924,44 4.007,45 3.893,46 6.121,47 3.853,48 4.534,49 4.731,50 3.865,51 3.702,52 6.2,53 3.666,54 4.331,55 4.542,56 3.594,57 3.608,58 5.521,59 3.549,60 4.272,61 4.469,62 3.656,63 3.56,64 5.595,65 3.51,66 0.19,67 0.897,68 5.456,69 3.894,70 5.2}
{0 CHEMBL1987982,1 12.346,2 12.342,3 0.051,4 -0.011,5 0.561,7 3.808,8 3.808,9 3.93,10 1,11 1.643,12 10.846,13 5.802,14 33.666,15 95.972,16 8.335,17 0.552,18 3.891,19 3.997,20 3.542,21 3.452,22 5.037,23 3.458,24 4.455,25 4.594,26 4.012,27 3.859,28 6.154,29 3.844,30 4.611,31 4.807,32 3.855,33 3.995,34 5.609,35 3.919,36 4.645,37 4.843,38 3.853,39 3.975,40 5.762,41 3.896,42 4.688,43 4.919,44 3.796,45 3.896,46 5.849,47 3.823,48 4.571,49 4.807,50 3.636,51 3.766,52 5.646,53 3.687,54 4.383,55 4.607,56 3.486,57 3.624,58 5.376,59 3.539,60 4.305,61 4.525,62 3.461,63 3.486,64 5.484,65 3.424,66 0.121,67 0.823,68 7.033,69 4.107,70 5.2}
{0 CHEMBL1988075,1 18.938,2 24.25,3 0.08,4 0.035,5 0.453,7 3.836,8 3.836,11 1.676,12 14.529,13 4.401,14 19.368,15 133.556,16 8.696,17 0.737,18 4.108,19 4.216,20 3.839,21 3.755,22 5.33,23 3.727,24 4.568,25 4.7,26 4.217,27 4.144,28 5.811,29 4.096,30 4.8,31 4.966,32 4.277,33 4.258,34 5.984,35 4.195,36 4.859,37 5.042,38 4.324,39 4.264,40 6.052,41 4.175,42 4.867,43 5.067,44 4.2,45 4.203,46 6.034,47 4.105,48 4.708,49 4.891,50 4.082,51 4.082,52 6.005,53 4.007,54 4.65,55 4.848,56 3.937,57 4.031,58 5.762,59 3.941,60 4.684,61 4.907,62 3.858,63 3.999,64 5.76,65 3.882,66 0.073,67 0.861,68 8.439,69 4.482,70 5.2}
{0 CHEMBL1988153,1 13.35,2 13.764,3 -0.006,4 -0.023,5 0.69,7 3.843,8 3.843,9 5.724,10 1,11 1.997,12 10.808,13 3.895,14 15.171,15 91.257,16 10.483,17 0.724,18 3.767,19 3.834,20 3.645,21 3.359,22 5.074,23 3.381,24 4.277,25 4.372,26 4.135,27 3.726,28 6.074,29 3.748,30 4.346,31 4.449,32 4.055,33 3.718,34 5.736,35 3.734,36 4.386,37 4.531,38 3.978,39 3.639,40 5.811,41 3.661,42 4.194,43 4.346,44 3.742,45 3.548,46 5.52,47 3.545,48 4.167,49 4.283,50 3.8,51 3.566,52 5.626,53 3.528,54 4.149,55 4.325,56 3.611,57 3.507,58 5.325,59 3.442,60 3.955,61 4.105,62 3.499,63 3.257,64 5.332,65 3.252,66 0.272,67 0.753,68 2.443,69 3.314,70 5.2}
{0 CHEMBL1988163,1 18.723,2 24.777,3 0.048,4 -0.133,5 0.419,7 4.554,8 4.554,11 1.766,12 10.269,13 3.086,14 9.523,15 100.21,16 8.913,17 0.759,18 3.854,19 3.953,20 3.731,21 3.468,22 5.017,23 3.446,24 4.333,25 4.453,26 3.998,27 3.833,28 5.811,29 3.805,30 4.548,31 4.721,32 3.967,33 3.9,34 5.769,35 3.851,36 4.549,37 4.747,38 3.892,39 3.825,40 5.75,41 3.773,42 4.476,43 4.684,44 3.797,45 3.755,46 5.7,47 3.7,48 4.386,49 4.584,50 3.697,51 3.678,52 5.53,53 3.615,54 4.305,55 4.527,56 3.664,57 3.583,58 5.588,59 3.511,60 4.149,61 4.339,62 3.522,63 3.504,64 5.317,65 3.427,66 0.119,67 0.679,68 8.513,69 3.589,70 6}
{0 CHEMBL1988173,1 19.132,2 21.657,3 0.07,4 0.18,5 0.539,6 0.142,7 3.888,8 3.888,11 1.711,12 11.241,13 4.759,14 22.643,15 119.157,16 8.693,17 0.581,18 3.981,19 4.091,20 3.665,21 3.602,22 5.174,23 3.564,24 4.441,25 4.572,26 4.065,27 3.97,28 5.646,29 3.918,30 4.739,31 4.898,32 4.194,33 4.129,34 6.041,35 4.053,36 4.833,37 5.014,38 4.192,39 4.122,40 6.096,41 4.045,42 4.868,43 5.06,44 4.221,45 4.112,46 6.172,47 4.026,48 4.801,49 5.012,50 4.04,51 4.039,52 6.008,53 3.915,54 4.659,55 4.897,56 4.005,57 3.935,58 5.756,59 3.783,60 4.481,61 4.697,62 3.82,63 3.818,64 5.633,65 3.672,66 0.092,67 0.67,68 7.917,69 4.1,70 5.2}
{0 CHEMBL1988300,1 6.325,2 5,3 0.122,4 0.153,5 0.124,7 4.408,8 4.408,11 1.51,12 11.464,13 4.014,14 16.111,15 117.879,16 8.522,17 0.813,18 3.936,19 4.051,20 3.668,21 3.612,22 5.117,23 3.572,24 4.381,25 4.507,26 4.048,27 4.015,28 5.523,29 3.953,30 4.591,31 4.764,32 4.078,33 4.102,34 5.678,35 4.013,36 4.643,37 4.84,38 4.042,39 4.083,40 5.677,41 3.963,42 4.561,43 4.77,44 3.843,45 3.978,46 5.535,47 3.834,48 4.437,49 4.634,50 3.849,51 3.853,52 5.527,53 3.756,54 4.431,55 4.642,56 3.789,57 3.813,58 5.477,59 3.71,60 4.359,61 4.576,62 3.663,63 3.751,64 5.425,65 3.628,66 0.051,67 0.679,68 7.664,69 3.54,70 5.2}
{0 CHEMBL1988370,1 25.129,2 25.865,3 0.026,4 -0.138,5 0.341,7 3.715,8 3.715,9 6.086,10 1,11 1.41,12 13.5,13 4.667,14 21.778,15 137.395,16 6.979,17 0.564,18 4.275,19 4.404,20 3.81,21 3.835,22 5.268,23 3.802,24 4.837,25 5.021,26 4.147,27 4.246,28 5.758,29 4.184,30 5.093,31 5.323,32 4.149,33 4.365,34 5.921,35 4.259,36 5.141,37 5.396,38 4.147,39 4.354,40 5.967,41 4.242,42 5.104,43 5.346,44 4.122,45 4.36,46 5.931,47 4.249,48 5.102,49 5.34,50 4.121,51 4.354,52 5.961,53 4.239,54 5.12,55 5.385,56 4.053,57 4.301,58 5.98,59 4.174,60 5.005,61 5.255,62 3.963,63 4.227,64 5.815,65 4.105,66 0.06,67 0.98,68 14.508,69 5.963,70 5.2}
{0 CHEMBL1988387,1 23.089,2 28.448,3 0.055,4 -0.003,5 0.826,6 0.247,7 3.88,8 3.88,9 4.299,10 1,11 1.842,12 16.139,13 4.519,14 20.42,15 135.961,16 9.046,17 0.675,18 4.166,19 4.272,20 3.917,21 3.737,22 5.405,23 3.737,24 4.655,25 4.789,26 4.312,27 4.128,28 6.114,29 4.108,30 4.798,31 4.954,32 4.298,33 4.249,34 5.964,35 4.196,36 4.901,37 5.074,38 4.396,39 4.286,40 6.126,41 4.218,42 4.949,43 5.147,44 4.307,45 4.219,46 6.209,47 4.148,48 4.787,49 4.979,50 4.097,51 4.069,52 5.998,53 4.013,54 4.706,55 4.914,56 3.981,57 4.005,58 5.893,59 3.923,60 4.694,61 4.908,62 3.88,63 3.946,64 5.809,65 3.859,66 0.194,67 1.016,68 8.063,69 4.781,70 5.3}
{0 CHEMBL1988437,1 7.851,2 5.913,3 0.052,4 0.09,5 0.169,7 3.946,8 3.946,11 1.585,12 12.286,13 4.493,14 20.186,15 114.788,16 8.402,17 0.71,18 3.933,19 4.041,20 3.653,21 3.596,22 5.11,23 3.55,24 4.385,25 4.525,26 4.009,27 3.968,28 5.533,29 3.895,30 4.58,31 4.752,32 4.064,33 4.071,34 5.68,35 3.961,36 4.574,37 4.747,38 4.008,39 3.986,40 5.713,41 3.882,42 4.522,43 4.712,44 3.866,45 3.941,46 5.584,47 3.83,48 4.549,49 4.75,50 3.804,51 3.926,52 5.609,53 3.818,54 4.533,55 4.753,56 3.746,57 3.841,58 5.597,59 3.752,60 4.411,61 4.634,62 3.583,63 3.705,64 5.489,65 3.601,66 0.044,67 0.663,68 7.861,69 3.899,70 5.2}
{0 CHEMBL1988537,1 16.56,2 18.34,4 -0.137,5 0.345,6 0.293,7 3.775,8 3.775,9 5.167,10 1,11 1.753,12 8.84,13 4.183,14 17.497,15 99.724,16 9.707,17 0.643,18 3.771,19 3.845,20 3.617,21 3.465,22 4.971,23 3.428,24 4.249,25 4.354,26 4.032,27 3.858,28 5.423,29 3.803,30 4.452,31 4.567,32 4.283,33 4.02,34 5.661,35 3.943,36 4.489,37 4.615,38 4.127,39 3.968,40 5.741,41 3.903,42 4.491,43 4.636,44 4.068,45 3.946,46 5.778,47 3.888,48 4.445,49 4.589,50 4.03,51 3.922,52 5.757,53 3.834,54 4.383,55 4.559,56 3.769,57 3.792,58 5.499,59 3.654,60 4.197,61 4.408,62 3.371,63 3.439,64 5.241,65 3.288,66 0.048,67 0.476,68 4.201,69 3.048,70 5.2}
{0 CHEMBL1988594,1 22.405,2 31.522,3 0.09,4 0.008,5 0.617,7 3.665,8 3.665,11 1.76,12 13.276,13 2.243,14 5.029,15 112.693,16 8.989,17 0.688,18 3.939,19 4.052,20 3.695,21 3.54,22 5.197,23 3.527,24 4.376,25 4.501,26 4.059,27 3.904,28 5.68,29 3.867,30 4.594,31 4.766,32 4.056,33 3.959,34 5.816,35 3.916,36 4.626,37 4.816,38 4.083,39 3.871,40 5.921,41 3.836,42 4.566,43 4.762,44 3.847,45 3.755,46 5.972,47 3.708,48 4.392,49 4.577,50 3.727,51 3.692,52 5.655,53 3.645,54 4.327,55 4.512,56 3.698,57 3.739,58 5.489,59 3.638,60 4.332,61 4.536,62 3.552,63 3.641,64 5.463,65 3.547,66 0.112,67 0.73,68 6.721,69 3.5,70 5.2}
{0 CHEMBL1988608,1 22.035,2 34.011,3 0.078,4 0.052,5 0.406,6 0.149,7 4.199,8 4.199,11 1.663,12 11.75,13 1.259,14 1.586,15 105.617,16 8.343,17 0.516,18 3.942,19 4.049,20 3.589,21 3.482,22 5.203,23 3.496,24 4.37,25 4.513,26 3.917,27 3.806,28 5.623,29 3.81,30 4.56,31 4.726,32 3.903,33 3.863,34 5.887,35 3.837,36 4.584,37 4.801,38 3.79,39 3.817,40 5.739,41 3.766,42 4.491,43 4.682,44 3.759,45 3.759,46 5.716,47 3.726,48 4.497,49 4.685,50 3.778,51 3.748,52 5.737,53 3.726,54 4.483,55 4.651,56 3.761,57 3.691,58 5.804,59 3.679,60 4.471,61 4.688,62 3.681,63 3.595,64 5.746,65 3.568,66 0.148,67 0.696,68 7.509,69 3.658,70 5.2}
{0 CHEMBL1988717,1 22.502,2 29.401,3 0.038,4 -0.045,5 1.139,7 3.929,8 3.929,11 1.79,12 15.528,13 3.183,14 10.128,15 128.671,16 8.955,17 0.675,18 4.158,19 4.281,20 3.863,21 3.663,22 5.429,23 3.699,24 4.658,25 4.807,26 4.309,27 4.05,28 6.295,29 4.08,30 4.823,31 4.994,32 4.278,33 4.162,34 6.129,35 4.164,36 4.944,37 5.146,38 4.282,39 4.142,40 6.275,41 4.143,42 4.925,43 5.15,44 4.205,45 4.032,46 6.283,47 4.037,48 4.761,49 4.975,50 4.007,51 3.944,52 6.019,53 3.931,54 4.693,55 4.908,56 3.993,57 3.893,58 6.234,59 3.857,60 4.569,61 4.784,62 3.795,63 3.83,64 5.741,65 3.781,66 0.258,67 1.127,68 7.531,69 4.272,70 5.2}
{0 CHEMBL1988838,1 28.574,2 45.114,3 0.071,4 -0.061,5 0.591,6 0.4,7 3.922,8 3.922,9 5.226,10 1,11 1.831,12 13.233,13 2.577,14 6.64,15 112.858,16 8.57,17 0.563,18 4.031,19 4.141,20 3.832,21 3.553,22 5.24,23 3.545,24 4.507,25 4.642,26 4.092,27 3.884,28 6.003,29 3.869,30 4.719,31 4.879,32 4.08,33 3.974,34 6.04,35 3.94,36 4.761,37 4.978,38 3.97,39 3.929,40 5.928,41 3.873,42 4.683,43 4.899,44 3.963,45 3.917,46 5.914,47 3.861,48 4.656,49 4.851,50 3.916,51 3.884,52 5.873,53 3.833,54 4.661,55 4.898,56 3.855,57 3.82,58 5.894,59 3.736,60 4.505,61 4.731,62 3.754,63 3.71,64 5.633,65 3.633,66 0.194,67 0.806,68 11.113,69 4.266,70 5.5}
{0 CHEMBL1988995,1 8.106,2 4.928,3 -0.039,4 -0.11,5 0.593,7 4.486,8 4.486,11 1.785,12 9.25,13 4.651,14 21.632,15 98.081,16 9.057,17 0.781,18 3.913,19 4.019,20 3.648,21 3.431,22 5.17,23 3.47,24 4.422,25 4.567,26 4.07,27 3.823,28 5.685,29 3.862,30 4.6,31 4.783,32 4.096,33 3.878,34 5.878,35 3.91,36 4.636,37 4.844,38 4.093,39 3.86,40 6.034,41 3.895,42 4.563,43 4.737,44 4.038,45 3.873,46 5.805,47 3.894,48 4.569,49 4.723,50 4.066,51 3.888,52 5.92,53 3.896,54 4.611,55 4.808,56 3.964,57 3.816,58 5.862,59 3.814,60 4.491,61 4.708,62 3.799,63 3.641,64 5.806,65 3.635,66 0.18,67 0.842,68 5.319,69 3.434,70 5.2}
{0 CHEMBL1989029,1 15.478,2 19.632,3 0.035,4 0.046,5 0.161,7 3.971,8 3.971,9 5.573,10 1,11 1.588,12 7.9,13 2.985,14 8.913,15 77.838,16 7.695,17 0.5,18 3.678,19 3.788,20 3.271,21 3.203,22 4.853,23 3.201,24 4.16,25 4.313,26 3.63,27 3.563,28 5.307,29 3.549,30 4.327,31 4.506,32 3.574,33 3.584,34 5.471,35 3.546,36 4.305,37 4.523,38 3.458,39 3.547,40 5.358,41 3.479,42 4.202,43 4.395,44 3.464,45 3.477,46 5.294,47 3.439,48 4.284,49 4.481,50 3.466,51 3.419,52 5.506,53 3.385,54 4.212,55 4.451,56 3.146,57 3.266,58 5.293,59 3.192,60 3.996,61 4.236,62 2.849,63 3.107,64 4.993,65 2.99,66 0.073,67 0.518,68 6.862,69 3.108,70 5.2}
{0 CHEMBL1989265,1 24.039,2 35.128,3 0.072,4 -0.042,5 0.682,6 0.765,7 3.816,8 3.816,11 1.844,12 8.4,13 1.999,14 3.996,15 95.228,16 8.452,17 0.214,18 3.897,19 4.003,20 3.602,21 3.457,22 5.057,23 3.434,24 4.471,25 4.623,26 4.055,27 3.909,28 5.672,29 3.871,30 4.764,31 4.958,32 4.169,33 4.081,34 5.924,35 4.018,36 4.828,37 5.016,38 4.283,39 4.094,40 6.185,41 4.034,42 4.754,43 4.923,44 4.099,45 3.989,46 6.121,47 3.945,48 4.736,49 4.936,50 3.898,51 3.809,52 6.069,53 3.759,54 4.604,55 4.815,56 3.785,57 3.655,58 6.044,59 3.592,60 4.414,61 4.634,62 3.369,63 3.561,64 5.502,65 3.393,66 0.134,67 0.731,68 7.976,69 4.184,70 5.2}
{0 CHEMBL1989474,1 4.79,2 3.162,3 -0.035,4 -0.119,5 0.144,7 3.579,8 3.579,11 1.595,12 7.632,13 2.801,14 7.843,15 71.083,16 8.476,17 0.81,18 3.535,19 3.651,20 3.22,21 3.103,22 4.776,23 3.11,24 3.995,25 4.161,26 3.548,27 3.444,28 5.236,29 3.449,30 4.128,31 4.311,32 3.506,33 3.507,34 5.342,35 3.478,36 4.12,37 4.324,38 3.44,39 3.451,40 5.255,41 3.408,42 4.065,43 4.257,44 3.433,45 3.428,46 5.177,47 3.393,48 4.139,49 4.364,50 3.297,51 3.38,52 5.31,53 3.307,54 4.048,55 4.309,56 2.965,57 3.167,58 5.128,59 3.033,60 3.785,61 4.112,62 2.493,63 2.608,64 4.937,65 2.475,66 0.058,67 0.549,68 4.47,69 2.41,70 5.2}
{0 CHEMBL1989518,1 5.204,2 5.612,3 0.008,4 -0.089,5 0.116,7 3.481,8 3.481,9 5.416,10 1,11 1.509,12 9.167,13 0.67,14 0.448,15 71.612,16 7.313,17 0.632,18 3.58,19 3.706,20 3.126,21 3.112,22 4.745,23 3.093,24 4.031,25 4.203,26 3.344,27 3.412,28 5.119,29 3.367,30 4.212,31 4.427,32 3.297,33 3.467,34 5.245,35 3.375,36 4.11,37 4.346,38 3.096,39 3.346,40 5.028,41 3.229,42 4.033,43 4.272,44 3.074,45 3.281,46 4.987,47 3.18,48 3.986,49 4.212,50 3.046,51 3.253,52 5.015,53 3.149,54 3.975,55 4.233,56 2.944,57 3.13,58 4.949,59 3.019,60 3.793,61 4.054,62 2.674,63 2.861,64 4.776,65 2.756,66 0.023,67 0.478,68 6.745,69 2.801,70 5.2}
{0 CHEMBL1989646,1 12.138,2 15.495,3 0.065,4 0.251,5 0.172,7 4.124,8 4.124,11 1.465,12 9.391,13 3.125,14 9.764,15 93.752,16 7.805,17 0.808,18 3.796,19 3.934,20 3.417,21 3.353,22 4.964,23 3.343,24 4.266,25 4.435,26 3.77,27 3.74,28 5.346,29 3.714,30 4.443,31 4.638,32 3.756,33 3.814,34 5.497,35 3.758,36 4.557,37 4.8,38 3.626,39 3.765,40 5.55,41 3.683,42 4.429,43 4.686,44 3.55,45 3.644,46 5.388,47 3.569,48 4.324,49 4.556,50 3.5,51 3.589,52 5.357,53 3.511,54 4.289,55 4.548,56 3.366,57 3.481,58 5.294,59 3.38,60 4.123,61 4.385,62 2.948,63 3.318,64 5.028,65 3.181,66 0.106,67 0.658,68 7.422,69 3.087,70 5.5}
{0 CHEMBL1989708,1 22.442,2 27.679,3 0.073,4 0.07,5 0.458,7 3.89,8 3.89,11 1.63,12 15.278,13 4.038,14 16.302,15 145.241,16 8.043,17 0.675,18 4.236,19 4.355,20 3.898,21 3.828,22 5.397,23 3.795,24 4.722,25 4.876,26 4.272,27 4.228,28 5.867,29 4.173,30 4.955,31 5.137,32 4.305,33 4.348,34 6.047,35 4.265,36 5.039,37 5.255,38 4.397,39 4.371,40 6.129,41 4.273,42 5.007,43 5.21,44 4.29,45 4.309,46 6.138,47 4.212,48 4.888,49 5.099,50 4.121,51 4.19,52 5.974,53 4.099,54 4.824,55 5.035,56 4.042,57 4.141,58 5.905,59 4.046,60 4.832,61 5.044,62 4.069,63 4.152,64 5.887,65 4.035,66 0.094,67 0.955,68 11.989,69 5.424,70 5.2}
{0 CHEMBL1989805,1 17.343,2 18.162,3 0.098,4 0.076,5 0.823,6 1.197,7 3.704,8 3.704,11 1.847,12 8.63,13 0.977,14 0.954,15 98.22,16 9.754,17 0.333,18 3.828,19 3.907,20 3.648,21 3.427,22 5.176,23 3.438,24 4.286,25 4.369,26 4.079,27 3.833,28 5.615,29 3.827,30 4.486,31 4.596,32 4.159,33 3.942,34 5.778,35 3.921,36 4.59,37 4.699,38 4.374,39 4.031,40 6.079,41 4.028,42 4.692,43 4.806,44 4.371,45 4.053,46 6.263,47 4.042,48 4.624,49 4.747,50 4.164,51 3.86,52 6.406,53 3.865,54 4.473,55 4.669,56 3.549,57 3.582,58 5.838,59 3.537,60 4.185,61 4.382,62 3.413,63 3.33,64 5.524,65 3.312,66 0.179,67 0.587,68 4.374,69 3.165,70 5.2}
{0 CHEMBL1989856,1 7.146,2 6.908,3 0.026,4 -0.133,5 0.446,7 3.997,8 3.997,11 1.644,12 6.158,13 2.742,14 7.52,15 68.799,16 8.974,17 0.714,18 3.478,19 3.563,20 3.197,21 3.085,22 4.831,23 3.103,24 3.931,25 4.052,26 3.587,27 3.47,28 5.175,29 3.479,30 4.14,31 4.267,32 3.755,33 3.607,34 5.465,35 3.629,36 4.286,37 4.426,38 3.772,39 3.606,40 5.841,41 3.618,42 4.227,43 4.41,44 3.438,45 3.406,46 5.7,47 3.402,48 3.89,49 4.063,50 3.144,51 3.129,52 5.566,53 3.085,54 3.537,55 3.754,56 2.403,57 2.675,58 4.905,59 2.555,60 3.195,61 3.51,62 1.297,63 2,64 4.248,65 1.749,66 0.076,67 0.402,68 3.492,69 2.167,70 5.2}
{0 CHEMBL1990212,1 16.71,2 26.219,3 -0.023,4 -0.049,5 0.58,7 4.064,8 4.064,9 10.649,10 2,11 1.744,12 10.778,13 4.605,14 21.209,15 104.815,16 8.88,17 0.733,18 3.904,19 4.008,20 3.625,21 3.439,22 5.112,23 3.452,24 4.377,25 4.517,26 3.987,27 3.787,28 5.537,29 3.794,30 4.516,31 4.67,32 4.103,33 3.878,34 5.713,35 3.872,36 4.567,37 4.743,38 4.03,39 3.863,40 5.707,41 3.838,42 4.591,43 4.792,44 3.956,45 3.842,46 5.72,47 3.795,48 4.525,49 4.719,50 3.88,51 3.785,52 5.617,53 3.74,54 4.423,55 4.609,56 3.738,57 3.722,58 5.514,59 3.648,60 4.408,61 4.65,62 3.645,63 3.607,64 5.409,65 3.526,66 0.123,67 0.662,68 6.266,69 3.475,70 5.2}
{0 CHEMBL1990254,1 8.567,2 11.74,3 0.064,4 0.07,5 0.264,7 3.577,8 3.577,11 1.428,12 10.833,13 2.189,14 4.792,15 94.747,16 7.382,17 0.692,18 3.839,19 3.964,20 3.395,21 3.446,22 4.993,23 3.412,24 4.307,25 4.464,26 3.691,27 3.81,28 5.412,29 3.746,30 4.584,31 4.795,32 3.752,33 3.932,34 5.622,35 3.841,36 4.622,37 4.84,38 3.68,39 3.882,40 5.71,41 3.784,42 4.637,43 4.877,44 3.623,45 3.836,46 5.766,47 3.726,48 4.54,49 4.789,50 3.472,51 3.724,52 5.599,53 3.605,54 4.344,55 4.585,56 3.342,57 3.564,58 5.437,59 3.455,60 4.208,61 4.448,62 3.158,63 3.42,64 5.268,65 3.302,66 0.04,67 0.603,68 8.459,69 3.715,70 5.35}
{0 CHEMBL1990288,1 12.302,2 18.958,3 -0.008,4 -0.179,5 0.398,7 3.714,8 3.714,11 1.612,12 11.433,13 5.438,14 29.571,15 112.445,16 8.322,17 0.794,18 4.007,19 4.115,20 3.679,21 3.578,22 5.197,23 3.586,24 4.497,25 4.642,26 4.055,27 3.955,28 5.697,29 3.949,30 4.698,31 4.894,32 4.045,33 4.038,34 5.81,35 4.005,36 4.708,37 4.912,38 4.014,39 4.015,40 5.797,41 3.977,42 4.753,43 4.963,44 4.074,45 4.055,46 5.837,47 4.021,48 4.759,49 4.959,50 4.055,51 4.04,52 5.901,53 4.004,54 4.698,55 4.91,56 3.917,57 3.942,58 5.801,59 3.887,60 4.583,61 4.809,62 3.762,63 3.819,64 5.734,65 3.752,66 0.056,67 0.798,68 7.618,69 3.932,70 5.2}
{0 CHEMBL1990346,1 4.806,2 3.176,3 0.111,4 0.339,5 0.073,7 3.67,8 3.67,11 1.567,12 6.529,13 3.256,14 10.599,15 72.536,16 10.673,17 0.842,18 3.43,19 3.547,20 3.31,21 3.108,22 4.61,23 3.072,24 3.864,25 3.99,26 3.742,27 3.51,28 4.996,29 3.448,30 4.07,31 4.241,32 3.761,33 3.596,34 5.157,35 3.496,36 4.062,37 4.254,38 3.513,39 3.492,40 5.099,41 3.384,42 3.984,43 4.195,44 3.348,45 3.351,46 5.039,47 3.24,48 3.943,49 4.2,50 3.361,51 3.192,52 4.937,53 3.032,54 3.628,55 3.92,56 3.318,57 2.838,58 4.503,59 2.596,60 2.902,61 3.173,62 3.462,63 2.233,64 3.913,65 1.969,66 0.056,67 0.399,68 2.283,69 1.973,70 5.2}
{0 CHEMBL1990415,1 7.52,2 10.692,3 0.045,4 0.009,5 0.331,7 3.946,8 3.946,11 1.6,12 9.227,13 1.751,14 3.067,15 78.606,16 8.767,17 0.84,18 3.654,19 3.766,20 3.367,21 3.248,22 4.896,23 3.263,24 4.102,25 4.233,26 3.722,27 3.62,28 5.356,29 3.62,30 4.297,31 4.471,32 3.729,33 3.66,34 5.513,35 3.645,36 4.278,37 4.476,38 3.579,39 3.523,40 5.512,41 3.502,42 4.142,43 4.34,44 3.498,45 3.375,46 5.459,47 3.37,48 3.978,49 4.165,50 3.364,51 3.29,52 5.212,53 3.279,54 3.938,55 4.151,56 3.19,57 3.219,58 5.083,59 3.174,60 3.803,61 4.029,62 3.018,63 3.051,64 4.987,65 3.003,66 0.077,67 0.543,68 4.523,69 2.39,70 5.2}
{0 CHEMBL1990482,1 2.824,2 2.351,3 0.084,4 -0.008,5 0.294,7 3.672,8 3.672,11 1.617,12 7.111,13 1.122,14 1.259,15 66.006,16 8.51,17 0.8,18 3.476,19 3.594,20 3.152,21 3.054,22 4.742,23 3.066,24 3.908,25 4.042,26 3.505,27 3.417,28 5.218,29 3.412,30 4.091,31 4.263,32 3.496,33 3.463,34 5.309,35 3.442,36 4.087,37 4.28,38 3.426,39 3.358,40 5.384,41 3.339,42 4.006,43 4.228,44 3.22,45 3.22,46 5.255,47 3.174,48 3.768,49 3.978,50 2.886,51 3.076,52 4.87,53 2.992,54 3.599,55 3.808,56 2.765,57 2.898,58 4.776,59 2.811,60 3.519,61 3.764,62 2.419,63 2.509,64 4.79,65 2.425,66 0.059,67 0.452,68 4.267,69 2.027,70 5.2}
{0 CHEMBL1990496,1 16.529,2 19.072,3 0.042,4 -0.044,5 0.338,6 0.204,7 4.111,8 4.111,11 1.424,12 12.886,13 3.739,14 13.976,15 139.236,16 7.445,17 0.59,18 4.217,19 4.341,20 3.791,21 3.819,22 5.338,23 3.789,24 4.717,25 4.883,26 4.138,27 4.215,28 5.779,29 4.161,30 4.992,31 5.193,32 4.24,33 4.369,34 6.029,35 4.293,36 5.09,37 5.319,38 4.217,39 4.352,40 6.154,41 4.27,42 5.066,43 5.281,44 4.264,45 4.362,46 6.144,47 4.29,48 5.123,49 5.34,50 4.275,51 4.386,52 6.204,53 4.316,54 5.16,55 5.388,56 4.228,57 4.397,58 6.248,59 4.299,60 5.144,61 5.399,62 4.092,63 4.345,64 6.105,65 4.227,66 0.05,67 0.9,68 12.159,69 5.309,70 5.2}
{0 CHEMBL1990583,1 24.033,2 33.471,3 0.065,4 -0.043,5 0.837,7 3.681,8 3.681,11 1.782,12 13.4,13 2.421,14 5.863,15 109.43,16 8.814,17 0.667,18 3.974,19 4.098,20 3.664,21 3.481,22 5.276,23 3.516,24 4.417,25 4.555,26 4.031,27 3.842,28 5.789,29 3.861,30 4.657,31 4.839,32 4.04,33 3.918,34 5.954,35 3.925,36 4.671,37 4.869,38 4.011,39 3.841,40 6.045,41 3.846,42 4.635,43 4.842,44 3.852,45 3.732,46 6.073,47 3.728,48 4.453,49 4.648,50 3.747,51 3.659,52 5.88,53 3.65,54 4.368,55 4.563,56 3.66,57 3.686,58 5.585,59 3.636,60 4.394,61 4.611,62 3.592,63 3.618,64 5.597,65 3.57,66 0.188,67 0.833,68 6.625,69 3.302,70 5.2}
{0 CHEMBL1990821,1 17.956,2 17.777,3 0.05,4 0.041,5 0.362,7 4.065,8 4.065,9 6.06,10 1,11 1.337,12 11.875,13 7.827,14 61.262,15 129.513,16 7.01,17 0.629,18 4.181,19 4.291,20 3.692,21 3.779,22 5.266,23 3.735,24 4.704,25 4.871,26 4.061,27 4.172,28 5.78,29 4.109,30 4.923,31 5.094,32 4.172,33 4.337,34 5.938,35 4.255,36 5.095,37 5.294,38 4.161,39 4.392,40 6.068,41 4.29,42 5.159,43 5.384,44 4.079,45 4.38,46 6.097,47 4.255,48 5.15,49 5.39,50 4.021,51 4.314,52 6.123,53 4.182,54 5.09,55 5.356,56 3.845,57 4.179,58 6.043,59 4.026,60 4.847,61 5.089,62 3.823,63 4.037,64 5.842,65 3.926,66 0.054,67 0.773,68 13.04,69 6.083,70 5.2}
{0 CHEMBL1990884,1 20.28,2 25.585,3 0.095,4 0.08,5 0.657,7 4.214,8 4.214,11 1.651,12 11.759,13 4.399,14 19.354,15 109.399,16 8.134,17 0.688,18 3.99,19 4.105,20 3.618,21 3.554,22 5.233,23 3.556,24 4.459,25 4.601,26 4.021,27 3.94,28 5.727,29 3.929,30 4.675,31 4.823,32 4.104,33 4.058,34 5.949,35 4.039,36 4.816,37 5.009,38 4.06,39 4.048,40 6.086,41 4.012,42 4.787,43 4.999,44 3.921,45 3.946,46 6.066,47 3.893,48 4.686,49 4.933,50 3.774,51 3.793,52 5.886,53 3.738,54 4.411,55 4.618,56 3.663,57 3.632,58 5.705,59 3.605,60 4.365,61 4.567,62 3.637,63 3.559,64 5.828,65 3.532,66 0.1,67 0.772,68 8.295,69 4.046,70 5.2}
{0 CHEMBL1990885,1 25.99,2 30.71,3 0.012,4 -0.12,5 0.714,7 4.111,8 4.111,11 1.584,12 11.655,13 2.998,14 8.987,15 113.678,16 7.117,17 0.355,18 4.101,19 4.238,20 3.612,21 3.603,22 5.199,23 3.578,24 4.649,25 4.852,26 3.983,27 3.985,28 5.735,29 3.943,30 4.864,31 5.08,32 4.051,33 4.122,34 5.954,35 4.066,36 4.978,37 5.196,38 4.03,39 4.168,40 6.076,41 4.077,42 5.06,43 5.324,44 3.954,45 4.095,46 6.164,47 3.994,48 4.949,49 5.221,50 3.905,51 4.029,52 6.047,53 3.935,54 4.824,55 5.053,56 3.867,57 3.978,58 5.943,59 3.895,60 4.825,61 5.057,62 3.837,63 3.927,64 6.073,65 3.851,66 0.042,67 0.89,68 12.112,69 4.992,70 5.2}
{0 CHEMBL1990904,1 9.533,2 13.162,3 -0.005,4 -0.211,5 0.243,7 3.699,8 3.699,11 1.563,12 9.889,13 3.744,14 14.015,15 100.737,16 8.192,17 0.71,18 3.926,19 4.047,20 3.589,21 3.49,22 5.071,23 3.494,24 4.418,25 4.588,26 3.908,27 3.834,28 5.565,29 3.817,30 4.61,31 4.831,32 3.939,33 3.903,34 5.707,35 3.871,36 4.574,37 4.792,38 3.906,39 3.88,40 5.656,41 3.853,42 4.537,43 4.729,44 3.962,45 3.928,46 5.62,47 3.903,48 4.627,49 4.823,50 3.974,51 3.98,52 5.795,53 3.94,54 4.653,55 4.876,56 3.816,57 3.909,58 5.711,59 3.831,60 4.556,61 4.817,62 3.586,63 3.669,64 5.638,65 3.581,66 0.045,67 0.796,68 7.338,69 3.536,70 5.2}
{0 CHEMBL1990912,1 7.215,2 11.409,3 0.043,4 -0.069,5 0.167,7 3.695,8 3.695,11 1.49,12 9.1,13 1.764,14 3.112,15 80.13,16 7.581,17 0.773,18 3.66,19 3.777,20 3.244,21 3.241,22 4.814,23 3.222,24 4.129,25 4.288,26 3.534,27 3.605,28 5.226,29 3.56,30 4.354,31 4.564,32 3.557,33 3.715,34 5.381,35 3.633,36 4.319,37 4.543,38 3.403,39 3.627,40 5.294,41 3.522,42 4.251,43 4.49,44 3.324,45 3.522,46 5.251,47 3.419,48 4.115,49 4.336,50 3.192,51 3.402,52 5.104,53 3.299,54 4.031,55 4.265,56 3.056,57 3.25,58 5.023,59 3.143,60 3.894,61 4.148,62 2.838,63 3.014,64 4.913,65 2.904,66 0.032,67 0.509,68 6.782,69 2.996,70 5.2}
{0 CHEMBL1991063,1 13.185,2 11.288,3 0.053,4 0.119,5 0.263,7 3.871,8 3.871,9 5.887,10 1,11 1.644,12 12.69,13 4.541,14 20.621,15 116.704,16 8.722,17 0.688,18 4,19 4.112,20 3.701,21 3.613,22 5.139,23 3.585,24 4.501,25 4.647,26 4.088,27 4.01,28 5.587,29 3.962,30 4.745,31 4.917,32 4.237,33 4.143,34 5.86,35 4.052,36 4.813,37 5.043,38 3.941,39 4.062,40 5.762,41 3.942,42 4.692,43 4.914,44 3.852,45 3.964,46 5.672,47 3.855,48 4.679,49 4.894,50 3.891,51 3.916,52 5.725,53 3.815,54 4.616,55 4.843,56 3.835,57 3.824,58 5.667,59 3.719,60 4.443,61 4.656,62 3.681,63 3.719,64 5.495,65 3.612,66 0.075,67 0.697,68 7.833,69 4.077,70 6.4}
{0 CHEMBL1991078,1 23.134,2 32.19,3 0.009,4 0.076,5 0.702,6 0.522,7 3.97,8 3.97,9 10.536,10 2,11 1.62,12 14.412,13 4.2,14 17.642,15 129.082,16 8.117,17 0.711,18 4.156,19 4.268,20 3.802,21 3.687,22 5.354,23 3.696,24 4.64,25 4.788,26 4.139,27 4.056,28 5.786,29 4.055,30 4.797,31 4.958,32 4.179,33 4.149,34 5.951,35 4.123,36 4.903,37 5.1,38 4.137,39 4.123,40 6.032,41 4.089,42 4.89,43 5.102,44 4.093,45 4.067,46 6.047,47 4.033,48 4.781,49 4.991,50 4.043,51 4.019,52 5.935,53 3.977,54 4.759,55 4.986,56 3.97,57 3.957,58 5.882,59 3.916,60 4.616,61 4.805,62 3.884,63 3.909,64 5.765,65 3.866,66 0.137,67 0.87,68 9.734,69 4.717,70 6.2}
{0 CHEMBL1991138,1 23.655,2 23.807,3 0.026,4 -0.138,5 0.317,7 3.715,8 3.715,9 6.074,10 1,11 1.41,12 13.5,13 4.881,14 23.819,15 135.731,16 6.979,17 0.564,18 4.275,19 4.404,20 3.81,21 3.835,22 5.267,23 3.802,24 4.836,25 5.018,26 4.148,27 4.243,28 5.755,29 4.181,30 5.096,31 5.33,32 4.157,33 4.351,34 5.94,35 4.247,36 5.132,37 5.393,38 4.146,39 4.324,40 5.978,41 4.224,42 5.06,43 5.29,44 4.118,45 4.351,46 5.902,47 4.241,48 5.106,49 5.347,50 4.116,51 4.368,52 5.956,53 4.247,54 5.119,55 5.38,56 4.051,57 4.313,58 5.971,59 4.182,60 5.02,61 5.276,62 3.974,63 4.201,64 5.846,65 4.089,66 0.06,67 0.98,68 14.508,69 5.963,70 5.2}
{0 CHEMBL1991143,1 20.52,2 23.739,3 0.033,4 0.075,5 0.582,7 3.943,8 3.943,11 1.692,12 8.833,13 4.382,14 19.2,15 92.879,16 8.942,17 0.63,18 3.779,19 3.875,20 3.504,21 3.388,22 4.991,23 3.378,24 4.265,25 4.4,26 3.937,27 3.791,28 5.438,29 3.78,30 4.497,31 4.636,32 4.074,33 3.91,34 5.753,35 3.902,36 4.615,37 4.783,38 4.07,39 3.885,40 5.947,41 3.878,42 4.534,43 4.706,44 3.973,45 3.799,46 5.919,47 3.779,48 4.418,49 4.579,50 3.789,51 3.739,52 5.698,53 3.683,54 4.375,55 4.593,56 3.554,57 3.624,58 5.488,59 3.501,60 4.146,61 4.383,62 3.06,63 3.373,64 5.126,65 3.204,66 0.128,67 0.547,68 5.435,69 3.125,70 5.2}
{0 CHEMBL1991180,1 23.907,2 26.855,3 0.043,4 0.128,5 1.053,7 4.002,8 4.002,9 5.022,10 1,11 1.864,12 10.571,13 0.548,14 0.3,15 99.94,16 8.827,17 0.533,18 3.955,19 4.067,20 3.628,21 3.305,22 5.33,23 3.378,24 4.377,25 4.526,26 3.959,27 3.633,28 5.699,29 3.704,30 4.498,31 4.642,32 4.031,33 3.706,34 5.92,35 3.767,36 4.676,37 4.861,38 4.094,39 3.732,40 6.13,41 3.793,42 4.653,43 4.843,44 3.985,45 3.677,46 6.059,47 3.725,48 4.603,49 4.81,50 3.89,51 3.589,52 6.023,53 3.629,54 4.502,55 4.671,56 3.797,57 3.536,58 5.977,59 3.582,60 4.47,61 4.684,62 3.68,63 3.556,64 5.665,65 3.563,66 0.379,67 0.686,68 7.141,69 3.065,70 5.5}
{0 CHEMBL1991188,1 18.962,2 24.013,3 -0.005,4 -0.09,5 0.567,6 0.473,7 3.785,8 3.785,9 10.602,10 2,11 1.592,12 11.571,13 3.54,14 12.529,15 104.688,16 7.764,17 0.6,18 3.983,19 4.085,20 3.575,21 3.525,22 5.184,23 3.518,24 4.48,25 4.634,26 3.899,27 3.869,28 5.651,29 3.853,30 4.668,31 4.829,32 4.023,33 4.021,34 5.881,35 3.991,36 4.782,37 4.957,38 4.01,39 4.045,40 6.027,41 3.993,42 4.874,43 5.091,44 3.918,45 4.022,46 6.023,47 3.951,48 4.784,49 4.993,50 3.824,51 3.923,52 5.938,53 3.855,54 4.687,55 4.907,56 3.753,57 3.843,58 5.825,59 3.767,60 4.658,61 4.897,62 3.651,63 3.754,64 5.905,65 3.665,66 0.056,67 0.72,68 9.046,69 4.611,70 5.2}
{0 CHEMBL1991285,1 25.707,2 31.855,3 0.019,4 -0.135,5 0.971,6 0.86,7 3.698,8 3.698,9 5.908,10 1,11 1.794,12 12.9,13 3.094,14 9.575,15 107.55,16 8.598,17 0.375,18 4.022,19 4.126,20 3.685,21 3.534,22 5.263,23 3.542,24 4.544,25 4.693,26 4.06,27 3.926,28 5.808,29 3.903,30 4.837,31 5.026,32 4.127,33 4.049,34 6.018,35 3.996,36 4.887,37 5.101,38 4.03,39 3.931,40 6.101,41 3.882,42 4.709,43 4.904,44 3.956,45 3.808,46 5.986,47 3.783,48 4.617,49 4.792,50 3.995,51 3.86,52 5.909,53 3.82,54 4.713,55 4.923,56 3.956,57 3.959,58 5.822,59 3.885,60 4.754,61 4.958,62 4.052,63 3.962,64 6.009,65 3.893,66 0.163,67 0.738,68 8.045,69 4.197,70 5.2}
{0 CHEMBL1991356,1 16.113,2 19.091,3 0.018,4 -0.113,5 0.19,7 3.82,8 3.82,9 5.27,10 1,11 1.493,12 8.5,13 3.454,14 11.932,15 84.165,16 8.065,17 0.68,18 3.716,19 3.814,20 3.368,21 3.321,22 4.878,23 3.316,24 4.206,25 4.333,26 3.74,27 3.71,28 5.352,29 3.695,30 4.404,31 4.56,32 3.796,33 3.829,34 5.531,35 3.789,36 4.444,37 4.622,38 3.709,39 3.798,40 5.566,41 3.74,42 4.415,43 4.633,44 3.518,45 3.688,46 5.455,47 3.602,48 4.215,49 4.408,50 3.379,51 3.497,52 5.33,53 3.424,54 4.069,55 4.269,56 3.2,57 3.34,58 5.168,59 3.265,60 3.983,61 4.202,62 3.08,63 3.17,64 5.113,65 3.09,66 0.021,67 0.49,68 6.097,69 3.062,70 5.2}
{0 CHEMBL1991395,1 10.612,2 14.867,3 -0.004,4 -0.217,5 0.325,7 3.7,8 3.7,11 1.644,12 10.69,13 3.298,14 10.879,15 108.712,16 7.85,17 0.688,18 4.027,19 4.151,20 3.635,21 3.542,22 5.207,23 3.544,24 4.536,25 4.712,26 4.012,27 3.932,28 5.686,29 3.92,30 4.78,31 4.976,32 4.066,33 4.076,34 5.915,35 4.029,36 4.953,37 5.223,38 3.989,39 4.047,40 5.984,41 3.984,42 4.715,43 4.936,44 4.037,45 4.02,46 5.774,47 3.982,48 4.754,49 4.957,50 4.078,51 4.056,52 5.982,53 4.023,54 4.766,55 4.981,56 3.93,57 4.021,58 5.862,59 3.946,60 4.721,61 4.975,62 3.733,63 3.827,64 5.822,65 3.736,66 0.075,67 0.859,68 9.333,69 4.119,70 5.2}
{0 CHEMBL1991429,1 30.162,2 48.926,3 0.019,4 -0.154,5 0.463,6 0.4,7 3.798,8 3.798,11 1.608,12 15.907,13 5.972,14 35.667,15 166.611,16 8.368,17 0.673,18 4.371,19 4.48,20 4.077,21 3.993,22 5.51,23 3.969,24 4.879,25 5.023,26 4.463,27 4.384,28 6.008,29 4.344,30 5.119,31 5.314,32 4.432,33 4.468,34 6.192,35 4.405,36 5.103,37 5.303,38 4.444,39 4.439,40 6.226,41 4.384,42 5.13,43 5.314,44 4.537,45 4.498,46 6.287,47 4.445,48 5.166,49 5.365,50 4.521,51 4.523,52 6.279,53 4.442,54 5.123,55 5.326,56 4.437,57 4.463,58 6.189,59 4.376,60 5.079,61 5.296,62 4.366,63 4.407,64 6.154,65 4.328,66 0.039,67 1.065,68 11.75,69 5.851,70 5.2}
{0 CHEMBL1991434,1 14.352,2 13.516,3 -0.016,4 -0.033,5 0.468,6 0.86,7 3.879,8 3.879,9 15.355,10 3,11 1.659,12 9.917,13 4.289,14 18.396,15 93.83,16 10.217,17 0.462,18 3.762,19 3.83,20 3.599,21 3.357,22 5.002,23 3.352,24 4.231,25 4.34,26 3.988,27 3.707,28 5.455,29 3.692,30 4.337,31 4.446,32 4.052,33 3.812,34 5.593,35 3.767,36 4.422,37 4.567,38 3.873,39 3.775,40 5.569,41 3.724,42 4.475,43 4.638,44 3.835,45 3.734,46 5.653,47 3.697,48 4.426,49 4.599,50 3.888,51 3.645,52 5.632,53 3.595,54 4.265,55 4.449,56 3.965,57 3.494,58 5.505,59 3.442,60 4.035,61 4.18,62 3.761,63 3.352,64 5.342,65 3.295,66 0.121,67 0.457,68 3.479,69 3.402,70 5.2}
{0 CHEMBL1991577,1 14.61,2 22.014,3 0.04,4 -0.091,5 0.184,7 3.465,8 3.465,11 1.508,12 9.227,13 2.327,14 5.416,15 85.913,16 6.963,17 0.25,18 3.85,19 3.971,20 3.349,21 3.375,22 4.934,23 3.345,24 4.372,25 4.56,26 3.647,27 3.729,28 5.359,29 3.665,30 4.675,31 4.927,32 3.68,33 3.839,34 5.707,35 3.729,36 4.657,37 4.924,38 3.54,39 3.794,40 5.569,41 3.661,42 4.591,43 4.85,44 3.579,45 3.749,46 5.53,47 3.648,48 4.547,49 4.763,50 3.589,51 3.679,52 5.674,53 3.616,54 4.506,55 4.717,56 3.47,57 3.579,58 5.68,59 3.511,60 4.41,61 4.641,62 3.197,63 3.49,64 5.462,65 3.368,66 0.043,67 0.624,68 9.641,69 4.071,70 5.2}
{0 CHEMBL1991640,1 23.819,2 32.466,3 0.054,4 -0.049,5 0.97,6 0.309,7 3.9,8 3.9,11 1.85,12 9.964,13 4.047,14 16.374,15 105.392,16 9.29,17 0.375,18 3.918,19 4.011,20 3.711,21 3.538,22 5.122,23 3.532,24 4.427,25 4.555,26 4.091,27 3.923,28 5.658,29 3.899,30 4.673,31 4.839,32 4.282,33 4.03,34 6.002,35 4.019,36 4.727,37 4.873,38 4.36,39 4.063,40 6.264,41 4.051,42 4.761,43 4.925,44 4.255,45 4.027,46 6.261,47 4.006,48 4.702,49 4.884,50 4.076,51 3.867,52 6.095,53 3.861,54 4.6,55 4.793,56 3.907,57 3.65,58 6.216,59 3.644,60 4.309,61 4.523,62 3.446,63 3.499,64 5.573,65 3.424,66 0.145,67 0.79,68 5.927,69 3.793,70 5.8}
{0 CHEMBL1991674,1 13.245,2 20.57,3 0.045,4 -0.141,5 0.369,7 3.816,8 3.816,11 1.674,12 9.958,13 2.716,14 7.379,15 92.956,16 8.187,17 0.593,18 3.866,19 3.988,20 3.512,21 3.411,22 4.951,23 3.399,24 4.411,25 4.575,26 3.916,27 3.829,28 5.492,29 3.788,30 4.714,31 4.947,32 3.899,33 3.926,34 5.679,35 3.845,36 4.676,37 4.933,38 3.857,39 3.827,40 5.66,41 3.736,42 4.512,43 4.76,44 3.769,45 3.743,46 5.51,47 3.651,48 4.391,49 4.592,50 3.858,51 3.72,52 5.46,53 3.64,54 4.371,55 4.574,56 3.718,57 3.666,58 5.473,59 3.555,60 4.246,61 4.452,62 3.43,63 3.525,64 5.247,65 3.404,66 0.068,67 0.664,68 7.815,69 3.484,70 5.8}
{0 CHEMBL1991678,1 14.665,2 17.662,3 -0.003,4 -0.187,5 0.507,7 3.942,8 3.942,11 1.695,12 10.774,13 3.786,14 14.337,15 113.52,16 8.009,17 0.647,18 4.086,19 4.208,20 3.703,21 3.59,22 5.29,23 3.598,24 4.604,25 4.783,26 4.103,27 3.979,28 5.795,29 3.979,30 4.847,31 5.036,32 4.198,33 4.126,34 6.061,35 4.106,36 5.037,37 5.296,38 4.173,39 4.122,40 6.274,41 4.087,42 4.829,43 5.046,44 4.162,45 4.108,46 5.949,47 4.078,48 4.842,49 5.039,50 4.243,51 4.135,52 6.155,53 4.125,54 4.892,55 5.089,56 4.156,57 4.139,58 6.155,59 4.098,60 4.909,61 5.158,62 3.918,63 3.983,64 6.107,65 3.897,66 0.118,67 0.969,68 9.554,69 4.477,70 5.2}
{0 CHEMBL1991725,1 15.288,2 16.618,3 0.009,4 -0.151,5 0.581,6 0.163,7 4.363,8 4.363,9 6.173,10 1,11 1.478,12 13.472,13 3.578,14 12.802,15 140.891,16 7.379,17 0.675,18 4.268,19 4.389,20 3.835,21 3.828,22 5.367,23 3.807,24 4.789,25 4.964,26 4.166,27 4.22,28 5.823,29 4.179,30 5.024,31 5.211,32 4.203,33 4.372,34 6.034,35 4.285,36 5.15,37 5.396,38 4.145,39 4.344,40 6.071,41 4.236,42 5.086,43 5.311,44 4.108,45 4.259,46 6.12,47 4.175,48 5.055,49 5.286,50 4.143,51 4.267,52 6.003,53 4.186,54 5.078,55 5.295,56 4.192,57 4.301,58 6.105,59 4.222,60 5.143,61 5.386,62 4.165,63 4.292,64 6.153,65 4.209,66 0.034,67 0.953,68 13.145,69 5.715,70 5.2}
{0 CHEMBL1991728,1 47.003,2 56.857,3 0.072,4 0.065,5 0.818,6 1.072,7 4.022,8 4.022,11 1.598,12 22.185,13 -0.928,14 0.862,15 207.385,16 7.183,17 0.218,18 4.718,19 4.894,20 4.199,21 4.089,22 5.966,23 4.091,24 5.165,25 5.381,26 4.502,27 4.43,28 6.398,29 4.387,30 5.413,31 5.656,32 4.538,33 4.572,34 6.569,35 4.522,36 5.5,37 5.755,38 4.566,39 4.639,40 6.554,41 4.573,42 5.523,43 5.758,44 4.676,45 4.696,46 6.623,47 4.64,48 5.619,49 5.852,50 4.695,51 4.752,52 6.788,53 4.688,54 5.77,55 6.058,56 4.671,57 4.76,58 6.865,59 4.662,60 5.668,61 5.937,62 4.631,63 4.684,64 6.812,65 4.601,66 0.353,67 1.579,68 23.445,69 6.543,70 5.2}
{0 CHEMBL1991800,1 14.25,2 16.338,3 0.015,4 -0.169,5 0.321,7 3.794,8 3.794,11 1.574,12 11,13 4.584,14 21.015,15 125.278,16 7.443,17 0.595,18 4.201,19 4.327,20 3.77,21 3.734,22 5.298,23 3.718,24 4.729,25 4.915,26 4.119,27 4.113,28 5.788,29 4.075,30 4.976,31 5.189,32 4.2,33 4.249,34 6.031,35 4.187,36 5.127,37 5.396,38 4.184,39 4.246,40 6.121,41 4.183,42 4.949,43 5.168,44 4.246,45 4.262,46 5.963,47 4.217,48 5.003,49 5.21,50 4.288,51 4.326,52 6.142,53 4.279,54 5.033,55 5.243,56 4.175,57 4.332,58 6.055,59 4.242,60 5.048,61 5.291,62 4.085,63 4.239,64 6.059,65 4.136,66 0.042,67 1.002,68 12.288,69 5.296,70 5.2}
{0 CHEMBL1991846,1 8.592,2 7.94,3 0.027,4 -0.023,5 0.169,7 3.482,8 3.482,9 5.801,10 1,11 1.41,12 12.32,13 2.603,14 6.776,15 100.649,16 7.205,17 0.667,18 3.903,19 4.024,20 3.443,21 3.489,22 5.028,23 3.454,24 4.377,25 4.538,26 3.704,27 3.829,28 5.422,29 3.767,30 4.628,31 4.841,32 3.678,33 3.921,34 5.613,35 3.809,36 4.647,37 4.905,38 3.515,39 3.82,40 5.505,41 3.682,42 4.529,43 4.771,44 3.535,45 3.758,46 5.478,47 3.649,48 4.536,49 4.771,50 3.522,51 3.75,52 5.517,53 3.638,54 4.505,55 4.769,56 3.461,57 3.672,58 5.435,59 3.561,60 4.302,61 4.529,62 3.34,63 3.553,64 5.297,65 3.451,66 0.04,67 0.635,68 9.425,69 4.123,70 5.2}
{0 CHEMBL1992242,1 16.574,2 26.577,3 0.047,4 -0.025,5 0.237,7 3.819,8 3.819,11 1.533,12 11.37,13 5.226,14 27.309,15 111.923,16 8.12,17 0.733,18 3.925,19 4.033,20 3.626,21 3.589,22 5.058,23 3.54,24 4.397,25 4.544,26 3.975,27 3.981,28 5.516,29 3.903,30 4.606,31 4.773,32 3.94,33 4.077,34 5.66,35 3.974,36 4.703,37 4.925,38 3.913,39 4.028,40 5.732,41 3.916,42 4.629,43 4.832,44 3.772,45 3.921,46 5.742,47 3.808,48 4.596,49 4.859,50 3.661,51 3.79,52 5.594,53 3.652,54 4.3,55 4.509,56 3.4,57 3.573,58 5.39,59 3.465,60 4.157,61 4.38,62 3.402,63 3.503,64 5.154,65 3.406,66 0.042,67 0.638,68 8.779,69 3.936,70 5.2}
{0 CHEMBL1992306,1 27.005,2 35.733,3 0.02,4 -0.09,5 1.042,6 0.86,7 3.823,8 3.823,9 5.659,10 1,11 1.851,12 14.161,13 3.511,14 12.33,15 105.654,16 8.967,17 0.545,18 3.997,19 4.101,20 3.686,21 3.491,22 5.298,23 3.531,24 4.489,25 4.623,26 4.11,27 3.816,28 6.236,29 3.853,30 4.676,31 4.839,32 4.071,33 3.898,34 6.066,35 3.92,36 4.708,37 4.891,38 4.01,39 3.82,40 6.132,41 3.85,42 4.63,43 4.809,44 3.973,45 3.782,46 6.126,47 3.797,48 4.598,49 4.8,50 3.772,51 3.749,52 5.88,53 3.727,54 4.498,55 4.687,56 3.833,57 3.661,58 6.162,59 3.639,60 4.375,61 4.578,62 3.599,63 3.578,64 5.639,65 3.552,66 0.263,67 0.914,68 6.42,69 4.067,70 5.2}
{0 CHEMBL1992323,1 10.589,2 12.349,3 0.024,4 -0.121,5 0.245,7 3.442,8 3.442,11 1.88,12 5.467,13 2.042,14 4.169,15 53.809,16 11.031,17 0.588,18 3.209,19 3.271,20 3.093,21 2.825,22 4.503,23 2.863,24 3.67,25 3.743,26 3.522,27 3.212,28 5.036,29 3.245,30 3.839,31 3.935,32 3.54,33 3.227,34 5.277,35 3.242,36 3.655,37 3.761,38 3.296,39 2.998,40 5.049,41 3.01,42 3.305,43 3.423,44 3.112,45 2.663,46 4.747,47 2.655,48 3.083,49 3.243,50 2.634,51 2.315,52 4.491,53 2.278,54 2.647,55 2.862,56 2.218,57 1.644,58 4.164,59 1.514,60 1.378,61 1.669,62 0.233,63 0.566,64 1.962,65 0.355,66 0.124,67 0.285,68 0.887,69 1.374,70 5.2}
{0 CHEMBL1992342,1 8.618,2 5.975,3 0.09,4 0.128,5 0.378,7 4.487,8 4.487,11 1.722,12 10.217,13 3.041,14 9.246,15 94.331,16 8.06,17 0.64,18 3.823,19 3.938,20 3.624,21 3.413,22 4.915,23 3.363,24 4.335,25 4.482,26 3.868,27 3.79,28 5.659,29 3.725,30 4.576,31 4.774,32 3.867,33 3.888,34 5.708,35 3.791,36 4.586,37 4.795,38 3.758,39 3.84,40 5.754,41 3.727,42 4.516,43 4.735,44 3.542,45 3.705,46 5.69,47 3.595,48 4.324,49 4.552,50 3.404,51 3.562,52 5.374,53 3.446,54 4.216,55 4.461,56 3.319,57 3.43,58 5.217,59 3.293,60 4.139,61 4.403,62 3.197,63 3.273,64 5.171,65 3.116,66 0.131,67 0.66,68 10.786,69 3.913,70 5.2}
{0 CHEMBL1992536,1 19.509,2 26.986,3 0.059,4 0.04,5 0.342,7 4.199,8 4.199,9 5.124,10 1,11 1.643,12 11.577,13 2.123,14 4.505,15 98.998,16 8.295,17 0.552,18 3.881,19 3.978,20 3.529,21 3.417,22 5.129,23 3.433,24 4.309,25 4.447,26 3.838,27 3.735,28 5.509,29 3.745,30 4.45,31 4.603,32 3.846,33 3.791,34 5.759,35 3.766,36 4.502,37 4.708,38 3.66,39 3.732,40 5.633,41 3.67,42 4.409,43 4.634,44 3.598,45 3.634,46 5.512,47 3.582,48 4.309,49 4.474,50 3.655,51 3.591,52 5.565,53 3.583,54 4.315,55 4.467,56 3.657,57 3.57,58 5.62,59 3.568,60 4.377,61 4.589,62 3.552,63 3.479,64 5.638,65 3.455,66 0.133,67 0.627,68 7.132,69 3.564,70 5.2}
{0 CHEMBL1992555,1 13.202,2 10.434,3 0.046,4 0.128,5 0.581,7 4.015,8 4.015,11 1.858,12 13.517,13 4.273,14 18.259,15 107.782,16 9.701,17 0.656,18 3.896,19 3.983,20 3.716,21 3.486,22 5.217,23 3.49,24 4.331,25 4.423,26 4.111,27 3.827,28 5.767,29 3.83,30 4.501,31 4.65,32 4.043,33 3.863,34 5.82,35 3.818,36 4.469,37 4.637,38 3.927,39 3.694,40 5.823,41 3.675,42 4.328,43 4.486,44 3.852,45 3.551,46 5.69,47 3.55,48 4.203,49 4.334,50 3.727,51 3.479,52 5.849,53 3.484,54 4.146,55 4.289,56 3.619,57 3.466,58 5.523,59 3.454,60 4.107,61 4.258,62 3.565,63 3.459,64 5.324,65 3.417,66 0.23,67 0.664,68 4.685,69 3.363,70 5.2}
{0 CHEMBL1992634,1 1.644,2 0.676,3 0.037,4 -0.02,5 0.072,7 3.531,8 3.531,11 1.498,12 6.313,13 3.299,14 10.884,15 67.699,16 10.926,17 0.889,18 3.348,19 3.448,20 3.262,21 3.069,22 4.484,23 3.027,24 3.797,25 3.919,26 3.686,27 3.463,28 4.903,29 3.394,30 3.988,31 4.16,32 3.702,33 3.503,34 5.012,35 3.396,36 3.884,37 4.077,38 3.529,39 3.376,40 4.858,41 3.259,42 3.819,43 4.027,44 3.629,45 3.264,46 4.798,47 3.124,48 3.658,49 3.889,50 3.279,51 3.042,52 4.61,53 2.862,54 3.29,55 3.525,56 3.033,57 2.685,58 4.21,59 2.45,60 2.69,61 2.945,62 2.334,63 2.051,64 3.486,65 1.751,66 0.011,67 0.318,68 1.526,69 1.767,70 5.2}
{0 CHEMBL1992645,1 21.593,2 22.017,3 0.071,4 0.08,5 0.909,6 0.4,7 4.06,8 4.06,11 1.853,12 17.821,13 5.54,14 30.686,15 149.515,16 9.306,17 0.571,18 4.227,19 4.303,20 4.097,21 3.864,22 5.484,23 3.827,24 4.707,25 4.804,26 4.406,27 4.241,28 6.21,29 4.188,30 4.98,31 5.127,32 4.49,33 4.357,34 6.298,35 4.289,36 5.032,37 5.188,38 4.421,39 4.288,40 6.498,41 4.223,42 4.995,43 5.178,44 4.417,45 4.236,46 6.274,47 4.163,48 4.98,49 5.153,50 4.355,51 4.155,52 6.583,53 4.098,54 4.809,55 4.965,56 4.234,57 4.048,58 6.206,59 4.009,60 4.729,61 4.87,62 4.25,63 4.028,64 6.264,65 3.99,66 0.281,67 0.931,68 10.607,69 5.935,70 5.2}
{0 CHEMBL1992732,1 25.224,2 28.187,3 -0.018,4 -0.004,5 0.727,7 3.842,8 3.842,9 5.552,10 1,11 1.739,12 11.367,13 2.087,14 4.356,15 113.729,16 8.068,17 0.485,18 4.079,19 4.21,20 3.709,21 3.483,22 5.296,23 3.515,24 4.578,25 4.758,26 4.034,27 3.844,28 5.712,29 3.859,30 4.76,31 4.98,32 4.053,33 3.883,34 5.918,35 3.874,36 4.743,37 4.95,38 4.131,39 3.887,40 5.96,41 3.907,42 4.772,43 4.97,44 4.125,45 3.944,46 5.97,47 3.952,48 4.84,49 5.06,50 4,51 3.897,52 6.031,53 3.889,54 4.818,55 5.054,56 3.913,57 3.746,58 6.133,59 3.749,60 4.587,61 4.836,62 3.609,63 3.587,64 5.726,65 3.552,66 0.271,67 0.83,68 9.676,69 3.754,70 6.1}
{0 CHEMBL1992740,1 22.362,2 29.373,3 -0.015,4 -0.12,5 0.925,6 0.149,7 4.061,8 4.061,11 1.7,12 14.032,13 2.673,14 7.144,15 113.254,16 7.67,17 0.471,18 4.138,19 4.277,20 3.722,21 3.6,22 5.268,23 3.603,24 4.701,25 4.902,26 4.077,27 3.99,28 5.792,29 3.974,30 4.97,31 5.206,32 4.156,33 4.118,34 6.169,35 4.074,36 5.012,37 5.268,38 4.03,39 4.098,40 6.095,41 4.014,42 4.994,43 5.281,44 3.947,45 3.993,46 6.082,47 3.906,48 4.797,49 5.061,50 3.895,51 3.869,52 5.882,53 3.816,54 4.706,55 4.941,56 3.884,57 3.774,58 5.944,59 3.748,60 4.671,61 4.923,62 3.747,63 3.701,64 5.872,65 3.651,66 0.142,67 1.024,68 11.193,69 4.709,70 5.2}
{0 CHEMBL1992796,1 19.033,2 27.14,3 0.066,4 0.155,5 0.298,7 3.677,8 3.677,11 1.515,12 9.586,13 4.333,14 18.771,15 114.983,16 8.509,17 0.545,18 3.967,19 4.071,20 3.66,21 3.642,22 5.106,23 3.612,24 4.464,25 4.59,26 4.051,27 4.057,28 5.581,29 4.006,30 4.748,31 4.928,32 4.12,33 4.192,34 5.795,35 4.116,36 4.761,37 4.941,38 4.167,39 4.181,40 5.866,41 4.118,42 4.841,43 5.023,44 4.259,45 4.217,46 6.015,47 4.165,48 4.852,49 5.037,50 4.192,51 4.203,52 6.007,53 4.128,54 4.791,55 4.998,56 4.102,57 4.098,58 5.933,59 3.997,60 4.646,61 4.872,62 3.789,63 3.923,64 5.681,65 3.793,66 0.045,67 0.629,68 7.274,69 3.78,70 5.2}
{0 CHEMBL1992922,1 8.106,2 13.611,3 0.068,4 -0.089,5 0.358,7 3.529,8 3.529,11 1.626,12 7.762,13 1.22,14 1.489,15 81.692,16 7.685,17 0.696,18 3.736,19 3.856,20 3.311,21 3.231,22 4.921,23 3.236,24 4.214,25 4.372,26 3.63,27 3.615,28 5.34,29 3.589,30 4.448,31 4.661,32 3.692,33 3.709,34 5.518,35 3.658,36 4.486,37 4.699,38 3.682,39 3.691,40 5.666,41 3.642,42 4.454,43 4.676,44 3.618,45 3.672,46 5.562,47 3.613,48 4.418,49 4.634,50 3.577,51 3.609,52 5.521,53 3.558,54 4.404,55 4.642,56 3.347,57 3.439,58 5.61,59 3.353,60 4.152,61 4.426,62 2.753,63 3.142,64 5.16,65 2.984,66 0.091,67 0.571,68 7.458,69 3.003,70 5.2}
{0 CHEMBL1992937,1 16.865,2 24.114,3 0.023,4 -0.073,5 0.36,7 3.759,8 3.759,11 1.736,12 9.25,13 3.206,14 10.281,15 73.451,16 8.687,17 0.727,18 3.589,19 3.707,20 3.279,21 3.095,22 4.871,23 3.121,24 4.042,25 4.187,26 3.638,27 3.46,28 5.455,29 3.472,30 4.208,31 4.392,32 3.577,33 3.48,34 5.451,35 3.477,36 4.251,37 4.484,38 3.396,39 3.328,40 5.467,41 3.302,42 3.953,43 4.171,44 3.281,45 3.063,46 5.277,47 3.08,48 3.754,49 3.944,50 3.155,51 3.014,52 5.066,53 3.02,54 3.719,55 3.924,56 2.975,57 2.974,58 4.95,59 2.928,60 3.621,61 3.82,62 2.78,63 2.879,64 4.8,65 2.824,66 0.162,67 0.522,68 4.644,69 2.19,70 5.2}
{0 CHEMBL1993166,1 53.519,2 69.143,3 0.05,4 -0.014,5 0.832,6 1.072,7 4.022,8 4.022,11 1.591,12 22.875,13 -2.22,14 4.927,15 216.423,16 7.12,17 0.211,18 4.765,19 4.941,20 4.239,21 4.122,22 6,23 4.125,24 5.22,25 5.444,26 4.543,27 4.463,28 6.432,29 4.424,30 5.456,31 5.694,32 4.582,33 4.622,34 6.603,35 4.571,36 5.581,37 5.843,38 4.61,39 4.704,40 6.606,41 4.629,42 5.6,43 5.84,44 4.718,45 4.756,46 6.669,47 4.69,48 5.699,49 5.944,50 4.737,51 4.804,52 6.842,53 4.731,54 5.817,55 6.108,56 4.73,57 4.807,58 6.895,59 4.709,60 5.735,61 6.002,62 4.68,63 4.726,64 6.892,65 4.648,66 0.355,67 1.638,68 24.877,69 6.763,70 5.2}
{0 CHEMBL1993243,1 14.121,2 13.532,3 0.065,4 0.029,5 0.25,7 3.942,8 3.942,9 10.822,10 2,11 1.743,12 9.88,13 2.296,14 5.272,15 98.898,16 8.836,17 0.571,18 3.832,19 3.922,20 3.587,21 3.433,22 5.032,23 3.418,24 4.318,25 4.436,26 3.96,27 3.822,28 5.532,29 3.789,30 4.425,31 4.56,32 3.988,33 3.922,34 5.598,35 3.859,36 4.499,37 4.64,38 3.992,39 3.946,40 5.65,41 3.855,42 4.491,43 4.683,44 3.816,45 3.868,46 5.531,47 3.743,48 4.385,49 4.557,50 3.904,51 3.71,52 5.595,53 3.662,54 4.34,55 4.512,56 3.772,57 3.639,58 5.524,59 3.574,60 4.292,61 4.502,62 3.395,63 3.452,64 5.456,65 3.349,66 0.091,67 0.583,68 6.407,69 3.565,70 5.2}
{0 CHEMBL1993424,1 20.779,2 33.334,3 0.045,4 -0.13,5 0.408,7 4.507,8 4.507,11 1.737,12 10.963,13 3.093,14 9.566,15 105.045,16 8.625,17 0.733,18 3.914,19 4.017,20 3.758,21 3.522,22 5.051,23 3.493,24 4.406,25 4.539,26 4.02,27 3.891,28 5.838,29 3.854,30 4.622,31 4.798,32 3.979,33 3.965,34 5.801,35 3.897,36 4.661,37 4.884,38 3.885,39 3.873,40 5.785,41 3.799,42 4.537,43 4.755,44 3.825,45 3.795,46 5.716,47 3.733,48 4.483,49 4.691,50 3.772,51 3.777,52 5.6,53 3.714,54 4.412,55 4.625,56 3.772,57 3.731,58 5.665,59 3.652,60 4.308,61 4.505,62 3.61,63 3.632,64 5.441,65 3.544,66 0.113,67 0.718,68 9.667,69 3.916,70 5.2}
{0 CHEMBL1993548,1 8.387,2 7.661,3 0.008,4 -0.083,5 0.213,7 3.493,8 3.493,9 5.525,10 1,11 1.632,12 9.25,13 1.921,14 3.689,15 81.896,16 8.05,17 0.571,18 3.666,19 3.785,20 3.289,21 3.222,22 4.823,23 3.194,24 4.138,25 4.304,26 3.608,27 3.542,28 5.257,29 3.494,30 4.351,31 4.554,32 3.631,33 3.641,34 5.45,35 3.544,36 4.343,37 4.59,38 3.398,39 3.525,40 5.272,41 3.391,42 4.101,43 4.313,44 3.422,45 3.42,46 5.146,47 3.33,48 4.106,49 4.298,50 3.474,51 3.472,52 5.208,53 3.369,54 4.204,55 4.444,56 3.434,57 3.425,58 5.244,59 3.3,60 3.955,61 4.155,62 3.272,63 3.168,64 5.135,65 3.053,66 0.03,67 0.506,68 6.708,69 3.083,70 5.2}
{0 CHEMBL1993584,1 8.307,2 7.558,3 0.033,4 -0.061,5 0.243,7 3.726,8 3.726,9 5.755,10 1,11 1.471,12 13.214,13 3.186,14 10.151,15 110.078,16 7.581,17 0.71,18 3.992,19 4.1,20 3.578,21 3.577,22 5.135,23 3.558,24 4.475,25 4.617,26 3.882,27 3.943,28 5.561,29 3.903,30 4.719,31 4.907,32 3.865,33 4.031,34 5.772,35 3.945,36 4.724,37 4.955,38 3.716,39 3.952,40 5.654,41 3.84,42 4.661,43 4.89,44 3.695,45 3.86,46 5.669,47 3.766,48 4.628,49 4.841,50 3.678,51 3.817,52 5.7,53 3.732,54 4.584,55 4.823,56 3.619,57 3.747,58 5.602,59 3.663,60 4.432,61 4.649,62 3.506,63 3.64,64 5.466,65 3.563,66 0.033,67 0.674,68 9.462,69 4.376,70 5.2}
{0 CHEMBL1993661,1 30.317,2 48.09,3 -0.023,4 -0.285,5 1.12,6 0.4,7 4.11,8 4.11,9 16.027,10 3,11 1.907,12 11.875,13 3.932,14 15.464,15 121.203,16 8.889,17 0.529,18 4.111,19 4.204,20 3.936,21 3.603,22 5.286,23 3.6,24 4.616,25 4.763,26 4.226,27 3.934,28 5.96,29 3.928,30 4.737,31 4.86,32 4.388,33 4.076,34 6.042,35 4.065,36 4.876,37 5.021,38 4.331,39 4.12,40 6.196,41 4.093,42 4.969,43 5.147,44 4.274,45 4.142,46 6.153,47 4.104,48 4.94,49 5.135,50 4.313,51 4.162,52 6.119,53 4.066,54 4.929,55 5.175,56 4.294,57 4.037,58 6.102,59 3.956,60 4.72,61 4.943,62 4.027,63 3.848,64 5.956,65 3.787,66 0.217,67 0.817,68 11.13,69 4.877,70 6.3}
{0 CHEMBL1993722,1 17.119,2 20.358,3 0.13,4 0.139,5 0.789,7 3.959,8 3.959,11 1.771,12 12.2,13 3.01,14 9.06,15 108.322,16 8.813,17 0.667,18 3.971,19 4.081,20 3.652,21 3.515,22 5.294,23 3.541,24 4.407,25 4.524,26 4.035,27 3.9,28 5.833,29 3.906,30 4.666,31 4.829,32 4.088,33 4.006,34 6.008,35 4,36 4.73,37 4.914,38 4.029,39 3.964,40 6.046,41 3.951,42 4.689,43 4.878,44 3.975,45 3.874,46 6.139,47 3.857,48 4.624,49 4.838,50 3.802,51 3.746,52 6.071,53 3.714,54 4.431,55 4.653,56 3.628,57 3.58,58 5.866,59 3.536,60 4.259,61 4.467,62 3.521,63 3.461,64 5.553,65 3.437,66 0.205,67 0.779,68 6.708,69 3.6,70 5.2}
{0 CHEMBL1993781,1 11.483,2 13.19,3 0.01,4 -0.067,5 0.201,7 3.481,8 3.481,9 11.396,10 2,11 1.466,12 13.889,13 2.151,14 4.626,15 106.938,16 7.23,17 0.621,18 3.99,19 4.107,20 3.53,21 3.538,22 5.112,23 3.514,24 4.479,25 4.637,26 3.778,27 3.866,28 5.529,29 3.817,30 4.699,31 4.902,32 3.769,33 3.947,34 5.72,35 3.851,36 4.74,37 4.993,38 3.584,39 3.831,40 5.616,41 3.709,42 4.558,43 4.793,44 3.573,45 3.777,46 5.478,47 3.676,48 4.6,49 4.83,50 3.623,51 3.814,52 5.572,53 3.712,54 4.632,55 4.878,56 3.615,57 3.778,58 5.617,59 3.678,60 4.546,61 4.791,62 3.453,63 3.653,64 5.513,65 3.545,66 0.031,67 0.689,68 10.368,69 4.56,70 5.2}
{0 CHEMBL1993941,1 21.256,2 25.279,3 0.063,4 0.036,5 0.505,7 3.889,8 3.889,11 1.69,12 15.143,13 4.791,14 22.957,15 138.978,16 8.39,17 0.692,18 4.177,19 4.295,20 3.877,21 3.782,22 5.361,23 3.754,24 4.661,25 4.812,26 4.247,27 4.175,28 5.848,29 4.125,30 4.89,31 5.084,32 4.286,33 4.278,34 6.007,35 4.207,36 4.93,37 5.127,38 4.371,39 4.298,40 6.095,41 4.215,42 4.934,43 5.133,44 4.253,45 4.25,46 6.089,47 4.157,48 4.806,49 5.004,50 4.115,51 4.132,52 6.044,53 4.05,54 4.751,55 4.964,56 3.995,57 4.095,58 5.813,59 3.995,60 4.766,61 4.982,62 3.972,63 4.087,64 5.818,65 3.968,66 0.095,67 0.97,68 10.125,69 4.988,70 5.2}
{0 CHEMBL1994040,1 16.265,2 17.95,3 0.015,4 -0.154,5 0.542,7 3.947,8 3.947,11 1.665,12 10.303,13 4.458,14 19.874,15 120.926,16 7.904,17 0.595,18 4.165,19 4.286,20 3.778,21 3.689,22 5.317,23 3.69,24 4.688,25 4.865,26 4.155,27 4.055,28 5.862,29 4.044,30 4.943,31 5.146,32 4.214,33 4.169,34 6.133,35 4.142,36 5.007,37 5.263,38 4.253,39 4.169,40 6.207,41 4.143,42 4.878,43 5.069,44 4.301,45 4.212,46 6.059,47 4.198,48 4.974,49 5.171,50 4.335,51 4.288,52 6.202,53 4.266,54 5.018,55 5.218,56 4.258,57 4.282,58 6.209,59 4.228,60 5.022,61 5.257,62 4.136,63 4.178,64 6.187,65 4.105,66 0.103,67 1.037,68 10.572,69 4.99,70 5.2}
{0 CHEMBL1994074,1 1.644,2 0.676,3 0.054,4 0.232,5 0.12,7 3.531,8 3.531,11 1.498,12 6.313,13 4.169,14 17.381,15 68.46,16 10.926,17 0.889,18 3.349,19 3.45,20 3.263,21 3.075,22 4.49,23 3.029,24 3.793,25 3.911,26 3.685,27 3.463,28 4.893,29 3.395,30 3.987,31 4.16,32 3.678,33 3.512,34 5.008,35 3.398,36 3.921,37 4.128,38 3.558,39 3.342,40 4.929,41 3.231,42 3.724,43 3.924,44 3.647,45 3.179,46 4.763,47 3.07,48 3.569,49 3.772,50 3.246,51 3.051,52 4.519,53 2.877,54 3.372,55 3.607,56 3.032,57 2.786,58 4.224,59 2.53,60 2.85,61 3.126,62 2.342,63 2.15,64 3.574,65 1.829,66 0.036,67 0.326,68 1.553,69 1.772,70 5.2}
{0 CHEMBL1994241,1 10.044,2 8.698,3 0.041,4 -0.029,5 0.31,7 4.081,8 4.081,9 5.103,10 1,11 1.722,12 8.783,13 4.042,14 16.339,15 90.659,16 10.578,17 0.64,18 3.682,19 3.766,20 3.542,21 3.312,22 4.971,23 3.305,24 4.12,25 4.233,26 3.95,27 3.676,28 5.339,29 3.652,30 4.308,31 4.44,32 4.11,33 3.787,34 5.599,35 3.736,36 4.347,37 4.514,38 4.066,39 3.731,40 5.628,41 3.66,42 4.246,43 4.429,44 3.976,45 3.629,46 5.486,47 3.553,48 4.128,49 4.298,50 4.084,51 3.551,52 5.479,53 3.496,54 4.087,55 4.263,56 3.775,57 3.475,58 5.447,59 3.384,60 3.873,61 4.025,62 3.613,63 3.274,64 5.325,65 3.207,66 0.083,67 0.465,68 2.785,69 2.743,70 5.2}
{0 CHEMBL1994321,1 23.906,2 28.787,3 0.079,4 0.024,5 0.371,7 4.424,8 4.424,11 1.746,12 15.343,13 3.734,14 13.944,15 141.263,16 8.718,17 0.579,18 4.164,19 4.266,20 4.006,21 3.806,22 5.326,23 3.754,24 4.651,25 4.786,26 4.27,27 4.169,28 6.019,29 4.102,30 4.854,31 5.015,32 4.264,33 4.272,34 6.053,35 4.187,36 4.885,37 5.074,38 4.287,39 4.257,40 6.085,41 4.16,42 4.85,43 5.051,44 4.142,45 4.177,46 6.031,47 4.07,48 4.753,49 4.954,50 4.099,51 4.092,52 5.907,53 3.993,54 4.696,55 4.872,56 4.136,57 4.085,58 5.863,59 3.98,60 4.724,61 4.915,62 4.167,63 4.079,64 5.947,65 3.964,66 0.136,67 0.89,68 12.253,69 5.366,70 5.2}
{0 CHEMBL1994361,1 14.673,2 13.064,3 0.087,4 0.091,5 0.38,7 4.169,8 4.169,9 5.938,10 1,11 1.554,12 14.806,13 4.442,14 19.735,15 139.067,16 7.878,17 0.7,18 4.215,19 4.329,20 3.823,21 3.812,22 5.409,23 3.798,24 4.701,25 4.838,26 4.181,27 4.205,28 5.852,29 4.173,30 4.98,31 5.16,32 4.27,33 4.328,34 6.156,35 4.274,36 5.061,37 5.27,38 4.216,39 4.294,40 6.307,41 4.228,42 5.003,43 5.214,44 4.161,45 4.25,46 6.142,47 4.183,48 4.998,49 5.207,50 4.151,51 4.227,52 6.196,53 4.161,54 4.994,55 5.229,56 4.039,57 4.174,58 6.118,59 4.09,60 4.859,61 5.088,62 3.959,63 4.086,64 5.97,65 3.997,66 0.067,67 0.923,68 11.015,69 5.318,70 5.2}
{0 CHEMBL1994526,1 12.427,2 15.179,3 0.042,4 -0.005,5 0.294,7 3.048,8 3.048,11 1.432,12 8.556,13 1.108,14 1.227,15 70.661,16 6.343,17 0.316,18 3.722,19 3.873,20 3.134,21 3.225,22 4.724,23 3.172,24 4.293,25 4.498,26 3.45,27 3.639,28 5.206,29 3.54,30 4.654,31 4.915,32 3.478,33 3.798,34 5.509,35 3.655,36 4.723,37 5.017,38 3.326,39 3.717,40 5.605,41 3.543,42 4.6,43 4.913,44 3.126,45 3.538,46 5.473,47 3.361,48 4.299,49 4.588,50 3.019,51 3.374,52 5.173,53 3.209,54 4.135,55 4.402,56 2.933,57 3.249,58 5.138,59 3.09,60 4.072,61 4.373,62 2.54,63 3.017,64 4.966,65 2.841,66 0.048,67 0.57,68 9.402,69 3.554,70 5.2}
{0 CHEMBL1994538,1 16.178,2 22.484,3 0.009,4 -0.151,5 0.845,7 3.549,8 3.549,11 1.905,12 9.583,13 1.889,14 3.57,15 78.386,16 9.803,17 0.654,18 3.689,19 3.796,20 3.454,21 3.186,22 5.038,23 3.248,24 4.182,25 4.314,26 3.902,27 3.523,28 6.064,29 3.584,30 4.327,31 4.495,32 3.856,33 3.611,34 5.725,35 3.657,36 4.384,37 4.562,38 3.9,39 3.539,40 5.991,41 3.607,42 4.346,43 4.522,44 3.801,45 3.424,46 5.945,47 3.511,48 4.249,49 4.454,50 3.587,51 3.239,52 5.854,53 3.305,54 4.01,55 4.213,56 3.334,57 3.116,58 5.438,59 3.165,60 3.887,61 4.053,62 3.458,63 3.059,64 5.849,65 3.106,66 0.254,67 0.778,68 3.155,69 2.596,70 5.3}
{0 CHEMBL1994693,1 20.593,2 25.689,3 0.094,4 0.056,5 0.279,7 3.911,8 3.911,11 1.64,12 11.643,13 3.447,14 11.882,15 112.681,16 8.611,17 0.688,18 3.942,19 4.054,20 3.68,21 3.591,22 5.106,23 3.559,24 4.429,25 4.562,26 4.098,27 4.015,28 5.597,29 3.953,30 4.667,31 4.839,32 4.131,33 4.139,34 5.728,35 4.052,36 4.699,37 4.882,38 4.117,39 4.101,40 5.798,41 4.005,42 4.677,43 4.878,44 3.941,45 3.973,46 5.802,47 3.888,48 4.576,49 4.791,50 3.756,51 3.829,52 5.689,53 3.746,54 4.472,55 4.713,56 3.532,57 3.677,58 5.505,59 3.576,60 4.293,61 4.532,62 3.427,63 3.564,64 5.294,65 3.444,66 0.052,67 0.699,68 7.493,69 3.692,70 5.2}
{0 CHEMBL1994830,1 11.234,2 11.281,3 0.055,4 0.089,5 0.291,7 3.808,8 3.808,9 5.895,10 1,11 1.965,12 9.826,13 3.151,14 9.931,15 89.821,16 10.775,17 0.808,18 3.655,19 3.726,20 3.572,21 3.296,22 4.941,23 3.293,24 4.086,25 4.164,26 3.998,27 3.68,28 5.408,29 3.655,30 4.211,31 4.312,32 3.962,33 3.661,34 5.455,35 3.621,36 4.131,37 4.254,38 3.815,39 3.551,40 5.295,41 3.51,42 3.979,43 4.109,44 3.683,45 3.459,46 5.179,47 3.432,48 4.053,49 4.184,50 3.698,51 3.505,52 5.315,53 3.454,54 4.045,55 4.219,56 3.593,57 3.441,58 5.187,59 3.347,60 3.77,61 3.932,62 3.413,63 3.14,64 5.051,65 3.047,66 0.151,67 0.49,68 2.127,69 2.395,70 5.2}
{0 CHEMBL1994864,1 17.621,2 23.806,3 0.046,4 -0.079,5 0.191,7 3.615,8 3.615,11 1.565,12 10,13 1.831,14 3.351,15 85.404,16 7.928,17 0.5,18 3.722,19 3.824,20 3.332,21 3.294,22 4.959,23 3.288,24 4.134,25 4.289,26 3.611,27 3.583,28 5.321,29 3.564,30 4.303,31 4.475,32 3.62,33 3.636,34 5.609,35 3.582,36 4.337,37 4.567,38 3.409,39 3.544,40 5.439,41 3.452,42 4.202,43 4.421,44 3.429,45 3.46,46 5.31,47 3.416,48 4.127,49 4.268,50 3.502,51 3.439,52 5.455,53 3.431,54 4.25,55 4.454,56 3.388,57 3.382,58 5.549,59 3.348,60 4.082,61 4.293,62 3.122,63 3.262,64 5.269,65 3.185,66 0.06,67 0.524,68 6.657,69 3.204,70 5.2}
{0 CHEMBL1994938,1 15.488,2 13.868,3 0.042,4 -0.054,5 0.217,7 3.707,8 3.707,11 1.721,12 13.8,13 3.081,14 9.489,15 127.56,16 9.649,17 0.636,18 4.017,19 4.131,20 3.844,21 3.661,22 5.165,23 3.612,24 4.502,25 4.655,26 4.23,27 4.059,28 5.621,29 3.977,30 4.714,31 4.908,32 4.249,33 4.163,34 5.74,35 4.038,36 4.752,37 4.953,38 4.184,39 4.146,40 5.791,41 4.013,42 4.718,43 4.927,44 4.049,45 4.068,46 5.751,47 3.928,48 4.648,49 4.859,50 4.141,51 3.953,52 5.813,53 3.845,54 4.544,55 4.754,56 4.268,57 3.908,58 5.664,59 3.777,60 4.468,61 4.679,62 4.038,63 3.77,64 5.673,65 3.645,66 0.043,67 0.75,68 6.624,69 4.204,70 5.2}
{0 CHEMBL1995172,1 8.92,2 10.97,3 0.066,4 0.269,5 0.079,7 3.451,8 3.451,11 1.578,12 4.923,13 3.114,14 9.696,15 55.812,16 11.755,17 0.733,18 3.16,19 3.262,20 3.133,21 2.885,22 4.257,23 2.843,24 3.651,25 3.775,26 3.593,27 3.324,28 4.7,29 3.258,30 3.785,31 3.946,32 3.528,33 3.334,34 4.75,35 3.205,36 3.69,37 3.911,38 3.311,39 3.074,40 4.607,41 2.918,42 3.332,43 3.576,44 3.355,45 2.689,46 4.267,47 2.513,48 2.8,49 3.033,50 2.909,51 2.149,52 3.731,53 1.891,54 1.948,55 2.221,56 0.84,57 1.172,58 2.565,59 0.824,60 0.635,61 0.899,62 0.007,63 0.135,64 0.693,65 0.067,66 0.038,67 0.283,68 0.451,69 1.409,70 5.2}
{0 CHEMBL1995448,1 17.853,2 29.817,3 0.05,4 -0.102,5 0.184,7 3.576,8 3.576,9 5.435,10 1,11 1.613,12 8.556,13 1.069,14 1.144,15 70.581,16 7.434,17 0.632,18 3.606,19 3.752,20 3.15,21 3.04,22 4.8,23 3.05,24 4.051,25 4.232,26 3.426,27 3.343,28 5.236,29 3.324,30 4.241,31 4.474,32 3.362,33 3.382,34 5.307,35 3.339,36 4.126,37 4.353,38 3.229,39 3.321,40 5.154,41 3.242,42 4.101,43 4.335,44 3.154,45 3.324,46 5.1,47 3.235,48 4.106,49 4.357,50 3.131,51 3.271,52 5.128,53 3.17,54 4.031,55 4.302,56 2.928,57 3.074,58 5.039,59 2.971,60 3.819,61 4.105,62 2.634,63 2.786,64 4.84,65 2.669,66 0.07,67 0.513,68 7.021,69 2.291,70 5.2}
{0 CHEMBL1995592,1 24.808,2 41.709,3 0.11,4 0.032,5 0.548,7 3.904,8 3.904,11 1.773,12 7.462,13 3.947,14 15.581,15 101.914,16 9.195,17 0.621,18 3.839,19 3.946,20 3.566,21 3.412,22 5.121,23 3.424,24 4.292,25 4.422,26 4.009,27 3.82,28 5.594,29 3.82,30 4.549,31 4.684,32 4.153,33 3.983,34 5.83,35 3.987,36 4.663,37 4.822,38 4.205,39 4.025,40 6.053,41 4.015,42 4.71,43 4.877,44 4.165,45 4.089,46 5.963,47 4.057,48 4.729,49 4.91,50 4.219,51 4.088,52 6.042,53 4.035,54 4.708,55 4.901,56 4.012,57 3.933,58 6.017,59 3.845,60 4.561,61 4.812,62 3.533,63 3.477,64 5.844,65 3.337,66 0.141,67 0.626,68 5.473,69 2.974,70 5.2}
{0 CHEMBL1995736,1 15.139,2 20.332,3 0.035,4 -0.092,5 0.316,7 3.787,8 3.787,9 5.124,10 1,11 1.532,12 11.423,13 2.718,14 7.386,15 100.802,16 7.301,17 0.552,18 3.978,19 4.104,20 3.533,21 3.506,22 5.056,23 3.491,24 4.523,25 4.696,26 3.906,27 3.906,28 5.588,29 3.87,30 4.762,31 4.986,32 3.913,33 4.004,34 5.761,35 3.936,36 4.76,37 4.988,38 3.877,39 3.961,40 5.849,41 3.894,42 4.67,43 4.885,44 3.747,45 3.905,46 5.731,47 3.815,48 4.582,49 4.817,50 3.574,51 3.828,52 5.529,53 3.709,54 4.501,55 4.743,56 3.494,57 3.699,58 5.463,59 3.59,60 4.418,61 4.668,62 3.35,63 3.515,64 5.391,65 3.423,66 0.029,67 0.726,68 10.151,69 4.203,70 5.2}
{0 CHEMBL1995740,1 24.991,2 38.643,3 0.073,4 0.13,5 0.747,6 0.4,7 4.046,8 4.046,9 5.149,10 1,11 1.673,12 10.714,13 3.464,14 11.998,15 102.359,16 8.776,17 0.581,18 3.911,19 3.998,20 3.6,21 3.457,22 5.217,23 3.481,24 4.371,25 4.473,26 3.979,27 3.85,28 5.767,29 3.865,30 4.647,31 4.774,32 4.15,33 4.042,34 5.976,35 4.048,36 4.768,37 4.93,38 4.051,39 4.025,40 6.075,41 4.004,42 4.731,43 4.927,44 3.905,45 3.946,46 5.954,47 3.898,48 4.543,49 4.73,50 3.802,51 3.774,52 5.798,53 3.741,54 4.449,55 4.605,56 3.768,57 3.665,58 5.968,59 3.656,60 4.329,61 4.518,62 3.567,63 3.509,64 5.607,65 3.488,66 0.227,67 0.618,68 6.25,69 3.57,70 5.2}
{0 CHEMBL1995813,1 10.605,2 17.803,3 0.058,4 -0.102,5 0.308,7 3.682,8 3.682,11 1.439,12 9.348,13 2.132,14 4.545,15 90.541,16 7.173,17 0.615,18 3.875,19 4.021,20 3.42,21 3.398,22 4.924,23 3.379,24 4.419,25 4.607,26 3.778,27 3.822,28 5.407,29 3.766,30 4.721,31 4.978,32 3.788,33 3.924,34 5.61,35 3.83,36 4.715,37 4.993,38 3.662,39 3.842,40 5.603,41 3.737,42 4.601,43 4.885,44 3.589,45 3.718,46 5.541,47 3.62,48 4.419,49 4.677,50 3.507,51 3.607,52 5.392,53 3.531,54 4.302,55 4.541,56 3.313,57 3.558,58 5.227,59 3.444,60 4.262,61 4.516,62 3.165,63 3.494,64 5.062,65 3.35,66 0.048,67 0.712,68 9.431,69 3.425,70 6.3}
{0 CHEMBL1995832,1 16.552,2 20.843,3 -0.019,4 -0.217,5 0.65,7 3.946,8 3.946,9 5.312,10 1,11 1.76,12 10.844,13 4.027,14 16.213,15 115.705,16 8.157,17 0.629,18 4.113,19 4.229,20 3.743,21 3.588,22 5.337,23 3.61,24 4.63,25 4.802,26 4.132,27 3.969,28 5.842,29 3.984,30 4.847,31 5.025,32 4.241,33 4.121,34 6.086,35 4.113,36 5.046,37 5.295,38 4.233,39 4.117,40 6.304,41 4.103,42 4.853,43 5.062,44 4.22,45 4.121,46 6.003,47 4.112,48 4.897,49 5.088,50 4.295,51 4.16,52 6.213,53 4.157,54 4.915,55 5.101,56 4.239,57 4.13,58 6.218,59 4.116,60 4.912,61 5.135,62 4.04,63 4.012,64 6.158,65 3.958,66 0.164,67 0.971,68 9.486,69 4.525,70 5.2}
{0 CHEMBL1995927,1 18.446,2 26.298,3 -0.036,4 -0.304,5 0.344,7 3.626,8 3.626,9 5.195,10 1,11 1.681,12 7.632,13 3.335,14 11.125,15 79.229,16 7.8,17 0.55,18 3.677,19 3.809,20 3.274,21 3.15,22 4.764,23 3.133,24 4.194,25 4.399,26 3.618,27 3.476,28 5.239,29 3.441,30 4.347,31 4.575,32 3.784,33 3.571,34 5.438,35 3.535,36 4.279,37 4.477,38 3.703,39 3.559,40 5.374,41 3.506,42 4.332,43 4.55,44 3.562,45 3.551,46 5.381,47 3.465,48 4.317,49 4.564,50 3.366,51 3.497,52 5.237,53 3.371,54 4.282,55 4.54,56 3.157,57 3.431,58 5.106,59 3.234,60 4.202,61 4.49,62 2.869,63 3.199,64 4.986,65 2.96,66 0.041,67 0.529,68 7.399,69 2.923,70 5.2}
{0 CHEMBL1996066,1 10.767,2 8.38,3 0.056,4 -0.043,5 0.18,7 3.944,8 3.944,11 1.583,12 9.217,13 3.746,14 14.033,15 90.944,16 9.335,17 0.808,18 3.67,19 3.771,20 3.49,21 3.361,22 4.93,23 3.331,24 4.109,25 4.227,26 3.878,27 3.729,28 5.31,29 3.688,30 4.285,31 4.456,32 3.855,33 3.778,34 5.452,35 3.719,36 4.307,37 4.484,38 3.941,39 3.777,40 5.525,41 3.69,42 4.208,43 4.383,44 3.773,45 3.684,46 5.412,47 3.579,48 4.078,49 4.271,50 3.547,51 3.522,52 5.267,53 3.407,54 3.883,55 4.069,56 3.355,57 3.336,58 5.187,59 3.265,60 3.837,61 4.026,62 3.104,63 3.25,64 5.071,65 3.179,66 0.035,67 0.525,68 4.296,69 2.472,70 5.2}
{0 CHEMBL1996111,1 13.355,2 19.165,3 -0.007,4 0.041,5 0.288,7 4.191,8 4.191,11 1.567,12 9.154,13 2.892,14 8.364,15 102.149,16 7.873,17 0.724,18 3.907,19 4.036,20 3.534,21 3.445,22 5.078,23 3.44,24 4.4,25 4.579,26 3.877,27 3.826,28 5.488,29 3.811,30 4.559,31 4.735,32 3.903,33 3.929,34 5.682,35 3.879,36 4.723,37 4.954,38 3.912,39 3.874,40 5.879,41 3.836,42 4.554,43 4.763,44 3.893,45 3.819,46 5.693,47 3.812,48 4.62,49 4.82,50 3.876,51 3.882,52 5.794,53 3.85,54 4.638,55 4.861,56 3.795,57 3.875,58 5.748,59 3.805,60 4.6,61 4.827,62 3.578,63 3.835,64 5.668,65 3.71,66 0.096,67 0.724,68 8.079,69 3.584,70 5.2}
{0 CHEMBL1996155,1 17.429,2 22.051,3 -0.034,4 -0.277,5 0.283,7 3.44,8 3.44,9 5.859,10 1,11 1.428,12 10.143,13 1.992,14 3.966,15 83.131,16 6.748,17 0.522,18 3.819,19 3.948,20 3.318,21 3.342,22 4.817,23 3.306,24 4.355,25 4.558,26 3.544,27 3.68,28 5.25,29 3.611,30 4.546,31 4.772,32 3.501,33 3.781,34 5.384,35 3.654,36 4.583,37 4.853,38 3.32,39 3.697,40 5.322,41 3.532,42 4.516,43 4.804,44 3.289,45 3.586,46 5.275,47 3.454,48 4.244,49 4.458,50 3.332,51 3.551,52 5.15,53 3.448,54 4.323,55 4.572,56 3.278,57 3.523,58 5.191,59 3.397,60 4.293,61 4.582,62 3.037,63 3.352,64 5.09,65 3.211,66 0.03,67 0.614,68 9.613,69 3.889,70 5.2}
{0 CHEMBL1996208,1 22.743,2 30.262,3 -0.034,4 -0.247,5 0.46,7 3.444,8 3.444,9 11.027,10 2,11 1.646,12 10.174,13 1.491,14 2.223,15 89.676,16 7.358,17 0.48,18 3.882,19 4.018,20 3.437,21 3.283,22 4.989,23 3.299,24 4.416,25 4.606,26 3.723,27 3.623,28 5.476,29 3.613,30 4.596,31 4.83,32 3.701,33 3.724,34 5.544,35 3.674,36 4.546,37 4.783,38 3.619,39 3.675,40 5.521,41 3.597,42 4.557,43 4.805,44 3.613,45 3.611,46 5.538,47 3.55,48 4.482,49 4.708,50 3.547,51 3.5,52 5.484,53 3.479,54 4.434,55 4.677,56 3.439,57 3.469,58 5.469,59 3.413,60 4.442,61 4.739,62 3.265,63 3.471,64 5.314,65 3.339,66 0.095,67 0.662,68 9.425,69 3.218,70 5.2}
{0 CHEMBL1996234,1 11.248,2 11.545,3 0.064,4 -0.039,5 0.288,7 4.384,8 4.384,11 1.457,12 11.594,13 4.182,14 17.489,15 123.98,16 7.664,17 0.73,18 4.13,19 4.246,20 3.737,21 3.737,22 5.243,23 3.717,24 4.636,25 4.787,26 4.136,27 4.145,28 5.717,29 4.111,30 4.912,31 5.101,32 4.174,33 4.273,34 5.965,35 4.21,36 4.968,37 5.209,38 4.134,39 4.252,40 5.948,41 4.176,42 4.857,43 5.063,44 4.097,45 4.231,46 5.873,47 4.151,48 4.871,49 5.077,50 4.101,51 4.228,52 5.902,53 4.156,54 4.918,55 5.142,56 4.006,57 4.213,58 5.919,59 4.109,60 4.861,61 5.107,62 3.917,63 4.086,64 5.888,65 3.982,66 0.048,67 0.822,68 10.547,69 4.718,70 5.2}
{0 CHEMBL1996390,1 2.278,2 1.651,3 0.077,4 0.06,5 0.117,7 3.632,8 3.632,11 1.65,12 7,13 2.955,14 8.734,15 70.958,16 9.456,17 0.8,18 3.431,19 3.495,20 3.263,21 3.164,22 4.699,23 3.119,24 3.858,25 3.939,26 3.661,27 3.559,28 5.227,29 3.483,30 4.039,31 4.162,32 3.695,33 3.593,34 5.234,35 3.507,36 4.021,37 4.17,38 3.486,39 3.487,40 5.21,41 3.404,42 3.94,43 4.115,44 3.376,45 3.374,46 5.114,47 3.283,48 3.869,49 4.024,50 3.272,51 3.211,52 5.247,53 3.113,54 3.574,55 3.772,56 2.708,57 2.795,58 4.815,59 2.659,60 3.155,61 3.335,62 2.154,63 2.126,64 4.617,65 2.085,66 0.047,67 0.309,68 3.407,69 2.258,70 5.2}
{0 CHEMBL1996500,1 15.053,2 17.95,3 -0.003,4 -0.193,5 0.527,7 3.942,8 3.942,11 1.72,12 10.067,13 3.455,14 11.935,15 108.951,16 8.209,17 0.667,18 4.036,19 4.156,20 3.673,21 3.54,22 5.258,23 3.555,24 4.546,25 4.72,26 4.09,27 3.914,28 5.8,29 3.93,30 4.794,31 4.975,32 4.14,33 4.039,34 6.074,35 4.035,36 4.883,37 5.135,38 4.133,39 4.038,40 6.139,41 4.018,42 4.729,43 4.922,44 4.148,45 4.053,46 5.944,47 4.037,48 4.79,49 4.983,50 4.203,51 4.092,52 6.094,53 4.086,54 4.848,55 5.043,56 4.119,57 4.082,58 6.132,59 4.047,60 4.852,61 5.102,62 3.869,63 3.909,64 6.072,65 3.827,66 0.133,67 0.931,68 8.556,69 4.147,70 5.2}
{0 CHEMBL1996543,1 10.219,2 8.602,3 0.062,4 0.028,5 0.196,7 3.94,8 3.94,9 5.843,10 1,11 1.527,12 12.407,13 3.785,14 14.325,15 103.791,16 7.69,17 0.733,18 3.955,19 4.071,20 3.55,21 3.542,22 5.107,23 3.525,24 4.45,25 4.597,26 3.886,27 3.925,28 5.568,29 3.888,30 4.713,31 4.911,32 3.895,33 4.022,34 5.801,35 3.946,36 4.742,37 4.976,38 3.745,39 3.956,40 5.7,41 3.853,42 4.657,43 4.894,44 3.699,45 3.867,46 5.637,47 3.767,48 4.646,49 4.886,50 3.644,51 3.779,52 5.693,53 3.687,54 4.55,55 4.806,56 3.509,57 3.664,58 5.594,59 3.568,60 4.352,61 4.581,62 3.445,63 3.594,64 5.425,65 3.495,66 0.035,67 0.729,68 8.908,69 4.207,70 5.2}
{0 CHEMBL1996587,1 15.462,2 11.488,3 0.006,4 -0.066,5 0.665,7 4.389,8 4.389,11 1.72,12 10,13 3.881,14 15.064,15 108.614,16 8.209,17 0.618,18 4.055,19 4.174,20 3.704,21 3.57,22 5.237,23 3.582,24 4.604,25 4.773,26 4.138,27 3.997,28 5.754,29 4.003,30 4.857,31 5.056,32 4.214,33 4.105,34 6.052,35 4.095,36 4.966,37 5.207,38 4.214,39 4.079,40 6.263,41 4.073,42 4.799,43 5.003,44 4.145,45 4.072,46 5.985,47 4.059,48 4.782,49 4.96,50 4.141,51 4.118,52 5.979,53 4.081,54 4.913,55 5.139,56 4.074,57 4.088,58 6.054,59 4.03,60 4.823,61 5.072,62 3.948,63 3.946,64 5.938,65 3.894,66 0.155,67 0.952,68 8.665,69 4.409,70 5.2}
{0 CHEMBL1996780,1 19.644,2 26.508,3 0.017,4 -0.102,5 0.364,7 3.888,8 3.888,9 5.092,10 1,11 1.514,12 9.8,13 3.912,14 15.3,15 113.514,16 8.009,17 0.545,18 4.018,19 4.109,20 3.643,21 3.606,22 5.23,23 3.599,24 4.506,25 4.64,26 4.011,27 3.98,28 5.719,29 3.964,30 4.738,31 4.888,32 4.146,33 4.139,34 5.941,35 4.117,36 4.834,37 4.987,38 4.167,39 4.181,40 6.173,41 4.142,42 4.865,43 5.034,44 4.126,45 4.224,46 6.026,47 4.165,48 4.904,49 5.092,50 4.156,51 4.207,52 6.076,53 4.16,54 4.889,55 5.054,56 4.11,57 4.149,58 6.164,59 4.112,60 4.838,61 5.009,62 3.908,63 4.046,64 6.077,65 3.98,66 0.057,67 0.653,68 8.569,69 4.527,70 5.2}
{0 CHEMBL1996791,1 13.404,2 12.222,3 0.038,4 -0.058,5 0.323,7 3.233,8 3.233,11 1.782,12 7.111,13 1.48,14 2.189,15 78.385,16 11.225,17 0.5,18 3.604,19 3.737,20 3.521,21 3.166,22 4.698,23 3.11,24 4.16,25 4.339,26 4.037,27 3.601,28 5.2,29 3.518,30 4.463,31 4.697,32 4.212,33 3.755,34 5.434,35 3.616,36 4.476,37 4.737,38 4.337,39 3.704,40 5.493,41 3.533,42 4.267,43 4.532,44 4.007,45 3.654,46 5.133,47 3.375,48 3.965,49 4.166,50 3.781,51 3.494,52 4.995,53 3.201,54 3.89,55 4.134,56 3.348,57 3.181,58 4.976,59 2.898,60 3.617,61 3.925,62 3.122,63 2.565,64 4.649,65 2.351,66 0.088,67 0.537,68 2.213,69 2.865,70 5.2}
{0 CHEMBL1996817,1 5.392,2 5.814,3 -0.003,4 -0.166,5 0.19,7 3.528,8 3.528,9 5.809,10 1,11 1.473,12 8.35,13 3.774,14 14.243,15 79.58,16 7.226,17 0.727,18 3.708,19 3.83,20 3.262,21 3.258,22 4.782,23 3.234,24 4.221,25 4.397,26 3.565,27 3.619,28 5.241,29 3.567,30 4.4,31 4.624,32 3.578,33 3.669,34 5.312,35 3.597,36 4.361,37 4.573,38 3.571,39 3.607,40 5.366,41 3.55,42 4.332,43 4.547,44 3.455,45 3.575,46 5.292,47 3.505,48 4.292,49 4.515,50 3.36,51 3.52,52 5.261,53 3.438,54 4.232,55 4.479,56 3.087,57 3.418,58 5.116,59 3.288,60 4.107,61 4.382,62 2.696,63 3.255,64 4.869,65 3.056,66 0.021,67 0.542,68 7.744,69 3.295,70 5.2}
{0 CHEMBL1996831,1 12.324,2 12.223,3 0.077,4 0.054,5 0.312,7 3.819,8 3.819,11 1.391,12 7.048,13 4.551,14 20.715,15 80.928,16 7.352,17 0.458,18 3.745,19 3.846,20 3.313,21 3.382,22 4.802,23 3.345,24 4.31,25 4.462,26 3.712,27 3.83,28 5.415,29 3.763,30 4.575,31 4.788,32 3.743,33 3.926,34 5.501,35 3.832,36 4.535,37 4.726,38 3.806,39 3.89,40 5.596,41 3.832,42 4.627,43 4.811,44 3.744,45 3.869,46 5.825,47 3.794,48 4.564,49 4.809,50 3.31,51 3.699,52 5.533,53 3.552,54 4.269,55 4.526,56 3.031,57 3.426,58 5.119,59 3.262,60 4.084,61 4.312,62 2.756,63 3.128,64 5.147,65 2.984,66 0.027,67 0.491,68 7.655,69 3.778,70 5.2}
{0 CHEMBL1996923,1 2.167,2 0.907,3 0.105,4 0.455,5 0.138,7 3.33,8 3.33,11 1.877,12 4.273,13 2.719,14 7.39,15 43.99,16 13.43,17 0.833,18 2.863,19 2.954,20 2.903,21 2.526,22 4.176,23 2.532,24 3.27,25 3.366,26 3.321,27 2.896,28 4.625,29 2.887,30 3.327,31 3.428,32 3.488,33 2.887,34 4.735,35 2.813,36 3.074,37 3.23,38 2.98,39 2.393,40 4.442,41 2.332,42 2.435,43 2.62,44 2.706,45 1.666,46 3.962,47 1.618,48 1.219,49 1.33,50 0.403,51 0.664,52 2.222,53 0.454,66 0.104,67 0.232,68 0.828,69 0.733,70 5.2}
{0 CHEMBL1996931,1 10.237,2 9.091,3 0.047,4 0.013,5 0.357,7 3.621,8 3.621,11 1.56,12 12.192,13 3.464,14 12.001,15 102.649,16 8.153,17 0.643,18 3.89,19 3.994,20 3.524,21 3.512,22 5.058,23 3.479,24 4.371,25 4.512,26 3.856,27 3.886,28 5.512,29 3.823,30 4.658,31 4.852,32 3.903,33 4.015,34 5.742,35 3.917,36 4.703,37 4.917,38 3.769,39 3.94,40 5.789,41 3.832,42 4.659,43 4.879,44 3.737,45 3.868,46 5.84,47 3.771,48 4.596,49 4.819,50 3.657,51 3.803,52 5.697,53 3.695,54 4.501,55 4.725,56 3.64,57 3.665,58 5.682,59 3.575,60 4.294,61 4.486,62 3.539,63 3.535,64 5.555,65 3.452,66 0.037,67 0.583,68 7.868,69 3.985,70 5.2}
{0 CHEMBL1996979,1 10.775,2 13.651,3 0.056,4 -0.015,5 0.523,7 4.101,8 4.101,11 1.662,12 10.192,13 3.746,14 14.036,15 93.764,16 8.958,17 0.759,18 3.801,19 3.901,20 3.515,21 3.418,22 5.089,23 3.429,24 4.262,25 4.379,26 3.891,27 3.793,28 5.594,29 3.794,30 4.513,31 4.679,32 3.964,33 3.855,34 5.842,35 3.854,36 4.517,37 4.692,38 3.965,39 3.758,40 6.222,41 3.763,42 4.421,43 4.609,44 3.708,45 3.68,46 5.733,47 3.657,48 4.323,49 4.519,50 3.669,51 3.619,52 5.586,53 3.599,54 4.292,55 4.494,56 3.613,57 3.514,58 5.698,59 3.499,60 4.11,61 4.312,62 3.43,63 3.372,64 5.382,65 3.353,66 0.106,67 0.694,68 4.914,69 3.179,70 5.2}
{0 CHEMBL1997023,1 13.524,2 18.742,3 0.006,4 -0.259,5 0.398,7 3.516,8 3.516,11 1.906,12 6.5,13 1.075,14 1.156,15 69.577,16 9.149,17 0.526,18 3.499,19 3.594,20 3.286,21 3.027,22 4.788,23 3.022,24 3.954,25 4.107,26 3.635,27 3.393,28 5.342,29 3.367,30 4.09,31 4.213,32 3.624,33 3.488,34 5.636,35 3.427,36 4.23,37 4.439,38 3.512,39 3.467,40 5.347,41 3.389,42 4.181,43 4.386,44 3.549,45 3.402,46 5.4,47 3.327,48 4.173,49 4.359,50 3.417,51 3.335,52 5.509,53 3.24,54 3.963,55 4.121,56 3.167,57 2.878,58 5.549,59 2.873,60 3.538,61 3.734,62 2.578,63 2.083,64 5.133,65 2.074,66 0.129,67 0.458,68 4.781,69 2.418,70 5.2}
{0 CHEMBL1997025,1 13.796,2 13.159,3 0.088,4 0.031,5 0.426,7 3.98,8 3.98,11 1.609,12 10.12,13 2.701,14 7.296,15 93.722,16 7.691,17 0.571,18 3.9,19 4.028,20 3.488,21 3.46,22 5.033,23 3.447,24 4.436,25 4.6,26 3.874,27 3.884,28 5.581,29 3.846,30 4.734,31 4.951,32 3.937,33 4.01,34 5.805,35 3.945,36 4.761,37 4.997,38 3.915,39 3.944,40 5.949,41 3.876,42 4.674,43 4.921,44 3.752,45 3.813,46 5.829,47 3.745,48 4.476,49 4.709,50 3.547,51 3.66,52 5.638,53 3.583,54 4.308,55 4.528,56 3.506,57 3.494,58 5.547,59 3.453,60 4.248,61 4.477,62 3.353,63 3.349,64 5.693,65 3.297,66 0.061,67 0.745,68 8.54,69 3.839,70 5.2}
{0 CHEMBL1997129,1 7.745,2 6.909,3 0.053,4 -0.009,5 0.172,7 3.712,8 3.712,11 1.439,12 10.292,13 3.285,14 10.794,15 95.215,16 7.693,17 0.63,18 3.82,19 3.935,20 3.427,21 3.447,22 4.942,23 3.421,24 4.312,25 4.459,26 3.768,27 3.832,28 5.417,29 3.784,30 4.56,31 4.766,32 3.752,33 3.913,34 5.59,35 3.831,36 4.53,37 4.748,38 3.608,39 3.81,40 5.579,41 3.709,42 4.402,43 4.637,44 3.465,45 3.689,46 5.373,47 3.581,48 4.255,49 4.462,50 3.489,51 3.627,52 5.309,53 3.55,54 4.286,55 4.499,56 3.403,57 3.596,58 5.326,59 3.503,60 4.222,61 4.463,62 3.256,63 3.46,64 5.265,65 3.348,66 0.028,67 0.579,68 7.553,69 3.468,70 6.6}
{0 CHEMBL1997340,1 8.524,2 8.387,3 0.037,4 0.033,5 0.482,7 3.936,8 3.936,11 1.676,12 9.478,13 1.531,14 2.342,15 84.034,16 8.009,17 0.577,18 3.815,19 3.922,20 3.444,21 3.315,22 4.977,23 3.328,24 4.346,25 4.498,26 3.811,27 3.728,28 5.45,29 3.724,30 4.604,31 4.804,32 3.791,33 3.805,34 5.72,35 3.757,36 4.622,37 4.847,38 3.696,39 3.688,40 5.764,41 3.646,42 4.375,43 4.581,44 3.543,45 3.493,46 5.614,47 3.469,48 4.23,49 4.41,50 3.479,51 3.34,52 5.476,53 3.345,54 4.071,55 4.252,56 3.306,57 3.192,58 5.324,59 3.196,60 3.875,61 4.056,62 3.045,63 3.145,64 4.94,65 3.085,66 0.154,67 0.611,68 7.307,69 3.387,70 5.2}
{0 CHEMBL1997349,1 21.636,2 23.787,3 0.015,4 -0.058,5 0.681,7 4.347,8 4.347,11 1.746,12 11.576,13 5.971,14 35.655,15 125.911,16 9.924,17 0.568,18 4.015,19 4.101,20 3.822,21 3.661,22 5.292,23 3.661,24 4.496,25 4.615,26 4.271,27 4.068,28 5.731,29 4.061,30 4.724,31 4.847,32 4.491,33 4.218,34 6.072,35 4.21,36 4.83,37 4.977,38 4.359,39 4.216,40 6.192,41 4.2,42 4.82,43 4.976,44 4.301,45 4.168,46 6.189,47 4.158,48 4.789,49 4.926,50 4.366,51 4.175,52 6.297,53 4.144,54 4.811,55 4.995,56 4.177,57 4.104,58 6.1,59 4.04,60 4.719,61 4.937,62 4.041,63 3.979,64 6.01,65 3.894,66 0.136,67 0.682,68 4.436,69 3.469,70 5.2}
{0 CHEMBL1997503,1 20.677,2 31.167,3 0.027,4 -0.018,5 0.634,7 3.849,8 3.849,9 5.655,10 1,11 1.657,12 14.581,13 4.89,14 23.908,15 116.864,16 8.035,17 0.5,18 4.116,19 4.217,20 3.739,21 3.656,22 5.253,23 3.642,24 4.654,25 4.803,26 4.133,27 4.055,28 5.81,29 4.019,30 4.94,31 5.14,32 4.16,33 4.147,34 5.987,35 4.079,36 4.941,37 5.167,38 4.102,39 4.087,40 6.003,41 4.021,42 4.804,43 4.997,44 4.066,45 4.053,46 5.93,47 3.968,48 4.745,49 4.961,50 3.858,51 3.978,52 5.767,53 3.849,54 4.566,55 4.8,56 3.718,57 3.786,58 5.571,59 3.695,60 4.455,61 4.635,62 3.775,63 3.703,64 5.639,65 3.659,66 0.132,67 0.763,68 10.353,69 5.153,70 5.2}
{0 CHEMBL1997534,1 17.871,2 20.996,3 0.046,4 0.091,5 0.268,7 4.111,8 4.111,9 5.278,10 1,11 1.569,12 11.793,13 5.159,14 26.61,15 118.525,16 7.799,17 0.656,18 4.045,19 4.155,20 3.697,21 3.664,22 5.153,23 3.612,24 4.555,25 4.716,26 4.092,27 4.061,28 5.609,29 3.988,30 4.722,31 4.886,32 4.167,33 4.173,34 5.785,35 4.079,36 4.856,37 5.049,38 4.051,39 4.207,40 5.872,41 4.073,42 4.842,43 5.059,44 4.001,45 4.146,46 5.84,47 4.001,48 4.787,49 4.991,50 4.004,51 4.081,52 5.832,53 3.945,54 4.709,55 4.927,56 3.858,57 3.988,58 5.76,59 3.853,60 4.635,61 4.869,62 3.676,63 3.865,64 5.603,65 3.728,66 0.052,67 0.737,68 10.579,69 4.982,70 5.2}
{0 CHEMBL1997597,1 8.618,2 5.975,3 0.097,4 0.137,5 0.256,7 4.485,8 4.485,11 1.758,12 9.5,13 2.517,14 6.335,15 89.807,16 8.327,17 0.667,18 3.757,19 3.869,20 3.593,21 3.353,22 4.875,23 3.309,24 4.258,25 4.395,26 3.839,27 3.728,28 5.625,29 3.672,30 4.487,31 4.67,32 3.804,33 3.813,34 5.69,35 3.734,36 4.494,37 4.697,38 3.654,39 3.757,40 5.676,41 3.653,42 4.39,43 4.614,44 3.484,45 3.639,46 5.504,47 3.519,48 4.247,49 4.468,50 3.332,51 3.478,52 5.332,53 3.364,54 4.126,55 4.385,56 3.225,57 3.292,58 5.125,59 3.157,60 3.943,61 4.195,62 3.128,63 3.097,64 5.045,65 2.967,66 0.133,67 0.622,68 9.678,69 3.578,70 5.2}
{0 CHEMBL1997617,1 28.063,2 34.175,3 0.006,4 -0.216,5 0.405,7 3.707,8 3.707,9 5.985,10 1,11 1.424,12 14.75,13 4.738,14 22.449,15 145.54,16 6.896,17 0.537,18 4.347,19 4.48,20 3.869,21 3.878,22 5.338,23 3.847,24 4.925,25 5.119,26 4.239,27 4.308,28 5.835,29 4.254,30 5.227,31 5.456,32 4.304,33 4.497,34 6.048,35 4.4,36 5.329,37 5.584,38 4.256,39 4.546,40 6.114,41 4.411,42 5.352,43 5.63,44 4.209,45 4.538,46 6.098,47 4.392,48 5.274,49 5.538,50 4.172,51 4.467,52 6.076,53 4.331,54 5.218,55 5.491,56 4.053,57 4.363,58 6.021,59 4.222,60 5.119,61 5.399,62 3.952,63 4.262,64 5.901,65 4.11,66 0.064,67 1.077,68 15.969,69 6.262,70 5.5}
{0 CHEMBL1997623,1 19.34,2 26.901,3 0.106,4 0.061,5 0.851,7 3.87,8 3.87,11 1.771,12 13.4,13 4.142,14 17.159,15 107.32,16 8.944,17 0.667,18 3.97,19 4.088,20 3.664,21 3.513,22 5.25,23 3.539,24 4.459,25 4.587,26 4.116,27 3.898,28 6.182,29 3.91,30 4.657,31 4.831,32 4.058,33 3.994,34 5.973,35 3.979,36 4.748,37 4.96,38 3.974,39 3.916,40 6.07,41 3.894,42 4.641,43 4.859,44 3.862,45 3.765,46 6.022,47 3.746,48 4.491,49 4.716,50 3.691,51 3.64,52 5.757,53 3.622,54 4.322,55 4.5,56 3.749,57 3.571,58 6.031,59 3.56,60 4.307,61 4.52,62 3.529,63 3.542,64 5.554,65 3.497,66 0.215,67 0.936,68 6.34,69 3.761,70 5.2}
{0 CHEMBL1997759,1 11.833,2 17.048,3 -0.002,4 -0.073,5 0.281,7 3.727,8 3.727,9 5.182,10 1,11 1.572,12 10.692,13 3.061,14 9.368,15 98.186,16 8.2,17 0.759,18 3.864,19 3.97,20 3.523,21 3.436,22 5.069,23 3.44,24 4.331,25 4.468,26 3.86,27 3.787,28 5.515,29 3.781,30 4.509,31 4.678,32 3.909,33 3.87,34 5.666,35 3.85,36 4.549,37 4.734,38 3.896,39 3.849,40 5.801,41 3.816,42 4.543,43 4.748,44 3.771,45 3.813,46 5.685,47 3.767,48 4.458,49 4.656,50 3.705,51 3.72,52 5.669,53 3.676,54 4.352,55 4.576,56 3.536,57 3.556,58 5.488,59 3.513,60 4.165,61 4.345,62 3.406,63 3.391,64 5.414,65 3.36,66 0.06,67 0.625,68 6.876,69 3.444,70 5.2}
{0 CHEMBL1997764,1 11.833,2 15.343,3 0.034,4 -0.049,5 0.273,7 3.775,8 3.775,9 5.117,10 1,11 1.508,12 11.462,13 3.319,14 11.016,15 99.795,16 7.986,17 0.759,18 3.876,19 3.982,20 3.51,21 3.475,22 5.059,23 3.467,24 4.345,25 4.479,26 3.846,27 3.845,28 5.508,29 3.82,30 4.537,31 4.705,32 3.879,33 3.932,34 5.676,35 3.884,36 4.569,37 4.759,38 3.776,39 3.88,40 5.707,41 3.816,42 4.549,43 4.767,44 3.695,45 3.803,46 5.657,47 3.727,48 4.424,49 4.642,50 3.628,51 3.705,52 5.531,53 3.635,54 4.318,55 4.527,56 3.532,57 3.589,58 5.466,59 3.531,60 4.229,61 4.437,62 3.37,63 3.47,64 5.378,65 3.414,66 0.029,67 0.599,68 7.426,69 3.604,70 5.2}
{0 CHEMBL1997822,1 8.74,2 6.455,3 0.099,4 0.104,5 0.197,7 4.655,8 4.655,11 1.666,12 10.767,13 4.336,14 18.797,15 124.154,16 8.849,17 0.765,18 4.013,19 4.1,20 3.897,21 3.738,22 5.119,23 3.665,24 4.52,25 4.635,26 4.221,27 4.148,28 5.805,29 4.073,30 4.732,31 4.87,32 4.261,33 4.267,34 5.919,35 4.174,36 4.824,37 4.993,38 4.297,39 4.3,40 5.937,41 4.177,42 4.791,43 4.975,44 4.171,45 4.248,46 5.852,47 4.102,48 4.712,49 4.896,50 4.201,51 4.164,52 5.805,53 4.028,54 4.663,55 4.844,56 4.181,57 4.067,58 5.865,59 3.952,60 4.581,61 4.775,62 3.888,63 3.937,64 5.715,65 3.816,66 0.084,67 0.689,68 10.087,69 4.769,70 5.2}
{0 CHEMBL1997846,1 11.088,2 19.407,3 0.024,4 -0.166,5 0.242,7 3.816,8 3.816,11 1.549,12 9.217,13 3.953,14 15.629,15 91.288,16 7.996,17 0.615,18 3.831,19 3.961,20 3.471,21 3.403,22 4.864,23 3.377,24 4.385,25 4.563,26 3.861,27 3.816,28 5.405,29 3.758,30 4.668,31 4.919,32 3.834,33 3.902,34 5.539,35 3.801,36 4.606,37 4.872,38 3.817,39 3.793,40 5.538,41 3.694,42 4.452,43 4.698,44 3.729,45 3.718,46 5.415,47 3.624,48 4.357,49 4.561,50 3.826,51 3.709,52 5.39,53 3.618,54 4.337,55 4.546,56 3.648,57 3.65,58 5.352,59 3.522,60 4.2,61 4.419,62 3.335,63 3.501,64 5.105,65 3.354,66 0.02,67 0.652,68 7.805,69 3.4,70 5.4}
{0 CHEMBL1997872,1 8.912,2 9.739,3 0.004,4 -0.182,5 0.309,7 3.888,8 3.888,9 5.307,10 1,11 1.539,12 9.348,13 1.652,14 2.73,15 87.525,16 7.684,17 0.615,18 3.812,19 3.923,20 3.421,21 3.37,22 4.903,23 3.363,24 4.353,25 4.51,26 3.765,27 3.767,28 5.412,29 3.74,30 4.566,31 4.763,32 3.772,33 3.872,34 5.603,35 3.807,36 4.553,37 4.763,38 3.637,39 3.803,40 5.633,41 3.722,42 4.458,43 4.67,44 3.565,45 3.717,46 5.56,47 3.632,48 4.359,49 4.568,50 3.491,51 3.665,52 5.361,53 3.572,54 4.372,55 4.606,56 3.37,57 3.553,58 5.367,59 3.452,60 4.164,61 4.394,62 3.188,63 3.356,64 5.104,65 3.253,66 0.021,67 0.591,68 7.646,69 3.517,70 5.2}
{0 CHEMBL1998112,1 19.544,2 28.736,3 0.006,4 -0.177,5 0.589,6 0.4,7 3.963,8 3.963,9 10.703,10 2,11 1.641,12 10.241,13 2.934,14 8.608,15 106.952,16 8.114,17 0.688,18 4,19 4.11,20 3.637,21 3.506,22 5.222,23 3.525,24 4.473,25 4.62,26 3.988,27 3.864,28 5.69,29 3.872,30 4.623,31 4.777,32 4.069,33 3.983,34 5.816,35 3.981,36 4.717,37 4.885,38 4.067,39 4.009,40 5.932,41 3.988,42 4.813,43 5.025,44 3.972,45 4.009,46 5.914,47 3.964,48 4.74,49 4.955,50 4,51 4.006,52 5.853,53 3.958,54 4.722,55 4.93,56 3.979,57 3.997,58 5.836,59 3.951,60 4.66,61 4.856,62 3.861,63 3.885,64 5.867,65 3.826,66 0.094,67 0.733,68 8.389,69 3.849,70 5.2}
{0 CHEMBL1998121,1 15.022,2 19.461,3 0.085,4 0.199,5 0.496,7 3.913,8 3.913,11 1.735,12 9.417,13 3.026,14 9.154,15 96.248,16 9.082,17 0.615,18 3.799,19 3.919,20 3.521,21 3.4,22 4.976,23 3.375,24 4.288,25 4.433,26 3.91,27 3.806,28 5.431,29 3.751,30 4.567,31 4.757,32 4.084,33 3.934,34 5.703,35 3.843,36 4.595,37 4.809,38 3.85,39 3.84,40 5.725,41 3.752,42 4.556,43 4.766,44 3.808,45 3.767,46 5.794,47 3.684,48 4.522,49 4.729,50 3.868,51 3.772,52 5.742,53 3.679,54 4.45,55 4.655,56 3.83,57 3.742,58 5.688,59 3.619,60 4.338,61 4.559,62 3.602,63 3.638,64 5.402,65 3.493,66 0.101,67 0.592,68 5.96,69 3.171,70 5.3}
{0 CHEMBL1998159,1 15.472,2 15.035,3 0.044,4 0.001,5 0.602,7 3.866,8 3.866,9 5.74,10 1,11 1.733,12 12.903,13 3.432,14 11.781,15 110.539,16 8.382,17 0.647,18 4.057,19 4.174,20 3.705,21 3.578,22 5.267,23 3.593,24 4.589,25 4.742,26 4.137,27 3.955,28 6.177,29 3.963,30 4.774,31 4.956,32 4.102,33 4.067,34 6.008,35 4.036,36 4.902,37 5.139,38 4.002,39 4.018,40 6.067,41 3.968,42 4.748,43 4.964,44 3.949,45 3.932,46 5.941,47 3.888,48 4.782,49 5.017,50 3.852,51 3.876,52 5.942,53 3.831,54 4.685,55 4.915,56 3.857,57 3.781,58 6.001,59 3.747,60 4.636,61 4.87,62 3.717,63 3.683,64 5.989,65 3.638,66 0.177,67 0.991,68 8.327,69 4.55,70 6}
{0 CHEMBL1998193,1 20.284,2 26.661,3 -0.014,4 -0.248,5 0.558,6 0.247,7 3.476,8 3.476,11 1.592,12 15,13 0.965,14 0.931,15 97.856,16 7.13,17 0.444,18 3.985,19 4.132,20 3.489,21 3.433,22 5.108,23 3.421,24 4.491,25 4.691,26 3.733,27 3.765,28 5.624,29 3.7,30 4.757,31 5.023,32 3.666,33 3.832,34 5.725,35 3.728,36 4.715,37 4.991,38 3.581,39 3.709,40 5.727,41 3.614,42 4.635,43 4.893,44 3.554,45 3.632,46 5.783,47 3.555,48 4.563,49 4.823,50 3.413,51 3.613,52 5.567,53 3.509,54 4.544,55 4.817,56 3.28,57 3.598,58 5.464,59 3.463,60 4.478,61 4.751,62 3.223,63 3.551,64 5.362,65 3.408,66 0.056,67 0.761,68 10.849,69 3.773,70 5.2}
{0 CHEMBL1998414,1 11.772,2 8.296,3 0.063,4 0.15,5 0.255,7 3.614,8 3.614,11 1.796,12 10.286,13 3.409,14 11.623,15 87.35,16 9.138,17 0.652,18 3.669,19 3.776,20 3.461,21 3.329,22 4.801,23 3.271,24 4.166,25 4.312,26 3.877,27 3.723,28 5.285,29 3.636,30 4.339,31 4.519,32 3.847,33 3.731,34 5.438,35 3.618,36 4.332,37 4.547,38 3.489,39 3.578,40 5.369,41 3.427,42 4.164,43 4.391,44 3.342,45 3.404,46 5.213,47 3.249,48 3.978,49 4.173,50 3.327,51 3.286,52 5.152,53 3.174,54 3.95,55 4.132,56 3.287,57 3.235,58 5.182,59 3.133,60 3.782,61 3.957,62 3.198,63 3.226,64 4.844,65 3.08,66 0.065,67 0.52,68 5.417,69 3.059,70 5.2}
{0 CHEMBL1998435,1 7.215,2 11.409,3 0.043,4 -0.069,5 0.152,7 3.695,8 3.695,11 1.49,12 9.1,13 1.764,14 3.112,15 80.13,16 7.581,17 0.773,18 3.66,19 3.777,20 3.244,21 3.241,22 4.814,23 3.222,24 4.129,25 4.288,26 3.534,27 3.605,28 5.227,29 3.56,30 4.354,31 4.564,32 3.552,33 3.721,34 5.375,35 3.638,36 4.315,37 4.533,38 3.399,39 3.647,40 5.283,41 3.537,42 4.272,43 4.512,44 3.326,45 3.545,46 5.26,47 3.434,48 4.145,49 4.378,50 3.193,51 3.407,52 5.12,53 3.301,54 4.015,55 4.245,56 3.055,57 3.245,58 5.016,59 3.14,60 3.892,61 4.146,62 2.834,63 3,64 4.899,65 2.897,66 0.032,67 0.509,68 6.782,69 2.996,70 5.2}
{0 CHEMBL1998545,1 8.636,2 8.45,3 0.048,4 0.011,5 0.335,7 3.516,8 3.516,11 1.432,12 11.56,13 2.8,14 7.839,15 97.844,16 7.387,17 0.667,18 3.883,19 3.995,20 3.436,21 3.487,22 5.035,23 3.453,24 4.363,25 4.513,26 3.726,27 3.85,28 5.469,29 3.786,30 4.646,31 4.854,32 3.769,33 3.971,34 5.685,35 3.875,36 4.695,37 4.918,38 3.688,39 3.91,40 5.755,41 3.805,42 4.656,43 4.879,44 3.666,45 3.85,46 5.83,47 3.752,48 4.586,49 4.821,50 3.567,51 3.769,52 5.668,53 3.663,54 4.49,55 4.727,56 3.455,57 3.62,58 5.64,59 3.527,60 4.271,61 4.49,62 3.296,63 3.468,64 5.431,65 3.384,66 0.037,67 0.595,68 8.865,69 4.131,70 5.2}
{0 CHEMBL1998551,1 16.133,2 16.328,3 0.006,4 -0.068,5 0.535,7 4.388,8 4.388,11 1.746,12 9.345,13 3.55,14 12.6,15 104.045,16 8.435,17 0.636,18 4.003,19 4.12,20 3.674,21 3.519,22 5.202,23 3.538,24 4.547,25 4.709,26 4.126,27 3.934,28 5.761,29 3.956,30 4.802,31 4.995,32 4.163,33 4.017,34 6.067,35 4.022,36 4.817,37 5.049,38 4.166,39 3.985,40 6.166,41 3.993,42 4.673,43 4.858,44 4.075,45 3.996,46 5.856,47 3.99,48 4.724,49 4.899,50 4.102,51 4.053,52 5.948,53 4.024,54 4.856,55 5.082,56 4.033,57 4.021,58 6.017,59 3.969,60 4.752,61 4.998,62 3.909,63 3.854,64 5.932,65 3.817,66 0.168,67 0.914,68 7.637,69 4.068,70 5.2}
{0 CHEMBL1998585,1 19.296,2 24.778,3 0.095,4 -0.018,5 1.129,7 3.996,8 3.996,11 1.956,12 12.806,13 4.124,14 17.008,15 110.765,16 10.169,17 0.647,18 3.943,19 4.042,20 3.776,21 3.527,22 5.283,23 3.546,24 4.432,25 4.545,26 4.24,27 3.904,28 6.223,29 3.916,30 4.605,31 4.751,32 4.22,33 3.988,34 6.047,35 3.99,36 4.709,37 4.886,38 4.214,39 3.953,40 6.162,41 3.949,42 4.651,43 4.836,44 4.079,45 3.834,46 6.192,47 3.814,48 4.51,49 4.703,50 3.936,51 3.648,52 6.247,53 3.659,54 4.334,55 4.517,56 3.813,57 3.537,58 6.082,59 3.537,60 4.259,61 4.46,62 3.626,63 3.497,64 5.619,65 3.466,66 0.296,67 1.006,68 3.975,69 3.731,70 6.4}
{0 CHEMBL1998611,1 9.232,2 8.379,3 0.22,4 0.477,5 0.303,7 3.455,8 3.455,11 2.2,12 5.067,13 2.652,14 7.031,15 66.929,16 14.552,17 0.625,18 3.198,19 3.276,20 3.373,21 2.98,22 4.51,23 2.907,24 3.606,25 3.671,26 3.891,27 3.417,28 4.989,29 3.306,30 3.796,31 3.857,32 4.29,33 3.542,34 5.169,35 3.396,36 3.781,37 3.855,38 4.077,39 3.424,40 5.305,41 3.259,42 3.587,43 3.736,44 3.882,45 2.959,46 5.005,47 2.811,48 3.339,49 3.527,50 3.463,51 2.471,52 5.01,53 2.384,54 2.761,55 3.001,56 1.22,57 1.774,58 3.844,59 1.44,60 1.515,61 1.922,62 0.028,63 0.457,64 1.609,65 0.245,66 0.105,67 0.293,68 3.266,69 1.375,70 5.2}
{0 CHEMBL1998829,1 9.121,2 11.333,3 0.052,5 0.269,7 3.765,8 3.765,11 1.58,12 10.72,13 4,14 15.998,15 98.136,16 8.918,17 0.786,18 3.785,19 3.886,20 3.511,21 3.45,22 4.98,23 3.431,24 4.242,25 4.36,26 3.886,27 3.836,28 5.448,29 3.797,30 4.482,31 4.65,32 3.905,33 3.913,34 5.643,35 3.846,36 4.463,37 4.652,38 3.758,39 3.801,40 5.632,41 3.736,42 4.389,43 4.586,44 3.692,45 3.707,46 5.569,47 3.648,48 4.306,49 4.503,50 3.699,51 3.651,52 5.496,53 3.59,54 4.243,55 4.457,56 3.503,57 3.557,58 5.367,59 3.478,60 4.087,61 4.292,62 3.422,63 3.437,64 5.222,65 3.357,66 0.036,67 0.525,68 5.293,69 2.929,70 5.2}
{0 CHEMBL1999112,1 18.873,2 19.083,3 0.026,4 -0.056,5 0.924,6 1.248,7 3.704,8 3.704,9 5.222,10 1,11 1.791,12 8.759,13 2.179,14 4.747,15 105.915,16 9.306,17 0.313,18 3.932,19 4.003,20 3.716,21 3.511,22 5.223,23 3.518,24 4.423,25 4.521,26 4.132,27 3.898,28 5.687,29 3.89,30 4.595,31 4.721,32 4.217,33 4.002,34 5.83,35 3.983,36 4.674,37 4.768,38 4.442,39 4.089,40 6.154,41 4.099,42 4.77,43 4.859,44 4.477,45 4.142,46 6.314,47 4.145,48 4.772,49 4.88,50 4.358,51 4.067,52 6.444,53 4.064,54 4.742,55 4.909,56 3.902,57 3.944,58 6.002,59 3.89,60 4.613,61 4.785,62 3.723,63 3.774,64 5.939,65 3.722,66 0.166,67 0.619,68 5.724,69 3.922,70 5.2}
{0 CHEMBL1999126,1 19.468,2 21.615,3 0.018,4 -0.06,5 0.451,7 4.335,8 4.335,11 1.561,12 10.806,13 4.642,14 21.552,15 116.302,16 8.489,17 0.6,18 4.003,19 4.102,20 3.688,21 3.616,22 5.255,23 3.617,24 4.482,25 4.617,26 4.096,27 4.008,28 5.668,29 4.003,30 4.7,31 4.851,32 4.228,33 4.134,34 5.968,35 4.135,36 4.814,37 4.98,38 4.225,39 4.167,40 6.141,41 4.155,42 4.808,43 4.978,44 4.158,45 4.133,46 6.149,47 4.121,48 4.774,49 4.928,50 4.142,51 4.12,52 6.223,53 4.084,54 4.794,55 4.998,56 3.905,57 4.034,58 6.003,59 3.964,60 4.697,61 4.941,62 3.851,63 3.897,64 5.933,65 3.818,66 0.076,67 0.706,68 7.079,69 3.823,70 5.2}
{0 CHEMBL1999321,1 22.114,2 30.939,3 0.031,4 -0.047,5 0.268,7 3.676,8 3.676,9 5.781,10 1,11 1.538,12 14,13 2.579,14 6.652,15 112.669,16 8.03,17 0.563,18 3.979,19 4.081,20 3.61,21 3.57,22 5.169,23 3.563,24 4.433,25 4.57,26 3.9,27 3.88,28 5.61,29 3.859,30 4.679,31 4.87,32 3.908,33 3.94,34 5.898,35 3.886,36 4.635,37 4.843,38 3.742,39 3.883,40 5.697,41 3.799,42 4.601,43 4.807,44 3.766,45 3.886,46 5.701,47 3.816,48 4.599,49 4.789,50 3.759,51 3.854,52 5.788,53 3.797,54 4.533,55 4.731,56 3.66,57 3.754,58 5.754,59 3.686,60 4.395,61 4.598,62 3.487,63 3.619,64 5.57,65 3.54,66 0.046,67 0.662,68 8.16,69 4.116,70 5.2}
{0 CHEMBL1999428,1 8.707,2 12.096,3 0.03,4 -0.023,5 0.203,7 3.569,8 3.569,11 1.37,12 10.783,13 3.367,14 11.336,15 91.545,16 7.376,17 0.72,18 3.786,19 3.901,20 3.351,21 3.423,22 4.921,23 3.382,24 4.26,25 4.415,26 3.654,27 3.78,28 5.359,29 3.714,30 4.519,31 4.722,32 3.688,33 3.896,34 5.551,35 3.801,36 4.554,37 4.767,38 3.582,39 3.833,40 5.631,41 3.721,42 4.548,43 4.792,44 3.467,45 3.755,46 5.583,47 3.63,48 4.393,49 4.642,50 3.333,51 3.619,52 5.395,53 3.491,54 4.201,55 4.436,56 3.231,57 3.455,58 5.271,59 3.347,60 4.052,61 4.271,62 3.085,63 3.323,64 5.134,65 3.217,66 0.028,67 0.534,68 7.877,69 3.654,70 5.2}
{0 CHEMBL1999496,1 21.736,2 33.345,3 0.046,4 0.001,5 0.168,7 3.562,8 3.562,11 1.332,12 8.962,13 4.052,14 16.422,15 103.679,16 7.135,17 0.621,18 3.948,19 4.065,20 3.492,21 3.589,22 5.022,23 3.54,24 4.442,25 4.607,26 3.808,27 3.96,28 5.451,29 3.885,30 4.689,31 4.871,32 3.893,33 4.117,34 5.672,35 4.022,36 4.827,37 5.05,38 3.866,39 4.152,40 5.759,41 4.03,42 4.838,43 5.055,44 3.952,45 4.167,46 5.854,47 4.064,48 4.88,49 5.093,50 3.881,51 4.158,52 5.93,53 4.039,54 4.864,55 5.125,56 3.757,57 4.068,58 5.814,59 3.927,60 4.718,61 4.969,62 3.504,63 3.929,64 5.684,65 3.778,66 0.038,67 0.632,68 9.823,69 4.505,70 5.2}
{0 CHEMBL1999556,1 2.824,2 2.351,3 0.1,4 0.154,5 0.081,7 3.632,8 3.632,11 1.646,12 7,13 2.353,14 5.538,15 72.78,16 9.083,17 0.8,18 3.456,19 3.547,20 3.26,21 3.184,22 4.687,23 3.13,24 3.888,25 3.993,26 3.654,27 3.581,28 5.145,29 3.495,30 4.071,31 4.205,32 3.685,33 3.62,34 5.239,35 3.523,36 4.047,37 4.209,38 3.485,39 3.529,40 5.183,41 3.427,42 3.986,43 4.179,44 3.371,45 3.416,46 5.095,47 3.308,48 3.894,49 4.072,50 3.258,51 3.262,52 5.184,53 3.142,54 3.664,55 3.895,56 2.704,57 2.885,58 4.796,59 2.72,60 3.242,61 3.475,62 2.132,63 2.278,64 4.545,65 2.169,66 0.027,67 0.37,68 4.067,69 2.272,70 5.2}
{0 CHEMBL1999590,1 13.843,2 13.388,3 -0.021,4 -0.067,5 0.311,7 3.628,8 3.628,11 1.578,12 10.885,13 4.298,14 18.469,15 102.142,16 8.2,17 0.759,18 3.871,19 3.99,20 3.534,21 3.41,22 5.078,23 3.419,24 4.319,25 4.474,26 3.849,27 3.737,28 5.489,29 3.738,30 4.456,31 4.655,32 3.773,33 3.755,34 5.55,35 3.722,36 4.444,37 4.663,38 3.77,39 3.731,40 5.509,41 3.695,42 4.439,43 4.647,44 3.784,45 3.763,46 5.544,47 3.732,48 4.463,49 4.663,50 3.725,51 3.782,52 5.559,53 3.724,54 4.491,55 4.73,56 3.587,57 3.689,58 5.499,59 3.609,60 4.36,61 4.62,62 3.381,63 3.481,64 5.369,65 3.399,66 0.083,67 0.683,68 7.009,69 3.279,70 5.2}
{0 CHEMBL1999714,1 17.388,2 29.596,3 0.068,4 0.038,5 0.181,7 3.781,8 3.781,11 1.468,12 6.294,13 2.821,14 7.958,15 66.782,16 7.734,17 0.632,18 3.483,19 3.599,20 3.093,21 3.102,22 4.625,23 3.081,24 3.959,25 4.103,26 3.461,27 3.483,28 5.098,29 3.444,30 4.25,31 4.42,32 3.606,33 3.645,34 5.381,35 3.598,36 4.315,37 4.537,38 3.441,39 3.536,40 5.46,41 3.464,42 4.149,43 4.38,44 3.149,45 3.357,46 5.253,47 3.265,48 3.817,49 4.05,50 2.709,51 3.044,52 4.88,53 2.914,54 3.582,55 3.844,56 2.083,57 2.698,58 4.5,59 2.495,60 2.93,61 3.21,62 1.397,63 2.115,64 3.62,65 1.873,66 0.021,67 0.411,68 5.343,69 2.436,70 5.2}
{0 CHEMBL1999718,1 19.502,2 24.828,3 0.03,4 -0.091,5 0.84,6 0.247,7 3.699,8 3.699,11 1.862,12 11.615,13 2.919,14 8.52,15 86.281,16 9.926,17 0.607,18 3.734,19 3.834,20 3.51,21 3.279,22 5.123,23 3.332,24 4.22,25 4.341,26 3.957,27 3.626,28 6.093,29 3.674,30 4.399,31 4.558,32 3.923,33 3.72,34 5.85,35 3.753,36 4.463,37 4.654,38 3.856,39 3.607,40 5.995,41 3.648,42 4.345,43 4.541,44 3.75,45 3.444,46 5.91,47 3.499,48 4.168,49 4.343,50 3.635,51 3.313,52 5.723,53 3.376,54 4.094,55 4.279,56 3.563,57 3.259,58 5.699,59 3.316,60 4.003,61 4.185,62 3.411,63 3.232,64 5.584,65 3.256,66 0.243,67 0.798,68 3,69 2.758,70 5.2}
{0 CHEMBL1999749,1 30.181,2 43.862,3 0.032,4 -0.095,5 0.497,6 0.4,7 3.929,8 3.929,9 11.629,10 2,11 1.454,12 17.902,13 5.979,14 35.744,15 160.496,16 7.462,17 0.617,18 4.403,19 4.51,20 3.987,21 3.984,22 5.48,23 3.964,24 4.925,25 5.08,26 4.319,27 4.375,28 5.939,29 4.333,30 5.168,31 5.357,32 4.367,33 4.501,34 6.126,35 4.423,36 5.23,37 5.46,38 4.293,39 4.472,40 6.15,41 4.376,42 5.189,43 5.411,44 4.283,45 4.476,46 6.132,47 4.382,48 5.151,49 5.366,50 4.273,51 4.477,52 6.084,53 4.378,54 5.154,55 5.384,56 4.223,57 4.409,58 6.094,59 4.31,60 5.059,61 5.287,62 4.134,63 4.309,64 6.009,65 4.217,66 0.043,67 1.021,68 14.716,69 6.762,70 5.2}
{0 CHEMBL1999774,1 16.708,2 19.487,3 0.064,4 -0.102,5 0.756,7 3.763,8 3.763,11 1.801,12 8.957,13 1.521,14 2.313,15 84.873,16 8.42,17 0.44,18 3.817,19 3.929,20 3.459,21 3.31,22 5.021,23 3.314,24 4.345,25 4.513,26 3.883,27 3.74,28 5.565,29 3.72,30 4.617,31 4.802,32 4.086,33 3.905,34 5.779,35 3.868,36 4.74,37 4.948,38 4.095,39 3.891,40 6.125,41 3.841,42 4.643,43 4.856,44 3.944,45 3.805,46 5.833,47 3.734,48 4.433,49 4.627,50 3.727,51 3.672,52 5.653,53 3.575,54 4.432,55 4.656,56 3.556,57 3.494,58 5.669,59 3.388,60 4.187,61 4.439,62 3.003,63 3.216,64 5.236,65 3.072,66 0.152,67 0.602,68 7.263,69 3.353,70 5.2}
{0 CHEMBL1999811,1 13.263,2 15.16,3 0.08,4 -0.042,5 0.537,7 3.909,8 3.909,11 1.919,12 10.522,13 2.185,14 4.773,15 86.831,16 9.687,17 0.64,18 3.69,19 3.782,20 3.514,21 3.221,22 5.039,23 3.246,24 4.074,25 4.184,26 3.8,27 3.567,28 5.467,29 3.568,30 4.291,31 4.442,32 3.789,33 3.589,34 5.666,35 3.58,36 4.301,37 4.49,38 3.735,39 3.469,40 5.698,41 3.434,42 4.129,43 4.326,44 3.436,45 3.219,46 5.501,47 3.2,48 3.928,49 4.106,50 3.483,51 3.042,52 5.425,53 3.088,54 3.819,55 3.993,56 3.277,57 3.011,58 5.36,59 3.006,60 3.704,61 3.869,62 3.088,63 3.01,64 4.989,65 2.986,66 0.202,67 0.57,68 4.937,69 2.509,70 5.2}
{0 CHEMBL1999918,1 5.614,2 3.628,3 0.104,4 0.07,5 0.516,7 4.108,8 4.108,11 2.059,12 7.762,13 3.513,14 12.338,15 80.835,16 13.186,17 0.696,18 3.495,19 3.562,20 3.573,21 3.234,22 4.869,23 3.205,24 3.938,25 4.012,26 4.056,27 3.647,28 5.387,29 3.599,30 4.157,31 4.239,32 4.305,33 3.704,34 5.824,35 3.67,36 4.128,37 4.243,38 4.061,39 3.584,40 5.629,41 3.554,42 4.063,43 4.222,44 3.779,45 3.448,46 5.536,47 3.417,48 3.984,49 4.116,50 3.934,51 3.345,52 5.629,53 3.321,54 3.762,55 3.924,56 3.807,57 3.074,58 5.257,59 3,60 3.36,61 3.504,62 3.807,63 2.712,64 5.278,65 2.591,66 0.165,67 0.507,68 1.759,69 2.023,70 5.2}
{0 CHEMBL1999931,1 15.901,2 24.25,3 0.041,4 0.17,5 0.33,7 3.879,8 3.879,11 1.531,12 12.933,13 4.233,14 17.918,15 116.156,16 8.218,17 0.794,18 4.003,19 4.122,20 3.667,21 3.599,22 5.195,23 3.593,24 4.468,25 4.61,26 4.008,27 3.981,28 5.626,29 3.957,30 4.685,31 4.876,32 3.986,33 4.037,34 5.79,35 3.983,36 4.723,37 4.947,38 3.926,39 3.936,40 5.842,41 3.889,42 4.608,43 4.826,44 3.901,45 3.841,46 5.786,47 3.822,48 4.51,49 4.71,50 3.863,51 3.829,52 5.665,53 3.802,54 4.501,55 4.713,56 3.793,57 3.818,58 5.618,59 3.769,60 4.408,61 4.61,62 3.63,63 3.777,64 5.495,65 3.699,66 0.104,67 0.765,68 7.871,69 3.792,70 6.8}
{0 CHEMBL2000071,1 8.984,2 14.205,3 0.044,4 -0.117,5 0.162,7 3.528,8 3.528,11 1.542,12 8.35,13 1.793,14 3.216,15 80.595,16 7.454,17 0.727,18 3.696,19 3.825,20 3.261,21 3.221,22 4.826,23 3.21,24 4.183,25 4.357,26 3.56,27 3.597,28 5.257,29 3.552,30 4.391,31 4.622,32 3.572,33 3.664,34 5.343,35 3.592,36 4.358,37 4.583,38 3.562,39 3.624,40 5.392,41 3.557,42 4.351,43 4.581,44 3.461,45 3.6,46 5.326,47 3.52,48 4.329,49 4.571,50 3.374,51 3.521,52 5.342,53 3.432,54 4.234,55 4.487,56 3.115,57 3.367,58 5.197,59 3.248,60 4.085,61 4.359,62 2.764,63 3.109,64 5.095,65 2.944,66 0.041,67 0.56,68 7.411,69 2.944,70 5.2}
{0 CHEMBL2000104,1 6.559,2 5.174,3 0.091,4 0.098,5 0.283,7 4.567,8 4.567,11 1.802,12 9.348,13 2.228,14 4.964,15 91.282,16 9.364,17 0.64,18 3.725,19 3.798,20 3.685,21 3.449,22 4.89,23 3.367,24 4.227,25 4.33,26 4.016,27 3.847,28 5.639,29 3.752,30 4.447,31 4.568,32 4.057,33 3.927,34 5.769,35 3.832,36 4.476,37 4.612,38 3.847,39 3.857,40 5.809,41 3.768,42 4.399,43 4.595,44 3.664,45 3.743,46 5.54,47 3.622,48 4.281,49 4.491,50 3.604,51 3.605,52 5.455,53 3.458,54 4.059,55 4.255,56 3.47,57 3.378,58 5.261,59 3.241,60 3.906,61 4.042,62 3.562,63 3.229,64 5.443,65 3.141,66 0.095,67 0.526,68 7.238,69 3.886,70 5.2}
{0 CHEMBL2000114,1 11.313,2 16.481,3 0.033,4 -0.188,5 0.207,7 2.895,8 2.895,11 1.756,12 7.125,13 0.817,14 0.667,15 68.365,16 7.945,17 0.588,18 3.513,19 3.644,20 3.188,21 3.025,22 4.625,23 2.977,24 4.007,25 4.197,26 3.446,27 3.377,28 5.048,29 3.288,30 4.127,31 4.353,32 3.504,33 3.399,34 5.095,35 3.304,36 4.112,37 4.331,38 3.482,39 3.348,40 5.171,41 3.255,42 4.103,43 4.354,44 3.14,45 3.29,46 5.001,47 3.133,48 4.004,49 4.266,50 2.91,51 3.14,52 4.95,53 2.969,54 3.821,55 4.071,56 2.693,57 2.945,58 4.736,59 2.749,60 3.691,61 3.984,62 2.49,63 2.557,64 4.758,65 2.348,66 0.06,67 0.487,68 6.762,69 2.641,70 5.2}
{0 CHEMBL2000271,1 13.036,2 13.685,3 0.053,4 0.106,5 0.212,7 3.816,8 3.816,9 6.029,10 1,11 1.43,12 11.893,13 3.278,14 10.747,15 112.035,16 7.164,17 0.71,18 4.041,19 4.168,20 3.581,21 3.615,22 5.13,23 3.581,24 4.548,25 4.717,26 3.899,27 4,28 5.542,29 3.943,30 4.789,31 4.994,32 3.926,33 4.119,34 5.727,35 4.023,36 4.893,37 5.143,38 3.809,39 4.083,40 5.784,41 3.958,42 4.8,43 5.046,44 3.782,45 4.024,46 5.675,47 3.907,48 4.763,49 4.99,50 3.783,51 3.985,52 5.721,53 3.879,54 4.763,55 5.027,56 3.676,57 3.901,58 5.703,59 3.782,60 4.596,61 4.856,62 3.547,63 3.789,64 5.498,65 3.664,66 0.076,67 0.758,68 11.032,69 4.711,70 5.3}
{0 CHEMBL2000335,1 18.168,2 24.827,3 0.076,4 0.028,5 0.314,7 3.875,8 3.875,11 1.628,12 12.536,13 3.949,14 15.592,15 114.657,16 8.288,17 0.71,18 3.959,19 4.078,20 3.659,21 3.585,22 5.137,23 3.546,24 4.425,25 4.577,26 4.035,27 3.967,28 5.596,29 3.906,30 4.612,31 4.775,32 4.052,33 4.076,34 5.731,35 4,36 4.736,37 4.94,38 4.036,39 4.068,40 5.845,41 3.955,42 4.739,43 4.987,44 3.81,45 3.921,46 5.804,47 3.794,48 4.462,49 4.689,50 3.651,51 3.7,52 5.591,53 3.62,54 4.344,55 4.562,56 3.515,57 3.609,58 5.443,59 3.526,60 4.289,61 4.514,62 3.436,63 3.57,64 5.354,65 3.456,66 0.044,67 0.724,68 8.553,69 3.962,70 5.2}
{0 CHEMBL2000345,1 12.47,2 10.169,3 0.037,4 -0.031,5 0.321,7 4.083,8 4.083,9 5.116,10 1,11 1.692,12 9.375,13 4.528,14 20.506,15 95.7,16 10.112,17 0.615,18 3.752,19 3.842,20 3.575,21 3.374,22 5.012,23 3.359,24 4.207,25 4.337,26 3.99,27 3.745,28 5.386,29 3.715,30 4.384,31 4.512,32 4.15,33 3.874,34 5.656,35 3.815,36 4.482,37 4.669,38 4.11,39 3.831,40 5.702,41 3.746,42 4.366,43 4.565,44 4.023,45 3.713,46 5.567,47 3.632,48 4.224,49 4.399,50 4.11,51 3.626,52 5.535,53 3.564,54 4.177,55 4.365,56 3.822,57 3.558,58 5.487,59 3.464,60 3.987,61 4.135,62 3.679,63 3.399,64 5.422,65 3.324,66 0.07,67 0.507,68 3.887,69 3.113,70 5.2}
{0 CHEMBL2000354,1 14.539,2 15.157,3 0.051,4 -0.009,5 0.287,6 0.624,7 3.673,8 3.673,9 5,10 1,11 1.708,12 10.652,13 3.496,14 12.219,15 91.11,16 8.822,17 0.48,18 3.732,19 3.814,20 3.483,21 3.353,22 4.974,23 3.326,24 4.172,25 4.283,26 3.866,27 3.692,28 5.42,29 3.649,30 4.333,31 4.473,32 3.83,33 3.719,34 5.611,35 3.659,36 4.295,37 4.466,38 3.711,39 3.645,40 5.502,41 3.551,42 4.266,43 4.436,44 3.683,45 3.644,46 5.441,47 3.526,48 4.22,49 4.408,50 3.628,51 3.515,52 5.425,53 3.433,54 4.017,55 4.163,56 3.424,57 3.264,58 5.483,59 3.238,60 3.876,61 4.052,62 3.192,63 3.129,64 5.208,65 3.071,66 0.08,67 0.499,68 5.92,69 3.374,70 5.2}
{0 CHEMBL2000393,1 27.218,2 37.083,3 -0.023,4 -0.22,5 0.935,6 0.167,7 4.094,8 4.094,9 5.495,10 1,11 1.824,12 10.29,13 3.366,14 11.33,15 105.914,16 9.342,17 0.611,18 3.998,19 4.095,20 3.754,21 3.525,22 5.244,23 3.574,24 4.533,25 4.663,26 4.19,27 3.947,28 5.823,29 3.988,30 4.774,31 4.939,32 4.272,33 4.051,34 6.064,35 4.085,36 4.799,37 4.977,38 4.238,39 4.036,40 6.082,41 4.062,42 4.778,43 4.953,44 4.191,45 3.997,46 6.126,47 4.02,48 4.742,49 4.939,50 4.119,51 3.913,52 6.091,53 3.933,54 4.582,55 4.767,56 4.03,57 3.798,58 6.015,59 3.824,60 4.481,61 4.672,62 3.831,63 3.677,64 5.792,65 3.686,66 0.213,67 0.893,68 5.047,69 3.545,70 5.2}
{0 CHEMBL2000408,1 17.09,2 20.604,3 -0.003,4 -0.182,5 0.46,7 3.959,8 3.959,11 1.672,12 10.813,13 4.069,14 16.557,15 118.112,16 7.831,17 0.629,18 4.133,19 4.258,20 3.731,21 3.638,22 5.318,23 3.639,24 4.659,25 4.844,26 4.139,27 4.026,28 5.829,29 4.021,30 4.896,31 5.084,32 4.236,33 4.175,34 6.102,35 4.152,36 5.093,37 5.355,38 4.222,39 4.187,40 6.304,41 4.149,42 4.897,43 5.105,44 4.221,45 4.199,46 6.008,47 4.159,48 4.968,49 5.186,50 4.296,51 4.226,52 6.221,53 4.201,54 4.959,55 5.154,56 4.225,57 4.226,58 6.2,59 4.183,60 5.01,61 5.251,62 4.041,63 4.117,64 6.197,65 4.026,66 0.104,67 1.007,68 10.538,69 4.808,70 5.2}
{0 CHEMBL2000429,1 18.709,2 24.331,3 -0.018,4 -0.205,5 0.613,7 3.947,8 3.947,9 5.812,10 1,11 1.711,12 11.029,13 4.753,14 22.589,15 124.872,16 7.809,17 0.595,18 4.203,19 4.324,20 3.797,21 3.681,22 5.386,23 3.689,24 4.735,25 4.915,26 4.196,27 4.06,28 5.912,29 4.062,30 4.983,31 5.173,32 4.284,33 4.205,34 6.171,35 4.186,36 5.131,37 5.388,38 4.297,39 4.204,40 6.347,41 4.179,42 4.947,43 5.154,44 4.321,45 4.221,46 6.092,47 4.213,48 5.031,49 5.227,50 4.39,51 4.296,52 6.311,53 4.286,54 5.068,55 5.265,56 4.314,57 4.288,58 6.297,59 4.246,60 5.031,61 5.254,62 4.182,63 4.177,64 6.223,65 4.118,66 0.132,67 1.047,68 11.47,69 5.181,70 5.2}
{0 CHEMBL2000481,1 17.323,2 16.035,3 0.089,4 0.113,5 0.702,7 4.165,8 4.165,11 1.757,12 14.03,13 1.56,14 2.432,15 123.931,16 8.584,17 0.5,18 4.106,19 4.209,20 3.907,21 3.701,22 5.292,23 3.678,24 4.599,25 4.726,26 4.201,27 4.08,28 5.988,29 4.041,30 4.869,31 5.041,32 4.292,33 4.215,34 6.148,35 4.16,36 4.913,37 5.09,38 4.251,39 4.155,40 6.226,41 4.116,42 4.856,43 5.028,44 4.181,45 4.102,46 6.227,47 4.064,48 4.808,49 4.992,50 3.995,51 4.049,52 6.227,53 3.971,54 4.712,55 4.935,56 3.827,57 3.94,58 5.823,59 3.83,60 4.585,61 4.806,62 3.787,63 3.767,64 5.79,65 3.681,66 0.175,67 0.848,68 11.359,69 4.869,70 5.6}
{0 CHEMBL2000508,1 1.628,2 0.662,3 0.001,4 -0.123,5 0.171,7 3.699,8 3.699,11 1.665,12 7.714,13 3.905,14 15.249,15 81.269,16 9.528,17 0.875,18 3.588,19 3.676,20 3.432,21 3.288,22 4.804,23 3.257,24 4.048,25 4.162,26 3.817,27 3.652,28 5.272,29 3.619,30 4.201,31 4.366,32 3.728,33 3.685,34 5.379,35 3.628,36 4.156,37 4.329,38 3.661,39 3.63,40 5.281,41 3.574,42 4.178,43 4.342,44 3.785,45 3.732,46 5.272,47 3.648,48 4.219,49 4.378,50 3.711,51 3.733,52 5.381,53 3.592,54 4.107,55 4.324,56 3.322,57 3.409,58 5.196,59 3.245,60 3.739,61 4.023,62 2.831,63 2.72,64 4.925,65 2.621,66 0.035,67 0.507,68 3.543,69 2.448,70 5.2}
{0 CHEMBL2000568,1 2.428,2 1.842,3 0.039,4 -0.028,5 0.086,7 3.865,8 3.865,11 1.453,12 7.222,13 2.291,14 5.247,15 70.479,16 7.876,17 0.8,18 3.509,19 3.617,20 3.136,21 3.152,22 4.679,23 3.129,24 3.977,25 4.122,26 3.481,27 3.525,28 5.124,29 3.486,30 4.166,31 4.335,32 3.452,33 3.581,34 5.328,35 3.514,36 4.14,37 4.338,38 3.269,39 3.492,40 5.228,41 3.397,42 4.071,43 4.308,44 3.117,45 3.353,46 5.069,47 3.242,48 3.862,49 4.067,50 3.018,51 3.187,52 4.964,53 3.097,54 3.789,55 4.014,56 2.806,57 2.992,58 4.934,59 2.89,60 3.567,61 3.845,62 2.44,63 2.658,64 4.55,65 2.539,66 0.012,67 0.406,68 5.169,69 2.52,70 5.2}
{0 CHEMBL2000685,1 41.759,2 51.581,3 0.116,4 0.19,5 0.682,6 1.072,7 4.023,8 4.023,11 1.633,12 17.635,13 -0.795,14 0.632,15 197.783,16 7.705,17 0.333,18 4.611,19 4.775,20 4.16,21 4.037,22 5.926,23 4.048,24 5.018,25 5.209,26 4.492,27 4.377,28 6.329,29 4.359,30 5.249,31 5.449,32 4.565,33 4.521,34 6.546,35 4.504,36 5.372,37 5.597,38 4.581,39 4.591,40 6.541,41 4.554,42 5.39,43 5.593,44 4.702,45 4.666,46 6.594,47 4.634,48 5.51,49 5.711,50 4.732,51 4.751,52 6.814,53 4.703,54 5.685,55 5.957,56 4.717,57 4.785,58 6.824,59 4.706,60 5.571,61 5.807,62 4.747,63 4.727,64 6.814,65 4.675,66 0.347,67 1.487,68 18.62,69 5.964,70 5.2}
{0 CHEMBL2000801,1 16.455,2 24.048,3 0.052,4 -0.026,5 0.934,7 4.049,8 4.049,11 1.866,12 12.267,13 5.401,14 29.173,15 108.031,16 10.033,17 0.667,18 3.908,19 3.996,20 3.747,21 3.532,22 5.215,23 3.54,24 4.405,25 4.51,26 4.191,27 3.918,28 6.18,29 3.913,30 4.598,31 4.748,32 4.136,33 3.996,34 5.957,35 3.976,36 4.689,37 4.865,38 4.178,39 3.926,40 6.39,41 3.92,42 4.59,43 4.78,44 3.974,45 3.812,46 6.036,47 3.78,48 4.48,49 4.684,50 3.764,51 3.685,52 5.785,53 3.634,54 4.272,55 4.45,56 3.768,57 3.504,58 6.115,59 3.47,60 4.131,61 4.321,62 3.539,63 3.403,64 5.453,65 3.388,66 0.236,67 0.925,68 4.182,69 3.697,70 5.2}
{0 CHEMBL2000832,1 29.411,2 42.298,3 0.071,4 0.027,5 0.775,6 0.473,7 3.98,8 3.98,9 5.202,10 1,11 1.626,12 14.472,13 4.567,14 20.853,15 133.341,16 8.337,17 0.6,18 4.183,19 4.28,20 3.832,21 3.763,22 5.421,23 3.768,24 4.662,25 4.785,26 4.209,27 4.15,28 5.92,29 4.142,30 4.952,31 5.1,32 4.363,33 4.324,34 6.225,35 4.305,36 5.047,37 5.23,38 4.268,39 4.293,40 6.285,41 4.253,42 5.02,43 5.228,44 4.165,45 4.247,46 6.213,47 4.185,48 4.887,49 5.085,50 4.109,51 4.151,52 6.076,53 4.102,54 4.826,55 4.997,56 4.134,57 4.105,58 6.242,59 4.072,60 4.807,61 5.003,62 4.021,63 4.057,64 6.005,65 4.007,66 0.133,67 0.86,68 9.346,69 5.063,70 5.8}
{0 CHEMBL2000894,1 19.707,2 26.716,3 0.083,4 0.137,5 0.435,7 3.888,8 3.888,11 1.599,12 9.379,13 2.218,14 4.918,15 110.303,16 8.222,17 0.563,18 3.97,19 4.079,20 3.609,21 3.547,22 5.238,23 3.548,24 4.423,25 4.558,26 3.977,27 3.938,28 5.654,29 3.927,30 4.683,31 4.827,32 4.129,33 4.111,34 5.964,35 4.089,36 4.804,37 4.97,38 4.124,39 4.147,40 6.128,41 4.104,42 4.832,43 5.016,44 4.09,45 4.177,46 6.031,47 4.115,48 4.846,49 5.048,50 4.091,51 4.146,52 6.018,53 4.094,54 4.8,55 4.977,56 4.049,57 4.069,58 6.107,59 4.029,60 4.781,61 4.982,62 3.82,63 3.913,64 6.067,65 3.853,66 0.113,67 0.692,68 7.854,69 3.872,70 5.2}
{0 CHEMBL2001224,1 22.43,2 30.145,3 -0.001,4 -0.174,5 0.589,6 0.247,7 3.698,8 3.698,9 6.058,10 1,11 1.738,12 11,13 3.605,14 12.992,15 96.578,16 8.451,17 0.429,18 3.891,19 4.004,20 3.555,21 3.427,22 5.074,23 3.423,24 4.418,25 4.579,26 3.922,27 3.801,28 5.571,29 3.769,30 4.685,31 4.89,32 3.964,33 3.877,34 5.826,35 3.817,36 4.604,37 4.822,38 3.859,39 3.756,40 5.791,41 3.699,42 4.465,43 4.635,44 3.878,45 3.721,46 5.758,47 3.693,48 4.533,49 4.725,50 3.885,51 3.81,52 5.696,53 3.75,54 4.645,55 4.871,56 3.838,57 3.854,58 5.723,59 3.751,60 4.635,61 4.871,62 3.787,63 3.719,64 5.87,65 3.613,66 0.081,67 0.664,68 7.287,69 3.623,70 5.2}
{0 CHEMBL2001239,1 23.318,2 34.589,3 0.077,4 -0.098,5 1.15,6 0.4,7 3.665,8 3.665,11 2.036,12 9.7,13 3.922,14 15.383,15 106.195,16 9.973,17 0.563,18 3.935,19 4.043,20 3.7,21 3.419,22 5.288,23 3.471,24 4.416,25 4.55,26 4.16,27 3.781,28 6.218,29 3.82,30 4.608,31 4.758,32 4.167,33 3.911,34 6.263,35 3.912,36 4.658,37 4.835,38 3.993,39 3.894,40 5.968,41 3.87,42 4.701,43 4.903,44 4.019,45 3.899,46 6.009,47 3.895,48 4.678,49 4.851,50 4.149,51 3.915,52 6.091,53 3.926,54 4.77,55 4.965,56 4.25,57 3.874,58 6.403,59 3.898,60 4.66,61 4.861,62 4.15,63 3.755,64 6.156,65 3.796,66 0.352,67 0.9,68 4.487,69 3.363,70 5.2}
{0 CHEMBL2001257,1 27.434,2 33.376,3 0.045,4 -0.02,5 0.316,6 0.247,7 3.74,8 3.74,11 1.514,12 15.314,13 5.393,14 29.082,15 147.412,16 7.558,17 0.579,18 4.234,19 4.362,20 3.847,21 3.839,22 5.344,23 3.785,24 4.732,25 4.914,26 4.186,27 4.213,28 5.799,29 4.131,30 4.934,31 5.134,32 4.257,33 4.349,34 5.96,35 4.249,36 5.027,37 5.245,38 4.284,39 4.375,40 6.067,41 4.249,42 5.038,43 5.281,44 4.123,45 4.287,46 6.073,47 4.148,48 4.858,49 5.086,50 4.056,51 4.157,52 5.916,53 4.049,54 4.757,55 4.945,56 4.033,57 4.154,58 5.807,59 4.049,60 4.845,61 5.064,62 4.03,63 4.207,64 5.818,65 4.059,66 0.061,67 0.94,68 13.426,69 5.725,70 5.2}
{0 CHEMBL2001288,1 14.107,2 18.574,3 0.078,4 -0.097,5 0.825,7 3.332,8 3.332,9 5.428,10 1,11 2.005,12 7.15,13 -0.787,14 0.619,15 77.403,16 12.287,17 0.455,18 3.658,19 3.759,20 3.612,21 3.107,22 4.917,23 3.118,24 4.183,25 4.307,26 4.141,27 3.527,28 5.415,29 3.53,30 4.455,31 4.608,32 4.358,33 3.659,34 5.869,35 3.621,36 4.469,37 4.654,38 4.456,39 3.639,40 5.843,41 3.57,42 4.354,43 4.56,44 4.219,45 3.585,46 5.673,47 3.433,48 4.105,49 4.283,50 4.14,51 3.431,52 5.463,53 3.281,54 3.963,55 4.146,56 3.858,57 3.221,58 5.363,59 3.044,60 3.722,61 3.949,62 3.332,63 2.8,64 5.092,65 2.576,66 0.275,67 0.51,68 1.598,69 2.829,70 5.2}
{0 CHEMBL2001485,1 26.913,2 34.714,3 0.035,4 -0.036,5 0.491,6 0.247,7 3.922,8 3.922,11 1.625,12 16.692,13 4.056,14 16.452,15 156.799,16 7.937,17 0.628,18 4.319,19 4.444,20 3.971,21 3.896,22 5.475,23 3.863,24 4.818,25 4.991,26 4.349,27 4.294,28 5.935,29 4.243,30 5.027,31 5.199,32 4.43,33 4.439,34 6.17,35 4.368,36 5.188,37 5.393,38 4.486,39 4.482,40 6.339,41 4.389,42 5.161,43 5.383,44 4.377,45 4.417,46 6.25,47 4.311,48 5.043,49 5.276,50 4.208,51 4.306,52 6.087,53 4.212,54 4.945,55 5.159,56 4.188,57 4.279,58 5.996,59 4.173,60 4.964,61 5.181,62 4.194,63 4.251,64 6.052,65 4.146,66 0.074,67 1.065,68 13.235,69 5.876,70 5.2}
{0 CHEMBL2001547,1 16.265,2 17.95,3 -0.003,4 -0.187,5 0.56,7 3.946,8 3.946,11 1.695,12 10.129,13 4.122,14 16.988,15 113.578,16 8.009,17 0.647,18 4.086,19 4.208,20 3.703,21 3.59,22 5.284,23 3.598,24 4.605,25 4.783,26 4.113,27 3.966,28 5.826,29 3.971,30 4.86,31 5.054,32 4.175,33 4.091,34 6.101,35 4.078,36 4.93,37 5.179,38 4.189,39 4.094,40 6.177,41 4.075,42 4.811,43 5.007,44 4.204,45 4.131,46 6.008,47 4.111,48 4.88,49 5.078,50 4.242,51 4.177,52 6.136,53 4.155,54 4.913,55 5.11,56 4.187,57 4.163,58 6.159,59 4.124,60 4.943,61 5.183,62 3.993,63 4.045,64 6.157,65 3.965,66 0.118,67 0.969,68 9.554,69 4.477,70 5.2}
{0 CHEMBL2001668,1 8.668,2 10.187,4 -0.184,5 0.106,7 3.578,8 3.578,11 1.773,12 6.529,13 2.028,14 4.112,15 72.116,16 13.485,17 0.579,18 3.372,19 3.471,20 3.458,21 3.081,22 4.579,23 3.027,24 3.831,25 3.953,26 3.938,27 3.496,28 5.078,29 3.402,30 4.017,31 4.179,32 4.19,33 3.539,34 5.238,35 3.431,36 3.912,37 4.085,38 4.024,39 3.479,40 5.188,41 3.29,42 3.651,43 3.848,44 3.737,45 3.163,46 4.762,47 3.001,48 3.45,49 3.618,50 3.596,51 3.083,52 4.639,53 2.907,54 3.432,55 3.596,56 3.537,57 3.042,58 4.689,59 2.765,60 3.143,61 3.374,62 2.888,63 2.556,64 4.26,65 2.202,66 0.039,67 0.376,68 2.313,69 1.7,70 5.2}
{0 CHEMBL2001751,1 16.112,2 18.632,3 0.065,4 0.035,5 0.434,7 4.202,8 4.202,9 6.004,10 1,11 1.512,12 14.833,13 3.876,14 15.02,15 137.858,16 7.943,17 0.659,18 4.219,19 4.324,20 3.848,21 3.811,22 5.373,23 3.805,24 4.717,25 4.846,26 4.214,27 4.217,28 5.84,29 4.193,30 4.955,31 5.133,32 4.204,33 4.311,34 6.029,35 4.247,36 5.004,37 5.214,38 4.141,39 4.29,40 6.006,41 4.209,42 4.98,43 5.187,44 4.178,45 4.239,46 6.085,47 4.176,48 4.97,49 5.171,50 4.13,51 4.211,52 6.065,53 4.149,54 4.932,55 5.159,56 3.998,57 4.14,58 5.953,59 4.057,60 4.8,61 5.016,62 3.94,63 4.045,64 5.86,65 3.969,66 0.054,67 0.846,68 10.735,69 5.147,70 5.6}
{0 CHEMBL2001920,1 14.277,2 15.473,3 0.107,4 0.124,5 0.41,6 0.524,7 3.584,8 3.584,11 2.103,12 6.333,13 2.505,14 6.274,15 78.272,16 14.836,17 0.3,18 3.322,19 3.372,20 3.51,21 3.123,22 4.605,23 3.068,24 3.783,25 3.827,26 4.082,27 3.564,28 5.179,29 3.476,30 3.94,31 4.009,32 4.002,33 3.585,34 5.319,35 3.485,36 3.837,37 3.913,38 3.999,39 3.444,40 5.31,41 3.371,42 3.807,43 3.881,44 4.017,45 3.315,46 5.53,47 3.244,48 3.553,49 3.624,50 4.077,51 3.146,52 5.173,53 2.974,54 3.075,55 3.183,56 3.537,57 2.645,58 4.555,59 2.447,60 2.358,61 2.498,62 3.118,63 2.093,64 3.664,65 1.678,66 0.111,67 0.287,68 3.922,69 1.226,70 5.2}
{0 CHEMBL2001923,1 44.122,2 66.777,3 0.02,4 -0.092,5 1.045,6 0.8,7 4.084,8 4.084,9 11.47,10 2,11 1.635,12 20.46,13 7.14,14 50.982,15 185.299,16 8.241,17 0.596,18 4.536,19 4.64,20 4.192,21 4.105,22 5.697,23 4.109,24 5.079,25 5.222,26 4.581,27 4.515,28 6.236,29 4.51,30 5.368,31 5.543,32 4.721,33 4.698,34 6.638,35 4.666,36 5.425,37 5.626,38 4.63,39 4.714,40 6.578,41 4.645,42 5.447,43 5.674,44 4.534,45 4.699,46 6.474,47 4.61,48 5.359,49 5.576,50 4.532,51 4.634,52 6.405,53 4.559,54 5.309,55 5.513,56 4.551,57 4.562,58 6.447,59 4.522,60 5.233,61 5.412,62 4.551,63 4.511,64 6.501,65 4.481,66 0.137,67 1.387,68 13.557,69 7.414,70 5.2}
{0 CHEMBL2001957,1 17.082,2 21.72,3 -0.018,4 -0.178,5 0.926,7 3.792,8 3.792,9 4.907,10 1,11 1.839,12 11.629,13 4.828,14 23.313,15 120.939,16 8.605,17 0.579,18 4.175,19 4.287,20 3.837,21 3.632,22 5.416,23 3.67,24 4.722,25 4.884,26 4.29,27 4.009,28 6.309,29 4.044,30 4.938,31 5.12,32 4.289,33 4.153,34 6.274,35 4.144,36 5.056,37 5.306,38 4.226,39 4.152,40 6.168,41 4.133,42 4.91,43 5.114,44 4.337,45 4.171,46 6.161,47 4.177,48 4.986,49 5.173,50 4.451,51 4.227,52 6.414,53 4.244,54 5.01,55 5.195,56 4.349,57 4.207,58 6.318,59 4.211,60 4.986,61 5.203,62 4.179,63 4.094,64 6.232,65 4.066,66 0.293,67 1.153,68 8.869,69 4.908,70 5.2}
{0 CHEMBL2001998,1 29.185,2 35.496,3 -0.005,4 -0.165,5 0.533,6 0.8,7 3.849,8 3.849,9 6.055,10 1,11 1.568,12 16.559,13 2.73,14 7.451,15 129.654,16 7.501,17 0.447,18 4.222,19 4.349,20 3.803,21 3.735,22 5.32,23 3.727,24 4.783,25 4.971,26 4.153,27 4.146,28 5.801,29 4.115,30 5.016,31 5.227,32 4.202,33 4.29,34 6.005,35 4.225,36 5.101,37 5.332,38 4.093,39 4.273,40 6.093,41 4.179,42 5.067,43 5.331,44 3.987,45 4.189,46 5.961,47 4.072,48 4.98,49 5.251,50 3.869,51 4.073,52 5.81,53 3.958,54 4.804,55 5.057,56 3.812,57 3.98,58 5.735,59 3.886,60 4.701,61 4.921,62 3.779,63 3.951,64 5.697,65 3.857,66 0.059,67 0.968,68 12.353,69 5.148,70 5.2}
{0 CHEMBL2002165,1 21.644,2 26.24,3 0.079,4 0.05,5 0.602,7 3.89,8 3.89,11 1.751,12 15.278,13 3.757,14 14.114,15 140.416,16 8.519,17 0.675,18 4.201,19 4.315,20 3.905,21 3.787,22 5.415,23 3.769,24 4.681,25 4.822,26 4.284,27 4.184,28 5.911,29 4.146,30 4.927,31 5.108,32 4.315,33 4.293,34 6.098,35 4.229,36 4.975,37 5.178,38 4.407,39 4.312,40 6.163,41 4.235,42 4.956,43 5.149,44 4.291,45 4.261,46 6.15,47 4.18,48 4.834,49 5.03,50 4.139,51 4.148,52 6.085,53 4.07,54 4.774,55 4.982,56 4.042,57 4.106,58 5.87,59 4.018,60 4.795,61 4.999,62 4.084,63 4.104,64 5.931,65 4.005,66 0.145,67 0.985,68 10.126,69 5.102,70 5.2}
{0 CHEMBL2002240,1 11.616,2 15.684,3 0.078,4 0.077,5 0.181,7 4.142,8 4.142,11 1.524,12 8.565,13 2.327,14 5.413,15 88.949,16 8.172,17 0.68,18 3.712,19 3.827,20 3.352,21 3.336,22 4.987,23 3.324,24 4.154,25 4.296,26 3.702,27 3.7,28 5.381,29 3.669,30 4.405,31 4.574,32 3.779,33 3.832,34 5.634,35 3.792,36 4.436,37 4.637,38 3.758,39 3.8,40 5.742,41 3.738,42 4.387,43 4.591,44 3.64,45 3.716,46 5.634,47 3.662,48 4.317,49 4.523,50 3.589,51 3.633,52 5.63,53 3.577,54 4.278,55 4.491,56 3.453,57 3.546,58 5.583,59 3.484,60 4.165,61 4.389,62 3.236,63 3.366,64 5.555,65 3.278,66 0.037,67 0.538,68 5.945,69 2.867,70 5.2}
{0 CHEMBL2002322,1 11.734,2 12.129,3 0.104,4 0.029,5 1.171,7 4.05,8 4.05,11 1.984,12 8.231,13 4.238,14 17.959,15 84.727,16 11.48,17 0.571,18 3.702,19 3.774,20 3.621,21 3.307,22 5.112,23 3.34,24 4.255,25 4.344,26 4.202,27 3.711,28 6.452,29 3.745,30 4.337,31 4.428,32 4.14,33 3.797,34 5.94,35 3.815,36 4.516,37 4.673,38 4.058,39 3.754,40 6.072,41 3.794,42 4.386,43 4.52,44 4.117,45 3.667,46 5.983,47 3.745,48 4.547,49 4.684,50 4.307,51 3.563,52 6.885,53 3.693,54 4.321,55 4.491,56 3.998,57 3.355,58 6.195,59 3.465,60 4.109,61 4.244,62 4.017,63 2.953,64 5.992,65 3.178,66 0.457,67 1.026,68 0.99,69 3.294,70 5.2}
{0 CHEMBL2002323,1 7.215,2 4.633,3 0.044,4 0.005,5 0.263,7 3.989,8 3.989,11 1.611,12 6.556,13 2.614,14 6.835,15 69.309,16 8.354,17 0.8,18 3.509,19 3.636,20 3.174,21 3.062,22 4.761,23 3.07,24 3.967,25 4.126,26 3.553,27 3.441,28 5.197,29 3.436,30 4.149,31 4.325,32 3.558,33 3.525,34 5.421,35 3.501,36 4.214,37 4.44,38 3.371,39 3.439,40 5.392,41 3.378,42 4.031,43 4.259,44 3.235,45 3.252,46 5.238,47 3.196,48 3.933,49 4.154,50 3.092,51 3.105,52 5.17,53 3.059,54 3.823,55 4.097,56 2.961,57 2.843,58 5.208,59 2.794,60 3.421,61 3.699,62 2.263,63 2.411,64 4.54,65 2.309,66 0.076,67 0.542,68 4.714,69 2.297,70 5.2}
{0 CHEMBL2002373,1 5.822,2 4.205,3 0.004,4 -0.189,5 0.165,7 3.489,8 3.489,11 1.466,12 7.571,13 2.052,14 4.212,15 82.688,16 7.352,17 0.739,18 3.732,19 3.851,20 3.294,21 3.299,22 4.856,23 3.274,24 4.22,25 4.391,26 3.578,27 3.662,28 5.26,29 3.61,30 4.43,31 4.654,32 3.59,33 3.758,34 5.356,35 3.67,36 4.444,37 4.666,38 3.631,39 3.758,40 5.415,41 3.681,42 4.457,43 4.663,44 3.668,45 3.815,46 5.462,47 3.738,48 4.524,49 4.741,50 3.557,51 3.813,52 5.543,53 3.695,54 4.498,55 4.759,56 3.261,57 3.673,58 5.393,59 3.504,60 4.353,61 4.642,62 2.926,63 3.344,64 5.297,65 3.158,66 0.029,67 0.55,68 7.698,69 3.338,70 5.2}
{0 CHEMBL2002407,1 13.177,2 11.431,3 0.1,4 0.18,5 0.373,7 3.906,8 3.906,9 5.001,10 1,11 1.72,12 8.095,13 1.778,14 3.162,15 78.965,16 8.791,17 0.5,18 3.59,19 3.697,20 3.265,21 3.11,22 5.018,23 3.142,24 3.982,25 4.112,26 3.569,27 3.438,28 5.277,29 3.456,30 4.151,31 4.28,32 3.678,33 3.545,34 5.586,35 3.553,36 4.268,37 4.445,38 3.611,39 3.548,40 5.728,41 3.529,42 4.222,43 4.432,44 3.455,45 3.443,46 5.652,47 3.409,48 4.043,49 4.246,50 3.346,51 3.29,52 5.545,53 3.264,54 3.968,55 4.192,56 3.266,57 3.131,58 5.367,59 3.121,60 3.748,61 3.915,62 3.122,63 2.88,64 5.366,65 2.906,66 0.141,67 0.495,68 4.637,69 2.356,70 5.2}
{0 CHEMBL2002446,1 26.301,2 34.315,3 0.029,4 -0.05,5 0.279,6 0.68,7 3.914,8 3.914,9 5.625,10 1,11 1.476,12 15.606,13 5.374,14 28.882,15 138.702,16 7.281,17 0.421,18 4.246,19 4.367,20 3.855,21 3.847,22 5.189,23 3.791,24 4.822,25 5.012,26 4.173,27 4.25,28 5.685,29 4.165,30 4.989,31 5.201,32 4.137,33 4.341,34 5.815,35 4.216,36 5.107,37 5.373,38 4.089,39 4.328,40 5.863,41 4.175,42 4.977,43 5.23,44 4.079,45 4.261,46 5.758,47 4.108,48 4.868,49 5.108,50 3.969,51 4.19,52 5.67,53 4.033,54 4.73,55 4.948,56 3.932,57 4.125,58 5.556,59 3.981,60 4.768,61 4.99,62 3.949,63 4.131,64 5.578,65 3.968,66 0.08,67 0.939,68 14.408,69 6.217,70 5.2}
{0 CHEMBL2002479,1 25.806,2 36.034,3 0.059,4 0.009,5 0.533,6 0.4,7 4.279,8 4.279,9 5.82,10 1,11 1.671,12 13.656,13 3.809,14 14.507,15 121.934,16 8.471,17 0.611,18 4.101,19 4.205,20 3.775,21 3.671,22 5.249,23 3.67,24 4.614,25 4.749,26 4.168,27 4.074,28 5.776,29 4.051,30 4.84,31 5.021,32 4.173,33 4.16,34 5.921,35 4.111,36 4.818,37 4.999,38 4.129,39 4.106,40 5.928,41 4.053,42 4.785,43 4.978,44 4.095,45 4.065,46 5.884,47 4.01,48 4.754,49 4.942,50 3.972,51 4.051,52 5.812,53 3.983,54 4.746,55 4.948,56 3.868,57 4.018,58 5.796,59 3.924,60 4.719,61 4.949,62 3.838,63 3.929,64 5.728,65 3.823,66 0.096,67 0.766,68 8.793,69 4.482,70 5.2}
{0 CHEMBL2002649,1 11.833,2 15.343,3 0.024,4 -0.135,5 0.295,7 3.556,8 3.556,9 5.17,10 1,11 1.654,12 7.056,13 1.03,14 1.062,15 66.997,16 8.32,17 0.55,18 3.515,19 3.621,20 3.176,21 3.045,22 4.732,23 3.066,24 3.985,25 4.123,26 3.516,27 3.415,28 5.202,29 3.421,30 4.077,31 4.232,32 3.434,33 3.444,34 5.263,35 3.417,36 4.068,37 4.241,38 3.338,39 3.381,40 5.223,41 3.337,42 4.074,43 4.278,44 3.363,45 3.251,46 5.33,47 3.231,48 3.914,49 4.09,50 3.201,51 3.091,52 5.237,53 3.078,54 3.773,55 3.996,56 2.725,57 2.868,58 4.894,59 2.783,60 3.542,61 3.816,62 2.281,63 2.447,64 4.555,65 2.334,66 0.067,67 0.445,68 4.761,69 2.306,70 5.2}
{0 CHEMBL2002682,1 24.271,2 22.891,3 0.038,4 0.014,5 0.655,6 0.86,7 4.43,8 4.43,9 17.136,10 3,11 1.504,12 16.023,13 6.454,14 41.655,15 172.4,16 7.41,17 0.574,18 4.474,19 4.589,20 4.032,21 4.033,22 5.535,23 4.001,24 5.017,25 5.177,26 4.365,27 4.419,28 6.028,29 4.361,30 5.257,31 5.457,32 4.493,33 4.569,34 6.252,35 4.486,36 5.296,37 5.49,38 4.515,39 4.606,40 6.28,41 4.516,42 5.38,43 5.591,44 4.479,45 4.622,46 6.372,47 4.513,48 5.404,49 5.636,50 4.44,51 4.604,52 6.364,53 4.485,54 5.372,55 5.61,56 4.334,57 4.547,58 6.289,59 4.42,60 5.307,61 5.533,62 4.422,63 4.517,64 6.316,65 4.413,66 0.047,67 1.09,68 16.963,69 7.731,70 5.2}
{0 CHEMBL2002702,1 12.37,2 15.104,3 0.062,4 0.032,5 0.175,7 3.921,8 3.921,11 1.44,12 7.111,13 2.748,14 7.551,15 72.469,16 7.447,17 0.55,18 3.568,19 3.688,20 3.144,21 3.178,22 4.683,23 3.149,24 4.061,25 4.221,26 3.525,27 3.566,28 5.155,29 3.52,30 4.226,31 4.403,32 3.471,33 3.62,34 5.325,35 3.547,36 4.304,37 4.54,38 3.302,39 3.546,40 5.295,41 3.433,42 4.128,43 4.345,44 3.258,45 3.372,46 5.266,47 3.288,48 4.094,49 4.33,50 3.185,51 3.301,52 5.184,53 3.225,54 3.94,55 4.152,56 2.823,57 3.169,58 5.006,59 3.043,60 3.82,61 4.097,62 2.177,63 2.894,64 4.676,65 2.666,66 0.026,67 0.452,68 6.295,69 2.797,70 5.2}
{0 CHEMBL2002726,1 11.017,2 9.41,3 0.055,4 0.112,5 0.171,7 3.816,8 3.816,9 5.892,10 1,11 1.447,12 11.889,13 3.212,14 10.318,15 107.094,16 7.316,17 0.733,18 3.988,19 4.113,20 3.548,21 3.566,22 5.096,23 3.538,24 4.486,25 4.649,26 3.875,27 3.946,28 5.513,29 3.897,30 4.722,31 4.921,32 3.882,33 4.052,34 5.728,35 3.964,36 4.797,37 5.045,38 3.741,39 3.999,40 5.685,41 3.879,42 4.677,43 4.916,44 3.705,45 3.912,46 5.619,47 3.805,48 4.661,49 4.897,50 3.667,51 3.85,52 5.636,53 3.748,54 4.59,55 4.847,56 3.557,57 3.746,58 5.517,59 3.64,60 4.42,61 4.66,62 3.467,63 3.656,64 5.379,65 3.548,66 0.07,67 0.719,68 10.103,69 4.355,70 5.5}
{0 CHEMBL2002992,1 12.427,2 15.179,3 0.066,4 -0.003,5 0.331,7 3.166,8 3.166,11 1.47,12 8.857,13 1.461,14 2.133,15 81.7,16 6.661,17 0.435,18 3.845,19 3.993,20 3.311,21 3.355,22 4.859,23 3.316,24 4.416,25 4.61,26 3.673,27 3.795,28 5.356,29 3.716,30 4.758,31 5.01,32 3.701,33 3.932,34 5.643,35 3.814,36 4.825,37 5.103,38 3.585,39 3.878,40 5.74,41 3.735,42 4.733,43 5.036,44 3.337,45 3.712,46 5.62,47 3.548,48 4.454,49 4.735,50 3.319,51 3.545,52 5.41,53 3.413,54 4.298,55 4.532,56 3.251,57 3.494,58 5.337,59 3.371,60 4.343,61 4.62,62 2.961,63 3.386,64 5.225,65 3.227,66 0.053,67 0.659,68 10.153,69 3.768,70 5.2}
{0 CHEMBL2003271,1 14.113,2 16.802,3 0.119,4 0.221,5 0.499,7 3.759,8 3.759,11 1.975,12 8.833,13 4.763,14 22.689,15 97.47,16 12.112,17 0.615,18 3.638,19 3.701,20 3.642,21 3.394,22 4.941,23 3.351,24 4.081,25 4.144,26 4.114,27 3.812,28 5.482,29 3.741,30 4.327,31 4.41,32 4.354,33 3.914,34 5.728,35 3.833,36 4.31,37 4.405,38 4.206,39 3.816,40 5.734,41 3.73,42 4.219,43 4.333,44 4.112,45 3.661,46 5.668,47 3.62,48 4.197,49 4.29,50 4.148,51 3.633,52 5.989,53 3.61,54 4.153,55 4.26,56 3.952,57 3.628,58 5.689,59 3.531,60 3.992,61 4.12,62 3.658,63 3.47,64 5.336,65 3.333,66 0.152,67 0.411,68 0.573,69 2.043,70 5.2}
{0 CHEMBL2003286,1 10.216,2 8.592,3 0.071,4 0.039,5 0.385,6 0.508,7 3.562,8 3.562,9 4.945,10 1,11 1.832,12 7.235,13 1.659,14 2.751,15 64.378,16 9.665,17 0.333,18 3.403,19 3.464,20 3.224,21 2.99,22 4.733,23 2.98,24 3.839,25 3.925,26 3.644,27 3.321,28 5.228,29 3.304,30 3.951,31 4.034,32 3.531,33 3.312,34 5.417,35 3.294,36 3.928,37 4.069,38 3.316,39 3.21,40 5.381,41 3.151,42 3.89,43 4.061,44 3.206,45 3.161,46 5.121,47 3.066,48 3.767,49 3.934,50 3.158,51 2.955,52 5.083,53 2.903,54 3.584,55 3.759,56 3.067,57 2.604,58 5.055,59 2.614,60 3.193,61 3.268,62 2.626,63 2.261,64 5.035,65 2.249,66 0.15,67 0.352,68 3.354,69 2.487,70 5.2}
{0 CHEMBL2003341,1 11.666,2 15.34,3 0.049,4 0.018,5 0.569,7 3.85,8 3.85,11 1.668,12 11.077,13 3.808,14 14.497,15 102.699,16 9.221,17 0.643,18 3.836,19 3.928,20 3.573,21 3.485,22 5.047,23 3.457,24 4.306,25 4.427,26 3.945,27 3.866,28 5.519,29 3.813,30 4.587,31 4.753,32 4.013,33 4.003,34 5.749,35 3.917,36 4.62,37 4.8,38 4.097,39 3.952,40 5.837,41 3.866,42 4.637,43 4.829,44 3.938,45 3.88,46 5.919,47 3.79,48 4.521,49 4.711,50 3.854,51 3.776,52 5.803,53 3.68,54 4.322,55 4.507,56 3.743,57 3.597,58 5.681,59 3.523,60 4.166,61 4.358,62 3.555,63 3.481,64 5.371,65 3.39,66 0.074,67 0.531,68 5.607,69 3.429,70 5.2}
{0 CHEMBL2003420,1 20.734,2 24.622,3 -0.015,4 -0.225,5 0.303,6 0.564,7 3.448,8 3.448,11 1.547,12 16.5,13 0.979,14 0.958,15 107.526,16 6.867,17 0.414,18 4.087,19 4.236,20 3.557,21 3.541,22 5.168,23 3.516,24 4.613,25 4.824,26 3.789,27 3.885,28 5.687,29 3.805,30 4.873,31 5.137,32 3.734,33 3.967,34 5.779,35 3.843,36 4.883,37 5.17,38 3.608,39 3.848,40 5.832,41 3.725,42 4.753,43 5.029,44 3.612,45 3.765,46 5.74,47 3.661,48 4.728,49 4.997,50 3.593,51 3.718,52 5.826,53 3.623,54 4.646,55 4.913,56 3.458,57 3.697,58 5.616,59 3.578,60 4.626,61 4.901,62 3.328,63 3.684,64 5.504,65 3.536,66 0.038,67 0.838,68 12.631,69 4.423,70 5.2}
{0 CHEMBL2003456,1 9.679,2 15.401,3 0.057,4 -0.063,5 0.12,7 3.553,8 3.553,11 1.592,12 6.938,13 1.6,14 2.559,15 59.726,16 8.45,17 0.667,18 3.37,19 3.482,20 3.05,21 2.962,22 4.58,23 2.971,24 3.822,25 3.951,26 3.408,27 3.339,28 5.088,29 3.321,30 4.01,31 4.192,32 3.312,33 3.365,34 5.167,35 3.316,36 3.893,37 4.108,38 3.084,39 3.196,40 5.025,41 3.118,42 3.743,43 3.966,44 2.903,45 2.985,46 4.856,47 2.918,48 3.513,49 3.736,50 2.683,51 2.748,52 4.592,53 2.69,54 3.319,55 3.549,56 2.437,57 2.483,58 4.47,59 2.429,60 3.035,61 3.273,62 1.929,63 2.009,64 4.302,65 1.949,66 0.041,67 0.391,68 3.836,69 1.87,70 5.2}
{0 CHEMBL2003482,1 15.894,2 16.748,3 0.055,4 0.127,5 0.289,7 3.628,8 3.628,11 1.67,12 8.737,13 2.947,14 8.682,15 74.065,16 8.356,17 0.524,18 3.613,19 3.733,20 3.278,21 3.204,22 4.709,23 3.177,24 4.142,25 4.301,26 3.656,27 3.613,28 5.22,29 3.553,30 4.376,31 4.59,32 3.568,33 3.619,34 5.415,35 3.518,36 4.269,37 4.514,38 3.345,39 3.396,40 5.337,41 3.299,42 4.099,43 4.332,44 3.261,45 3.211,46 5.3,47 3.161,48 3.982,49 4.197,50 3.148,51 3.172,52 5.106,53 3.093,54 3.835,55 4.03,56 3.185,57 3.107,58 5.049,59 3.029,60 3.79,61 4.035,62 2.918,63 3.095,64 4.653,65 2.963,66 0.06,67 0.495,68 5.779,69 2.835,70 5.2}
{0 CHEMBL2003524,1 16.423,2 14.262,3 -0.007,4 -0.157,5 0.47,6 0.8,7 3.796,8 3.796,9 10.569,10 2,11 1.646,12 7,13 1.76,14 3.096,15 74.385,16 8.18,17 0.478,18 3.687,19 3.777,20 3.327,21 3.195,22 4.899,23 3.217,24 4.214,25 4.359,26 3.712,27 3.569,28 5.42,29 3.588,30 4.328,31 4.451,32 3.867,33 3.698,34 5.652,35 3.724,36 4.389,37 4.508,38 3.846,39 3.749,40 5.774,41 3.75,42 4.526,43 4.697,44 3.718,45 3.729,46 5.676,47 3.69,48 4.486,49 4.678,50 3.556,51 3.542,52 5.705,53 3.492,54 4.362,55 4.586,56 3.188,57 3.235,58 5.62,59 3.167,60 4.014,61 4.257,62 2.497,63 2.845,64 5.219,65 2.704,66 0.098,67 0.494,68 5.951,69 3.165,70 5.2}
{0 CHEMBL2003638,1 17.529,2 24.912,3 0.042,4 0.122,5 0.623,7 3.88,8 3.88,11 1.647,12 13.065,13 4.439,14 19.7,15 116.372,16 8.593,17 0.771,18 4.012,19 4.127,20 3.704,21 3.597,22 5.248,23 3.604,24 4.48,25 4.617,26 4.061,27 3.978,28 5.716,29 3.972,30 4.703,31 4.887,32 4.044,33 4.034,34 5.9,35 4.001,36 4.737,37 4.955,38 3.986,39 3.933,40 5.924,41 3.907,42 4.626,43 4.836,44 3.976,45 3.839,46 5.988,47 3.836,48 4.521,49 4.717,50 3.897,51 3.827,52 5.724,53 3.813,54 4.513,55 4.72,56 3.863,57 3.816,58 5.71,59 3.784,60 4.433,61 4.625,62 3.751,63 3.773,64 5.689,65 3.727,66 0.134,67 0.835,68 7.057,69 3.825,70 6.7}
{0 CHEMBL2003657,1 7.701,2 5.439,3 0.034,4 -0.13,5 0.478,7 4.675,8 4.675,11 1.882,12 10.129,13 4.873,14 23.748,15 119.214,16 9.298,17 0.714,18 4.037,19 4.128,20 3.952,21 3.679,22 5.19,23 3.638,24 4.565,25 4.692,26 4.346,27 4.092,28 5.896,29 4.045,30 4.781,31 4.931,32 4.377,33 4.198,34 6.051,35 4.143,36 4.898,37 5.071,38 4.321,39 4.194,40 6.276,41 4.155,42 4.802,43 4.955,44 4.319,45 4.253,46 6.02,47 4.18,48 4.906,49 5.093,50 4.27,51 4.282,52 6.049,53 4.163,54 4.852,55 5.072,56 4.242,57 4.158,58 5.931,59 4.033,60 4.686,61 4.878,62 4.292,63 3.993,64 5.999,65 3.911,66 0.139,67 0.867,68 9.167,69 4.69,70 5.2}
{0 CHEMBL2003768,1 22.338,2 31.076,3 0.003,4 -0.179,5 0.36,6 0.6,7 3.909,8 3.909,9 10.496,10 2,11 1.647,12 10.8,13 1.312,14 1.721,15 93.289,16 8.08,17 0.444,18 3.862,19 3.952,20 3.481,21 3.351,22 5.121,23 3.373,24 4.293,25 4.441,26 3.752,27 3.621,28 5.494,29 3.642,30 4.391,31 4.53,32 3.827,33 3.705,34 5.726,35 3.706,36 4.477,37 4.646,38 3.714,39 3.724,40 5.677,41 3.678,42 4.516,43 4.726,44 3.682,45 3.724,46 5.599,47 3.673,48 4.521,49 4.709,50 3.701,51 3.652,52 5.727,53 3.64,54 4.409,55 4.578,56 3.646,57 3.579,58 5.734,59 3.553,60 4.444,61 4.684,62 3.451,63 3.473,64 5.609,65 3.414,66 0.126,67 0.59,68 7.535,69 3.703,70 5.2}
{0 CHEMBL2003817,1 16.178,2 22.484,3 0.009,4 -0.151,5 0.851,7 3.612,8 3.612,11 1.905,12 10.167,13 1.889,14 3.57,15 78.386,16 9.803,17 0.654,18 3.689,19 3.796,20 3.454,21 3.186,22 5.037,23 3.248,24 4.182,25 4.314,26 3.902,27 3.523,28 6.065,29 3.584,30 4.327,31 4.495,32 3.835,33 3.607,34 5.75,35 3.647,36 4.371,37 4.559,38 3.773,39 3.507,40 5.865,41 3.554,42 4.295,43 4.492,44 3.701,45 3.372,46 5.877,47 3.43,48 4.113,49 4.295,50 3.57,51 3.23,52 5.646,53 3.298,54 4.027,55 4.216,56 3.464,57 3.145,58 5.599,59 3.206,60 3.922,61 4.123,62 3.286,63 3.08,64 5.344,65 3.118,66 0.254,67 0.778,68 3.155,69 2.596,70 5.2}
{0 CHEMBL2004072,1 4.892,2 2.761,3 0.016,4 -0.037,5 0.235,7 3.737,8 3.737,9 4.722,10 1,11 1.779,12 7.75,13 3.412,14 11.641,15 75.943,16 9.578,17 0.727,18 3.536,19 3.602,20 3.371,21 3.22,22 4.81,23 3.191,24 4.005,25 4.104,26 3.765,27 3.6,28 5.327,29 3.551,30 4.122,31 4.232,32 3.826,33 3.643,34 5.437,35 3.594,36 4.158,37 4.296,38 3.682,39 3.579,40 5.452,41 3.524,42 4.077,43 4.229,44 3.561,45 3.513,46 5.313,47 3.431,48 4.068,49 4.229,50 3.514,51 3.353,52 5.476,53 3.293,54 3.775,55 3.935,56 3.243,57 3.008,58 5.16,59 2.966,60 3.59,61 3.795,62 2.563,63 2.58,64 4.862,65 2.533,66 0.074,67 0.433,68 3.411,69 2.707,70 5.2}
{0 CHEMBL2004290,1 25.408,2 31.066,3 0.058,4 0.034,5 0.551,7 3.895,8 3.895,9 5.14,10 1,11 1.658,12 16.711,13 3.74,14 13.988,15 151.3,16 8.01,17 0.643,18 4.3,19 4.415,20 3.954,21 3.864,22 5.466,23 3.838,24 4.793,25 4.946,26 4.34,27 4.262,28 5.949,29 4.221,30 5.025,31 5.189,32 4.368,33 4.398,34 6.153,35 4.324,36 5.154,37 5.386,38 4.445,39 4.434,40 6.212,41 4.333,42 5.082,43 5.289,44 4.343,45 4.373,46 6.207,47 4.272,48 4.962,49 5.175,50 4.149,51 4.244,52 6.015,53 4.147,54 4.861,55 5.072,56 4.126,57 4.186,58 5.95,59 4.096,60 4.902,61 5.102,62 4.182,63 4.22,64 5.994,65 4.112,66 0.111,67 1.008,68 12.923,69 5.876,70 5.2}
{0 CHEMBL2004311,1 26.744,2 40.338,3 0.058,4 0.028,5 0.29,6 0.247,7 3.823,8 3.823,11 1.454,12 11.897,13 4.462,14 19.905,15 114.783,16 7.413,17 0.563,18 4.038,19 4.159,20 3.601,21 3.637,22 5.158,23 3.607,24 4.546,25 4.712,26 3.981,27 4.038,28 5.671,29 3.985,30 4.766,31 4.935,32 4.019,33 4.178,34 5.856,35 4.103,36 4.887,37 5.106,38 4.001,39 4.164,40 5.944,41 4.071,42 4.861,43 5.073,44 3.876,45 4.102,46 5.948,47 4.003,48 4.873,49 5.141,50 3.805,51 4.001,52 5.873,53 3.883,54 4.694,55 4.933,56 3.556,57 3.797,58 5.81,59 3.698,60 4.455,61 4.705,62 3.476,63 3.657,64 5.477,65 3.559,66 0.038,67 0.73,68 10.284,69 4.63,70 5.2}
{0 CHEMBL2004355,1 19.519,2 19.137,3 0.075,4 -0.008,5 0.763,6 0.473,7 4.167,8 4.167,9 5.245,10 1,11 1.866,12 11.192,13 0.732,14 0.535,15 96.924,16 8.731,17 0.444,18 3.869,19 3.97,20 3.699,21 3.403,22 5.123,23 3.389,24 4.355,25 4.489,26 3.935,27 3.729,28 5.869,29 3.71,30 4.57,31 4.729,32 3.996,33 3.837,34 5.951,35 3.815,36 4.61,37 4.788,38 3.918,39 3.771,40 6.079,41 3.75,42 4.565,43 4.776,44 3.742,45 3.683,46 5.929,47 3.64,48 4.411,49 4.599,50 3.641,51 3.606,52 5.716,53 3.552,54 4.449,55 4.661,56 3.539,57 3.519,58 5.895,59 3.458,60 4.322,61 4.573,62 3.447,63 3.43,64 5.444,65 3.345,66 0.18,67 0.677,68 9.514,69 3.803,70 5.2}
{0 CHEMBL2004365,1 20.652,2 22.349,3 0.102,4 0.135,5 0.64,6 1.197,7 3.714,8 3.714,9 5.199,10 1,11 1.864,12 9.2,13 2.418,14 5.849,15 121.644,16 9.779,17 0.303,18 3.98,19 4.06,20 3.871,21 3.668,22 5.211,23 3.603,24 4.466,25 4.565,26 4.299,27 4.078,28 5.739,29 3.986,30 4.643,31 4.763,32 4.325,33 4.143,34 5.846,35 4.063,36 4.757,37 4.851,38 4.617,39 4.262,40 6.214,41 4.205,42 4.901,43 4.997,44 4.727,45 4.333,46 6.302,47 4.283,48 4.948,49 5.057,50 4.574,51 4.262,52 6.645,53 4.214,54 4.919,55 5.113,56 4.161,57 4.17,58 6.114,59 4.037,60 4.755,61 4.957,62 3.99,63 4.033,64 5.919,65 3.863,66 0.131,67 0.679,68 6.256,69 4.364,70 5.2}
{0 CHEMBL2004419,1 9.117,2 4.86,3 0.033,4 -0.096,5 0.428,7 4.594,8 4.594,11 1.688,12 10,13 5.969,14 35.634,15 115.367,16 8.643,17 0.735,18 4.026,19 4.14,20 3.76,21 3.631,22 5.202,23 3.608,24 4.545,25 4.702,26 4.192,27 4.036,28 5.716,29 4.008,30 4.76,31 4.949,32 4.192,33 4.129,34 5.948,35 4.083,36 4.853,37 5.083,38 4.184,39 4.146,40 5.95,41 4.095,42 4.792,43 4.971,44 4.285,45 4.221,46 5.994,47 4.157,48 4.921,49 5.116,50 4.26,51 4.254,52 6.135,53 4.16,54 4.862,55 5.091,56 4.23,57 4.108,58 6.036,59 4.034,60 4.702,61 4.914,62 4.047,63 3.914,64 5.987,65 3.859,66 0.078,67 0.915,68 8.044,69 4.353,70 5.2}
{0 CHEMBL2004438,1 19.34,2 26.901,3 0.075,4 -0.023,5 0.874,7 3.87,8 3.87,11 1.757,12 13.419,13 3.701,14 13.699,15 109.694,16 9.009,17 0.676,18 3.985,19 4.098,20 3.688,21 3.543,22 5.276,23 3.568,24 4.472,25 4.6,26 4.132,27 3.912,28 6.194,29 3.928,30 4.68,31 4.85,32 4.129,33 4.033,34 6.013,35 4.028,36 4.763,37 4.96,38 4.071,39 3.981,40 6.131,41 3.971,42 4.73,43 4.938,44 3.964,45 3.888,46 6.123,47 3.867,48 4.623,49 4.86,50 3.735,51 3.75,52 5.858,53 3.709,54 4.412,55 4.614,56 3.773,57 3.634,58 6.06,59 3.604,60 4.309,61 4.515,62 3.553,63 3.573,64 5.542,65 3.53,66 0.195,67 0.941,68 6.123,69 3.81,70 5.2}
{0 CHEMBL2004447,1 17.673,2 19.707,3 0.064,4 0.108,5 0.346,7 3.827,8 3.827,9 5.473,10 1,11 1.648,12 6.522,13 3.742,14 14.006,15 85.929,16 7.809,17 0.44,18 3.797,19 3.92,20 3.393,21 3.338,22 5.026,23 3.331,24 4.309,25 4.473,26 3.811,27 3.76,28 5.449,29 3.739,30 4.581,31 4.738,32 3.944,33 3.949,34 5.749,35 3.909,36 4.835,37 5.083,38 4.013,39 4.007,40 6.022,41 3.963,42 4.741,43 4.953,44 4.011,45 3.969,46 5.988,47 3.94,48 4.709,49 4.906,50 3.955,51 3.861,52 6.189,53 3.833,54 4.565,55 4.793,56 3.458,57 3.674,58 5.851,59 3.562,60 4.465,61 4.783,62 2.345,63 3.243,64 5.621,65 3.001,66 0.084,67 0.669,68 7.52,69 3.558,70 5.2}
{0 CHEMBL2004544,1 21.63,2 30.367,3 0.079,4 0.005,5 0.799,6 0.532,7 4.325,8 4.325,9 10.628,10 2,11 1.719,12 9.731,13 2.595,14 6.732,15 95.398,16 9.108,17 0.586,18 3.876,19 3.929,20 3.753,21 3.452,22 5.053,23 3.452,24 4.387,25 4.464,26 4.036,27 3.832,28 5.946,29 3.834,30 4.564,31 4.691,32 4.061,33 3.968,34 5.796,35 3.927,36 4.666,37 4.812,38 4.049,39 3.946,40 5.956,41 3.897,42 4.683,43 4.862,44 3.92,45 3.836,46 5.917,47 3.778,48 4.545,49 4.721,50 3.75,51 3.688,52 6.028,53 3.618,54 4.403,55 4.6,56 3.529,57 3.59,58 5.565,59 3.516,60 4.252,61 4.41,62 3.572,63 3.503,64 5.483,65 3.456,66 0.215,67 0.561,68 8.7,69 4.344,70 5.2}
{0 CHEMBL2004615,1 12.596,2 12.877,3 0.089,4 0.082,5 0.321,7 3.507,8 3.507,11 1.847,12 6.412,13 0.906,14 0.821,15 68.331,16 8.905,17 0.611,18 3.463,19 3.596,20 3.226,21 3.002,22 4.745,23 2.976,24 3.88,25 4.036,26 3.549,27 3.313,28 5.177,29 3.275,30 3.983,31 4.149,32 3.633,33 3.334,34 5.295,35 3.322,36 4.073,37 4.252,38 3.715,39 3.338,40 5.558,41 3.313,42 4.068,43 4.268,44 3.347,45 3.317,46 5.307,47 3.222,48 3.983,49 4.21,50 3.099,51 3.165,52 5.262,53 3.024,54 3.839,55 4.133,56 2.642,57 2.878,58 4.885,59 2.682,60 3.355,61 3.626,62 1.838,63 2.351,64 4.425,65 2.137,66 0.105,67 0.484,68 4.876,69 2.225,70 5.2}
{0 CHEMBL2004692,1 12.198,2 8.953,3 0.071,4 0.259,5 0.508,7 3.774,8 3.774,11 1.875,12 9.815,13 2.77,14 7.674,15 105.144,16 9.755,17 0.7,18 3.842,19 3.952,20 3.67,21 3.389,22 5.184,23 3.399,24 4.242,25 4.364,26 3.999,27 3.738,28 5.535,29 3.731,30 4.371,31 4.538,32 3.924,33 3.682,34 5.702,35 3.675,36 4.407,37 4.586,38 3.989,39 3.636,40 5.768,41 3.687,42 4.398,43 4.565,44 3.998,45 3.667,46 5.772,47 3.72,48 4.411,49 4.566,50 3.984,51 3.658,52 5.839,53 3.702,54 4.437,55 4.613,56 3.901,57 3.56,58 5.939,59 3.592,60 4.264,61 4.47,62 3.617,63 3.431,64 5.517,65 3.39,66 0.247,67 0.704,68 4.571,69 2.926,70 5.2}
{0 CHEMBL2004716,1 29.302,2 37.713,3 0.041,4 -0.043,5 0.495,6 0.247,7 3.729,8 3.729,11 1.564,12 17.385,13 4.543,14 20.642,15 162.121,16 7.435,17 0.524,18 4.363,19 4.495,20 3.95,21 3.931,22 5.469,23 3.882,24 4.87,25 5.055,26 4.289,27 4.307,28 5.954,29 4.228,30 5.105,31 5.318,32 4.355,33 4.449,34 6.121,35 4.35,36 5.196,37 5.417,38 4.388,39 4.487,40 6.221,41 4.362,42 5.247,43 5.5,44 4.266,45 4.421,46 6.27,47 4.283,48 5.107,49 5.359,50 4.246,51 4.289,52 6.185,53 4.19,54 4.969,55 5.176,56 4.137,57 4.241,58 6.103,59 4.151,60 4.966,61 5.185,62 4.065,63 4.242,64 6.048,65 4.111,66 0.062,67 1.096,68 15.755,69 6.569,70 5.2}
{0 CHEMBL2004771,1 17.232,2 27.874,3 0.051,4 -0.021,5 0.232,7 4.224,8 4.224,11 1.514,12 11.038,13 3.927,14 15.424,15 97.851,16 8.327,17 0.733,18 3.858,19 3.955,20 3.535,21 3.482,22 5.022,23 3.482,24 4.348,25 4.467,26 3.923,27 3.884,28 5.536,29 3.866,30 4.558,31 4.728,32 3.898,33 3.948,34 5.657,35 3.904,36 4.54,37 4.719,38 3.774,39 3.867,40 5.643,41 3.809,42 4.475,43 4.682,44 3.624,45 3.758,46 5.522,47 3.685,48 4.379,49 4.6,50 3.477,51 3.661,52 5.394,53 3.572,54 4.199,55 4.416,56 3.322,57 3.483,58 5.248,59 3.396,60 4.033,61 4.245,62 3.197,63 3.296,64 5.084,65 3.225,66 0.038,67 0.57,68 6.439,69 3.335,70 5.2}
{0 CHEMBL2004871,1 7.449,2 4.867,3 0.003,4 -0.15,5 0.21,7 3.603,8 3.603,11 1.61,12 8.318,13 2.258,14 5.097,15 82.905,16 7.825,17 0.708,18 3.744,19 3.858,20 3.348,21 3.297,22 4.931,23 3.289,24 4.235,25 4.4,26 3.658,27 3.659,28 5.387,29 3.63,30 4.454,31 4.668,32 3.676,33 3.754,34 5.532,35 3.694,36 4.461,37 4.677,38 3.677,39 3.755,40 5.521,41 3.696,42 4.463,43 4.667,44 3.706,45 3.814,46 5.504,47 3.747,48 4.536,49 4.748,50 3.646,51 3.81,52 5.656,53 3.711,54 4.516,55 4.769,56 3.429,57 3.669,58 5.55,59 3.535,60 4.379,61 4.656,62 3.147,63 3.336,64 5.489,65 3.21,66 0.047,67 0.623,68 6.991,69 3.369,70 5.2}
{0 CHEMBL2004872,1 13.021,2 18.055,3 -0.003,4 -0.133,5 0.316,7 3.724,8 3.724,9 5.227,10 1,11 1.507,12 11.56,13 3.151,14 9.928,15 96.49,16 7.578,17 0.667,18 3.871,19 3.983,20 3.453,21 3.441,22 5.039,23 3.422,24 4.354,25 4.515,26 3.758,27 3.785,28 5.487,29 3.748,30 4.552,31 4.734,32 3.81,33 3.915,34 5.644,35 3.852,36 4.632,37 4.835,38 3.721,39 3.891,40 5.74,41 3.804,42 4.662,43 4.897,44 3.627,45 3.841,46 5.713,47 3.735,48 4.527,49 4.756,50 3.485,51 3.726,52 5.543,53 3.615,54 4.423,55 4.672,56 3.417,57 3.59,58 5.536,59 3.479,60 4.277,61 4.527,62 3.296,63 3.444,64 5.323,65 3.35,66 0.011,67 0.615,68 8.339,69 3.886,70 5.2}
{0 CHEMBL2004892,1 8.035,2 5.975,3 0.106,4 0.147,5 0.274,7 4.441,8 4.441,11 1.798,12 8.857,13 2.168,14 4.701,15 85.059,16 8.64,17 0.696,18 3.688,19 3.795,20 3.56,21 3.289,22 4.832,23 3.251,24 4.174,25 4.301,26 3.775,27 3.651,28 5.617,29 3.613,30 4.385,31 4.558,32 3.706,33 3.728,34 5.606,35 3.66,36 4.365,37 4.57,38 3.602,39 3.694,40 5.487,41 3.582,42 4.318,43 4.536,44 3.417,45 3.562,46 5.467,47 3.443,48 4.159,49 4.393,50 3.239,51 3.347,52 5.25,53 3.237,54 3.927,55 4.174,56 3.159,57 3.12,58 4.993,59 3.014,60 3.77,61 3.993,62 3.074,63 2.971,64 4.973,65 2.862,66 0.135,67 0.583,68 8.534,69 3.246,70 5.2}
{0 CHEMBL2004934,1 14.648,2 18.717,3 0.012,4 -0.057,5 0.633,7 3.725,8 3.725,9 5.199,10 1,11 1.56,12 11.538,13 3.556,14 12.645,15 98.225,16 7.787,17 0.643,18 3.894,19 4.001,20 3.492,21 3.474,22 5.092,23 3.458,24 4.382,25 4.534,26 3.818,27 3.824,28 5.565,29 3.795,30 4.606,31 4.783,32 3.903,33 3.958,34 5.783,35 3.911,36 4.684,37 4.876,38 3.857,39 3.935,40 5.903,41 3.872,42 4.734,43 4.959,44 3.8,45 3.875,46 6.038,47 3.799,48 4.581,49 4.805,50 3.588,51 3.747,52 5.728,53 3.658,54 4.447,55 4.686,56 3.504,57 3.607,58 5.621,59 3.524,60 4.338,61 4.573,62 3.415,63 3.467,64 5.558,65 3.41,66 0.034,67 0.666,68 8.115,69 4.165,70 5.2}
{0 CHEMBL2005112,1 21.112,2 23.59,3 0.016,4 -0.055,5 0.529,7 4.34,8 4.34,11 1.676,12 10.906,13 5.391,14 29.061,15 123.924,16 10.132,17 0.583,18 4.007,19 4.1,20 3.841,21 3.652,22 5.262,23 3.644,24 4.487,25 4.614,26 4.294,27 4.056,28 5.685,29 4.039,30 4.708,31 4.846,32 4.417,33 4.192,34 5.989,35 4.175,36 4.82,37 4.976,38 4.421,39 4.208,40 6.156,41 4.187,42 4.814,43 4.974,44 4.366,45 4.175,46 6.164,47 4.154,48 4.781,49 4.924,50 4.441,51 4.173,52 6.251,53 4.129,54 4.8,55 4.994,56 4.148,57 4.089,58 6.02,59 4.007,60 4.707,61 4.934,62 4.022,63 3.964,64 5.956,65 3.863,66 0.095,67 0.685,68 4.334,69 3.659,70 5.2}
{0 CHEMBL2005186,1 20.292,2 31.925,3 0.03,4 -0.027,5 0.501,6 0.141,7 4.362,8 4.362,9 5.685,10 1,11 1.552,12 13.118,13 4.724,14 22.319,15 128.495,16 7.803,17 0.711,18 4.174,19 4.294,20 3.786,21 3.731,22 5.322,23 3.724,24 4.672,25 4.829,26 4.144,27 4.101,28 5.804,29 4.08,30 4.903,31 5.099,32 4.165,33 4.195,34 6.017,35 4.149,36 4.924,37 5.155,38 4.106,39 4.144,40 5.966,41 4.089,42 4.837,43 5.033,44 4.085,45 4.113,46 5.98,47 4.07,48 4.838,49 5.038,50 4.085,51 4.167,52 5.893,53 4.116,54 4.835,55 5.022,56 4.133,57 4.228,58 5.916,59 4.164,60 4.897,61 5.095,62 4.071,63 4.228,64 5.969,65 4.138,66 0.068,67 0.891,68 10.778,69 4.847,70 5.2}
{0 CHEMBL2005375,1 35.279,2 56.934,3 -0.009,4 -0.251,5 0.991,6 0.835,7 3.964,8 3.964,9 5.618,10 1,11 1.505,12 13.568,13 5.403,14 29.189,15 143.775,16 6.756,17 0.293,18 4.402,19 4.538,20 3.889,21 3.887,22 5.386,23 3.858,24 5.01,25 5.212,26 4.271,27 4.319,28 5.937,29 4.258,30 5.321,31 5.565,32 4.402,33 4.491,34 6.239,35 4.409,36 5.375,37 5.617,38 4.422,39 4.509,40 6.366,41 4.438,42 5.389,43 5.619,44 4.439,45 4.544,46 6.458,47 4.467,48 5.385,49 5.62,50 4.329,51 4.536,52 6.356,53 4.429,54 5.394,55 5.667,56 4.143,57 4.438,58 6.282,59 4.304,60 5.234,61 5.514,62 4.063,63 4.312,64 6.074,65 4.179,66 0.038,67 1.135,68 17.559,69 6.729,70 5.2}
{0 CHEMBL2005475,1 5.939,2 5.692,3 0.071,4 0.138,5 0.278,7 3.615,8 3.615,11 1.543,12 10.75,13 4.693,14 22.027,15 99.096,16 7.544,17 0.556,18 3.903,19 4.024,20 3.541,21 3.537,22 4.906,23 3.469,24 4.463,25 4.63,26 3.929,27 3.968,28 5.411,29 3.862,30 4.747,31 4.985,32 3.924,33 4.023,34 5.604,35 3.88,36 4.731,37 4.997,38 3.716,39 3.893,40 5.606,41 3.747,42 4.567,43 4.822,44 3.733,45 3.802,46 5.537,47 3.666,48 4.408,49 4.615,50 3.693,51 3.733,52 5.466,53 3.591,54 4.257,55 4.431,56 3.53,57 3.628,58 5.334,59 3.475,60 4.189,61 4.381,62 3.31,63 3.499,64 5.209,65 3.358,66 0.062,67 0.67,68 9.927,69 4.461,70 5.2}
{0 CHEMBL2005528,1 12.088,2 10.17,3 0.04,4 -0.047,5 0.289,7 3.586,8 3.586,9 4.99,10 1,11 1.609,12 7.737,13 1.902,14 3.617,15 70.084,16 7.827,17 0.476,18 3.623,19 3.728,20 3.227,21 3.151,22 4.759,23 3.155,24 4.164,25 4.314,26 3.608,27 3.548,28 5.353,29 3.532,30 4.372,31 4.559,32 3.66,33 3.642,34 5.526,35 3.611,36 4.344,37 4.508,38 3.533,39 3.555,40 5.588,41 3.527,42 4.203,43 4.391,44 3.288,45 3.392,46 5.379,47 3.33,48 4.1,49 4.307,50 3.186,51 3.223,52 5.272,53 3.156,54 3.973,55 4.213,56 2.803,57 2.937,58 5.027,59 2.852,60 3.649,61 3.849,62 2.687,63 2.637,64 5.144,65 2.574,66 0.064,67 0.479,68 6.199,69 2.961,70 5.2}
{0 CHEMBL2005548,1 26.945,2 38.992,3 0.014,4 -0.035,5 0.899,6 0.262,7 4.154,8 4.154,9 5.361,10 1,11 1.794,12 13.879,13 4.386,14 19.233,15 128.448,16 9.196,17 0.444,18 4.091,19 4.188,20 3.824,21 3.66,22 5.296,23 3.658,24 4.593,25 4.732,26 4.247,27 4.023,28 5.846,29 4.016,30 4.836,31 4.98,32 4.3,33 4.151,34 6.164,35 4.105,36 4.93,37 5.152,38 4.31,39 4.094,40 6.136,41 4.034,42 4.762,43 4.936,44 4.067,45 3.956,46 6.074,47 3.947,48 4.686,49 4.841,50 4.134,51 4.024,52 5.982,53 4.002,54 4.707,55 4.85,56 4.14,57 4.034,58 6.05,59 3.979,60 4.731,61 4.944,62 3.996,63 3.892,64 5.999,65 3.817,66 0.164,67 0.762,68 7.081,69 4.447,70 5.2}
{0 CHEMBL2005631,1 21.624,2 25.287,3 0.087,4 0.035,5 0.603,7 3.891,8 3.891,11 1.776,12 13.313,13 3.445,14 11.867,15 124.504,16 8.645,17 0.629,18 4.065,19 4.179,20 3.78,21 3.665,22 5.306,23 3.643,24 4.533,25 4.678,26 4.161,27 4.052,28 5.8,29 4.009,30 4.75,31 4.906,32 4.266,33 4.172,34 6.034,35 4.124,36 4.855,37 5.032,38 4.325,39 4.17,40 6.147,41 4.112,42 4.817,43 5.005,44 4.162,45 4.098,46 6.165,47 4.019,48 4.739,49 4.949,50 3.935,51 3.97,52 5.999,53 3.893,54 4.605,55 4.804,56 3.798,57 3.854,58 5.825,59 3.789,60 4.569,61 4.793,62 3.738,63 3.792,64 5.769,65 3.708,66 0.115,67 0.862,68 8.544,69 4.433,70 5.2}
{0 CHEMBL2005792,1 14.925,2 19.518,3 -0.019,4 -0.245,5 0.447,7 3.791,8 3.791,9 5.376,10 1,11 1.687,12 10.806,13 3.821,14 14.6,15 115.489,16 7.824,17 0.647,18 4.105,19 4.224,20 3.707,21 3.589,22 5.287,23 3.599,24 4.62,25 4.796,26 4.083,27 3.972,28 5.771,29 3.97,30 4.831,31 5.016,32 4.173,33 4.124,34 5.993,35 4.093,36 5.027,37 5.285,38 4.122,39 4.12,40 6.086,41 4.079,42 4.837,43 5.053,44 4.146,45 4.124,46 5.895,47 4.093,48 4.88,49 5.079,50 4.206,51 4.163,52 6.094,53 4.134,54 4.887,55 5.085,56 4.109,57 4.135,58 6.006,59 4.084,60 4.892,61 5.123,62 3.943,63 4.015,64 6.011,65 3.935,66 0.101,67 0.903,68 10.266,69 4.498,70 5.2}
{0 CHEMBL2005828,1 17.311,2 22.301,3 0.057,4 -0.04,5 0.404,7 3.679,8 3.679,11 1.606,12 12.444,13 2.904,14 8.435,15 103.173,16 8.169,17 0.733,18 3.913,19 4.029,20 3.555,21 3.462,22 5.137,23 3.472,24 4.368,25 4.51,26 3.914,27 3.838,28 5.607,29 3.824,30 4.559,31 4.728,32 3.915,33 3.931,34 5.712,35 3.896,36 4.643,37 4.849,38 3.864,39 3.878,40 5.824,41 3.824,42 4.594,43 4.815,44 3.697,45 3.727,46 5.765,47 3.68,48 4.371,49 4.583,50 3.537,51 3.574,52 5.539,53 3.536,54 4.251,55 4.472,56 3.415,57 3.529,58 5.325,59 3.452,60 4.217,61 4.435,62 3.314,63 3.436,64 5.328,65 3.354,66 0.077,67 0.681,68 7.505,69 3.433,70 5.2}
{0 CHEMBL2005886,1 32.179,2 47.172,3 0.035,4 -0.125,5 0.632,6 0.765,7 3.926,8 3.926,9 5.47,10 1,11 1.662,12 12.971,13 2.385,14 5.69,15 133.134,16 8,17 0.421,18 4.213,19 4.329,20 3.837,21 3.742,22 5.311,23 3.735,24 4.756,25 4.916,26 4.225,27 4.152,28 5.84,29 4.125,30 5.012,31 5.205,32 4.295,33 4.304,34 6.083,35 4.244,36 5.067,37 5.279,38 4.278,39 4.307,40 6.157,41 4.224,42 5.094,43 5.323,44 4.234,45 4.276,46 6.136,47 4.198,48 5.051,49 5.274,50 4.17,51 4.258,52 6.055,53 4.177,54 5.032,55 5.254,56 4.188,57 4.214,58 6.19,59 4.142,60 4.968,61 5.195,62 4.066,63 4.128,64 6.044,65 4.047,66 0.095,67 0.901,68 11.479,69 5.166,70 5.2}
{0 CHEMBL2005899,1 16.136,2 23.584,3 -0.024,4 -0.233,5 0.392,7 3.559,8 3.559,11 1.568,12 7.913,13 0.937,14 0.878,15 87.641,16 7.168,17 0.25,18 3.854,19 3.975,20 3.366,21 3.351,22 5.021,23 3.329,24 4.358,25 4.557,26 3.725,27 3.675,28 5.466,29 3.648,30 4.6,31 4.782,32 3.824,33 3.863,34 5.865,35 3.808,36 4.821,37 5.085,38 3.808,39 3.952,40 5.861,41 3.854,42 4.748,43 4.966,44 3.917,45 3.918,46 6.025,47 3.866,48 4.707,49 4.879,50 3.833,51 3.809,52 6.142,53 3.781,54 4.669,55 4.879,56 3.542,57 3.665,58 5.973,59 3.608,60 4.495,61 4.702,62 3.264,63 3.615,64 5.69,65 3.483,66 0.039,67 0.63,68 9.283,69 3.96,70 5.2}
{0 CHEMBL2005936,1 16.433,2 24.041,3 0.035,4 0.145,5 0.384,7 4.262,8 4.262,11 1.486,12 12.152,13 5.502,14 30.268,15 130.225,16 7.659,17 0.73,18 4.149,19 4.276,20 3.752,21 3.734,22 5.282,23 3.712,24 4.645,25 4.809,26 4.094,27 4.119,28 5.716,29 4.075,30 4.879,31 5.089,32 4.123,33 4.201,34 5.9,35 4.137,36 4.922,37 5.147,38 4.157,39 4.177,40 5.979,41 4.128,42 4.892,43 5.098,44 4.195,45 4.197,46 6.019,47 4.166,48 4.909,49 5.113,50 4.188,51 4.274,52 5.97,53 4.214,54 4.954,55 5.167,56 4.146,57 4.303,58 5.981,59 4.216,60 4.945,61 5.169,62 4.018,63 4.261,64 5.928,65 4.147,66 0.102,67 0.884,68 10.842,69 4.872,70 5.3}
{0 CHEMBL2006010,1 18.345,2 25.308,3 0.033,4 -0.094,5 0.968,7 3.869,8 3.869,11 2.064,12 10.385,13 4.797,14 23.014,15 89.78,16 11.463,17 0.607,18 3.72,19 3.808,20 3.614,21 3.297,22 5.068,23 3.337,24 4.221,25 4.325,26 4.11,27 3.661,28 6.102,29 3.696,30 4.409,31 4.553,32 4.256,33 3.775,34 5.952,35 3.786,36 4.383,37 4.537,38 4.068,39 3.657,40 5.906,41 3.679,42 4.341,43 4.506,44 3.948,45 3.517,46 5.922,47 3.549,48 4.233,49 4.408,50 3.729,51 3.355,52 5.754,53 3.38,54 4.036,55 4.177,56 3.769,57 3.251,58 6.001,59 3.285,60 3.893,61 4.046,62 3.578,63 3.262,64 5.37,65 3.26,66 0.316,67 0.742,68 1.038,69 2.604,70 5.2}
{0 CHEMBL2006156,1 15.508,2 24.392,3 -0.024,4 -0.237,5 0.715,7 3.886,8 3.886,11 1.554,12 10.5,13 4.753,14 22.593,15 111.645,16 7.491,17 0.636,18 4.092,19 4.205,20 3.668,21 3.608,22 5.216,23 3.602,24 4.615,25 4.785,26 4.046,27 3.969,28 5.71,29 3.954,30 4.829,31 5.039,32 4.069,33 4.072,34 5.875,35 4.035,36 4.905,37 5.112,38 4.178,39 4.139,40 6.058,41 4.105,42 5.011,43 5.218,44 4.09,45 4.18,46 6.161,47 4.125,48 4.98,49 5.233,50 4.034,51 4.161,52 5.937,53 4.075,54 4.789,55 4.973,56 3.868,57 4.104,58 5.823,59 3.995,60 4.817,61 5.092,62 3.61,63 3.905,64 5.676,65 3.751,66 0.029,67 0.789,68 10.824,69 4.794,70 5.4}
{0 CHEMBL2006188,1 22.508,2 34,3 0.034,4 -0.017,5 0.401,6 0.4,7 3.724,8 3.724,9 5.287,10 1,11 1.468,12 11.633,13 2.393,14 5.725,15 121.018,16 6.975,17 0.563,18 4.128,19 4.261,20 3.626,21 3.659,22 5.233,23 3.626,24 4.634,25 4.818,26 3.92,27 4.021,28 5.672,29 3.96,30 4.878,31 5.099,32 4.008,33 4.171,34 5.859,35 4.086,36 4.946,37 5.167,38 4.009,39 4.192,40 5.996,41 4.092,42 5.013,43 5.253,44 3.982,45 4.198,46 6.013,47 4.091,48 4.962,49 5.189,50 3.959,51 4.173,52 5.958,53 4.07,54 4.972,55 5.212,56 3.954,57 4.161,58 6.014,59 4.051,60 4.996,61 5.256,62 3.883,63 4.131,64 6.014,65 4.004,66 0.055,67 0.832,68 12.691,69 5.19,70 5.2}
{0 CHEMBL2006237,1 21.255,2 31.619,3 0.005,4 -0.256,5 0.448,6 0.4,7 3.786,8 3.786,11 1.517,12 13.345,13 2.057,14 4.231,15 115.076,16 7.028,17 0.5,18 4.123,19 4.271,20 3.642,21 3.598,22 5.171,23 3.582,24 4.677,25 4.887,26 3.986,27 3.994,28 5.698,29 3.951,30 4.926,31 5.167,32 4.001,33 4.138,34 5.866,35 4.051,36 5,37 5.273,38 3.917,39 4.11,40 5.924,41 3.99,42 4.928,43 5.221,44 3.801,45 3.991,46 5.825,47 3.868,48 4.75,49 5.018,50 3.669,51 3.888,52 5.637,53 3.776,54 4.705,55 4.983,56 3.656,57 3.846,58 5.619,59 3.731,60 4.624,61 4.877,62 3.604,63 3.787,64 5.569,65 3.685,66 0.045,67 0.899,68 12.627,69 4.37,70 5.2}
{0 CHEMBL2006263,1 12.483,2 8.394,3 0.063,4 -0.056,5 0.402,7 4.42,8 4.42,11 1.747,12 9.957,13 2.073,14 4.297,15 89.947,16 8.421,17 0.68,18 3.777,19 3.881,20 3.619,21 3.387,22 4.912,23 3.345,24 4.272,25 4.414,26 3.911,27 3.741,28 5.669,29 3.696,30 4.48,31 4.644,32 3.974,33 3.858,34 5.763,35 3.794,36 4.552,37 4.746,38 3.812,39 3.798,40 5.817,41 3.7,42 4.465,43 4.682,44 3.674,45 3.656,46 5.646,47 3.56,48 4.234,49 4.415,50 3.578,51 3.527,52 5.621,53 3.432,54 4.226,55 4.452,56 3.401,57 3.423,58 5.441,59 3.317,60 4.017,61 4.245,62 3.272,63 3.268,64 5.155,65 3.175,66 0.105,67 0.624,68 9.422,69 3.645,70 5.2}
{0 CHEMBL2006276,1 26.994,2 48.592,3 0.041,4 -0.078,5 0.353,6 0.4,7 3.896,8 3.896,9 5.408,10 1,11 1.584,12 9.48,13 2.718,14 7.387,15 94.534,16 8.107,17 0.643,18 3.846,19 3.958,20 3.488,21 3.402,22 5.036,23 3.409,24 4.315,25 4.452,26 3.835,27 3.769,28 5.486,29 3.762,30 4.57,31 4.735,32 3.984,33 3.936,34 5.718,35 3.918,36 4.646,37 4.838,38 3.903,39 3.917,40 5.811,41 3.873,42 4.633,43 4.841,44 3.776,45 3.889,46 5.718,47 3.826,48 4.514,49 4.728,50 3.653,51 3.766,52 5.623,53 3.681,54 4.411,55 4.641,56 3.451,57 3.603,58 5.444,59 3.511,60 4.207,61 4.432,62 3.268,63 3.382,64 5.298,65 3.308,66 0.059,67 0.621,68 7.082,69 3.284,70 5.2}
{0 CHEMBL2006439,1 11.088,2 19.407,3 0.024,4 -0.166,5 0.245,7 3.816,8 3.816,11 1.549,12 9.217,13 4.262,14 18.165,15 93.388,16 7.996,17 0.615,18 3.831,19 3.961,20 3.471,21 3.403,22 4.864,23 3.377,24 4.386,25 4.564,26 3.861,27 3.82,28 5.409,29 3.76,30 4.667,31 4.917,32 3.83,33 3.91,34 5.531,35 3.807,36 4.605,37 4.866,38 3.814,39 3.801,40 5.527,41 3.702,42 4.47,43 4.72,44 3.736,45 3.705,46 5.439,47 3.618,48 4.343,49 4.551,50 3.83,51 3.675,52 5.41,53 3.597,54 4.285,55 4.478,56 3.645,57 3.639,58 5.33,59 3.513,60 4.204,61 4.419,62 3.333,63 3.523,64 5.083,65 3.365,66 0.02,67 0.652,68 7.805,69 3.4,70 5.6}
{0 CHEMBL2006481,1 8.136,2 8.198,3 0.014,4 0.007,5 0.286,7 3.935,8 3.935,11 1.616,12 9.364,13 2.497,14 6.237,15 82.672,16 7.799,17 0.6,18 3.778,19 3.893,20 3.399,21 3.306,22 4.892,23 3.305,24 4.319,25 4.485,26 3.75,27 3.714,28 5.36,29 3.692,30 4.552,31 4.772,32 3.714,33 3.779,34 5.577,35 3.713,36 4.55,37 4.777,38 3.621,39 3.653,40 5.66,41 3.595,42 4.306,43 4.525,44 3.443,45 3.455,46 5.377,47 3.416,48 4.158,49 4.34,50 3.385,51 3.306,52 5.32,53 3.295,54 4.013,55 4.211,56 3.181,57 3.16,58 5.134,59 3.139,60 3.801,61 3.982,62 2.974,63 3.111,64 4.836,65 3.04,66 0.106,67 0.6,68 7.297,69 3.315,70 5.2}
{0 CHEMBL2006493,1 16.524,2 20.068,3 0.028,4 0.012,5 1.121,7 3.783,8 3.783,9 5.35,10 1,11 1.708,12 7.15,13 2.757,14 7.603,15 65.454,16 9.732,17 0.273,18 3.531,19 3.593,20 3.29,21 3.1,22 4.819,23 3.143,24 4.126,25 4.228,26 3.817,27 3.502,28 5.972,29 3.551,30 4.352,31 4.484,32 3.847,33 3.598,34 5.795,35 3.652,36 4.369,37 4.5,38 3.784,39 3.425,40 6.063,41 3.515,42 4.116,43 4.239,44 3.475,45 3.192,46 5.779,47 3.25,48 3.788,49 3.931,50 3.193,51 2.992,52 5.265,53 3.019,54 3.778,55 3.953,56 3.168,57 2.715,58 5.749,59 2.772,60 3.525,61 3.78,62 2.658,63 2.188,64 5.043,65 2.304,66 0.268,67 0.6,68 2.614,69 3.026,70 5.2}
{0 CHEMBL2006567,1 11.616,2 15.684,3 0.095,4 0.071,5 0.209,7 3.441,8 3.441,11 1.799,12 6.5,13 1.08,14 1.167,15 71.456,16 9.226,17 0.579,18 3.444,19 3.553,20 3.241,21 3.086,22 4.768,23 3.048,24 3.86,25 3.996,26 3.541,27 3.408,28 5.141,29 3.353,30 4.026,31 4.187,32 3.483,33 3.403,34 5.353,35 3.375,36 4.043,37 4.232,38 3.61,39 3.416,40 5.506,41 3.38,42 4.021,43 4.194,44 3.521,45 3.421,46 5.4,47 3.354,48 3.984,49 4.182,50 3.457,51 3.271,52 5.394,53 3.17,54 3.843,55 4.076,56 2.77,57 2.997,58 5.094,59 2.811,60 3.441,61 3.691,62 2.609,63 2.495,64 4.932,65 2.33,66 0.065,67 0.445,68 4.031,69 2.246,70 5.2}
{0 CHEMBL2006580,1 13.245,2 20.57,3 0.078,4 -0.032,5 0.227,7 3.62,8 3.62,11 1.94,12 7.389,13 3.459,14 11.963,15 73.29,16 10.683,17 0.8,18 3.424,19 3.503,20 3.344,21 3.111,22 4.686,23 3.077,24 3.841,25 3.937,26 3.738,27 3.475,28 5.12,29 3.424,30 4.011,31 4.147,32 3.825,33 3.493,34 5.254,35 3.418,36 3.965,37 4.148,38 3.617,39 3.291,40 5.185,41 3.227,42 3.781,43 3.979,44 3.28,45 3.21,46 4.883,47 3.099,48 3.62,49 3.76,50 3.32,51 3.175,52 4.822,53 3.075,54 3.621,55 3.777,56 3.208,57 3.083,58 4.843,59 2.921,60 3.272,61 3.458,62 2.678,63 2.538,64 4.471,65 2.383,66 0.095,67 0.385,68 2.09,69 1.967,70 5.2}
{0 CHEMBL2006581,1 16.638,2 15.513,3 0.074,4 -0.008,5 1,7 4.114,8 4.114,9 5.236,10 1,11 1.962,12 9.72,13 1.517,14 2.301,15 95.991,16 9.164,17 0.462,18 3.85,19 3.948,20 3.718,21 3.39,22 5.048,23 3.366,24 4.347,25 4.478,26 3.987,27 3.725,28 5.856,29 3.696,30 4.558,31 4.713,32 4.151,33 3.841,34 5.931,35 3.803,36 4.575,37 4.726,38 4.029,39 3.811,40 5.937,41 3.764,42 4.639,43 4.825,44 3.902,45 3.739,46 6.073,47 3.686,48 4.522,49 4.727,50 3.794,51 3.636,52 5.821,53 3.567,54 4.392,55 4.589,56 3.688,57 3.517,58 5.921,59 3.46,60 4.296,61 4.51,62 3.586,63 3.466,64 5.605,65 3.379,66 0.192,67 0.641,68 8.825,69 3.833,70 5.2}
{0 CHEMBL2006715,1 30.521,2 47.849,3 0.018,4 -0.125,5 0.797,6 0.4,7 4.103,8 4.103,11 1.772,12 15.364,13 6.348,14 40.302,15 162.495,16 9.07,17 0.66,18 4.347,19 4.448,20 4.108,21 3.957,22 5.569,23 3.954,24 4.851,25 4.983,26 4.515,27 4.347,28 6.099,29 4.336,30 5.095,31 5.277,32 4.533,33 4.425,34 6.325,35 4.406,36 5.088,37 5.262,38 4.576,39 4.39,40 6.607,41 4.383,42 5.094,43 5.267,44 4.553,45 4.465,46 6.329,47 4.432,48 5.125,49 5.308,50 4.566,51 4.505,52 6.325,53 4.445,54 5.127,55 5.322,56 4.497,57 4.44,58 6.314,59 4.381,60 5.056,61 5.263,62 4.416,63 4.356,64 6.251,65 4.308,66 0.151,67 1.176,68 8.916,69 5.554,70 5.9}
{0 CHEMBL2006778,1 11.573,2 7.825,3 0.095,4 0.058,5 0.243,7 4.516,8 4.516,11 1.734,12 10.519,13 3.173,14 10.065,15 109.275,16 8.647,17 0.667,18 3.905,19 4.018,20 3.635,21 3.536,22 5.118,23 3.504,24 4.382,25 4.528,26 4.029,27 3.938,28 5.594,29 3.889,30 4.566,31 4.72,32 4.106,33 4.047,34 5.808,35 3.983,36 4.669,37 4.847,38 4.126,39 4.072,40 5.878,41 3.985,42 4.588,43 4.774,44 3.949,45 3.981,46 5.753,47 3.872,48 4.554,49 4.747,50 4.041,51 3.868,52 5.833,53 3.808,54 4.455,55 4.649,56 3.893,57 3.788,58 5.733,59 3.71,60 4.41,61 4.623,62 3.609,63 3.661,64 5.651,65 3.557,66 0.077,67 0.732,68 7.32,69 3.818,70 5.2}
{0 CHEMBL2006785,1 13.727,2 14.03,3 0.054,4 0.072,5 0.338,7 3.759,8 3.759,11 1.811,12 8.783,13 5.462,14 29.831,15 94.863,16 10.947,17 0.64,18 3.613,19 3.68,20 3.553,21 3.393,22 4.886,23 3.336,24 4.07,25 4.161,26 3.998,27 3.8,28 5.309,29 3.716,30 4.293,31 4.397,32 4.23,33 3.9,34 5.623,35 3.809,36 4.337,37 4.486,38 4.103,39 3.806,40 5.665,41 3.7,42 4.169,43 4.322,44 4.003,45 3.614,46 5.592,47 3.546,48 3.962,49 4.062,50 3.878,51 3.521,52 5.676,53 3.475,54 3.956,55 4.068,56 3.752,57 3.498,58 5.494,59 3.406,60 3.829,61 3.978,62 3.448,63 3.375,64 5.097,65 3.23,66 0.06,67 0.377,68 1.78,69 2.114,70 5.2}
{0 CHEMBL2006836,1 21.746,2 23.266,3 0.039,4 -0.032,5 0.724,7 4.339,8 4.339,11 1.649,12 12.294,13 4.247,14 18.035,15 123.06,16 8.852,17 0.553,18 4.073,19 4.161,20 3.777,21 3.661,22 5.388,23 3.678,24 4.542,25 4.662,26 4.197,27 4.056,28 5.873,29 4.068,30 4.768,31 4.901,32 4.332,33 4.198,34 6.118,35 4.214,36 4.91,37 5.062,38 4.323,39 4.233,40 6.307,41 4.235,42 4.897,43 5.066,44 4.224,45 4.18,46 6.257,47 4.175,48 4.823,49 4.976,50 4.221,51 4.156,52 6.28,53 4.129,54 4.851,55 5.04,56 4.07,57 4.089,58 6.157,59 4.05,60 4.793,61 5.009,62 4.061,63 3.981,64 6.224,65 3.942,66 0.16,67 0.746,68 6.838,69 4.1,70 5.2}
{0 CHEMBL2006933,1 3.337,2 1.827,3 0.059,4 -0.022,5 0.232,7 3.919,8 3.919,11 1.669,12 6.706,13 2.049,14 4.196,15 68.873,16 8.975,17 0.842,18 3.429,19 3.513,20 3.227,21 3.129,22 4.637,23 3.076,24 3.871,25 3.992,26 3.546,27 3.502,28 4.999,29 3.433,30 4.033,31 4.148,32 3.722,33 3.592,34 5.247,35 3.542,36 4.106,37 4.26,38 3.521,39 3.514,40 5.34,41 3.43,42 4.061,43 4.28,44 3.205,45 3.326,46 5.151,47 3.193,48 3.697,49 3.917,50 2.857,51 2.997,52 4.703,53 2.812,54 3.398,55 3.644,56 2.533,57 2.622,58 4.429,59 2.399,60 2.912,61 3.166,62 1.986,63 2.187,64 3.668,65 1.934,66 0.029,67 0.362,68 4.206,69 2.366,70 5.5}
{0 CHEMBL2007002,1 12.596,2 15.484,3 0.066,4 0.127,5 0.367,7 3.962,8 3.962,9 5.175,10 1,11 1.568,12 10.778,13 3.922,14 15.379,15 102.25,16 8.168,17 0.733,18 3.91,19 4.01,20 3.551,21 3.487,22 5.14,23 3.489,24 4.364,25 4.488,26 3.899,27 3.856,28 5.57,29 3.845,30 4.575,31 4.727,32 3.968,33 3.955,34 5.824,35 3.923,36 4.633,37 4.817,38 3.878,39 3.906,40 5.833,41 3.861,42 4.597,43 4.797,44 3.775,45 3.837,46 5.765,47 3.788,48 4.492,49 4.676,50 3.793,51 3.783,52 5.686,53 3.753,54 4.456,55 4.634,56 3.703,57 3.735,58 5.648,59 3.698,60 4.436,61 4.654,62 3.563,63 3.631,64 5.55,65 3.565,66 0.097,67 0.621,68 7.479,69 3.768,70 5.2}
{0 CHEMBL2007044,1 20.724,2 21.796,3 0.014,4 -0.029,5 0.204,6 0.249,7 3.872,8 3.872,11 1.372,12 12.679,13 4.694,14 22.031,15 113.013,16 7.5,17 0.548,18 3.981,19 4.106,20 3.569,21 3.59,22 5.11,23 3.558,24 4.5,25 4.688,26 3.899,27 3.973,28 5.506,29 3.922,30 4.681,31 4.886,32 3.947,33 4.094,34 5.697,35 4.014,36 4.753,37 4.98,38 3.844,39 4.082,40 5.755,41 3.971,42 4.733,43 5.001,44 3.729,45 3.965,46 5.66,47 3.843,48 4.503,49 4.745,50 3.643,51 3.825,52 5.462,53 3.731,54 4.355,55 4.543,56 3.617,57 3.797,58 5.414,59 3.707,60 4.479,61 4.706,62 3.533,63 3.792,64 5.463,65 3.669,66 0.059,67 0.729,68 9.376,69 4.147,70 5.2}
{0 CHEMBL2007064,1 14.447,2 15.203,3 0.072,4 0.055,5 0.291,7 4.051,8 4.051,11 1.531,12 9.304,13 2.843,14 8.084,15 88.378,16 7.57,17 0.44,18 3.811,19 3.922,20 3.375,21 3.375,22 4.983,23 3.357,24 4.315,25 4.47,26 3.761,27 3.771,28 5.542,29 3.73,30 4.528,31 4.703,32 3.761,33 3.878,34 5.655,35 3.817,36 4.63,37 4.833,38 3.664,39 3.894,40 5.687,41 3.794,42 4.645,43 4.887,44 3.667,45 3.814,46 5.711,47 3.715,48 4.611,49 4.853,50 3.699,51 3.721,52 5.792,53 3.658,54 4.467,55 4.654,56 3.372,57 3.593,58 5.706,59 3.514,60 4.342,61 4.587,62 3.064,63 3.446,64 5.352,65 3.301,66 0.057,67 0.571,68 8.029,69 3.754,70 5.2}
{0 CHEMBL2007151,1 27.304,2 30.322,3 0.025,4 -0.131,5 0.394,7 3.716,8 3.716,9 6.146,10 1,11 1.384,12 13.444,13 5.394,14 29.096,15 146.706,16 6.785,17 0.537,18 4.353,19 4.484,20 3.86,21 3.908,22 5.325,23 3.868,24 4.937,25 5.126,26 4.234,27 4.342,28 5.829,29 4.275,30 5.23,31 5.464,32 4.296,33 4.507,34 6.027,35 4.405,36 5.313,37 5.556,38 4.325,39 4.568,40 6.116,41 4.45,42 5.38,43 5.628,44 4.318,45 4.619,46 6.179,47 4.487,48 5.416,49 5.683,50 4.263,51 4.589,52 6.223,53 4.442,54 5.338,55 5.617,56 4.184,57 4.471,58 6.155,59 4.329,60 5.185,61 5.445,62 4.083,63 4.383,64 5.982,65 4.253,66 0.073,67 1.059,68 16.33,69 6.653,70 5.2}
{0 CHEMBL2007296,1 14.099,2 19.218,3 0.011,4 -0.064,5 0.299,7 3.725,8 3.725,9 5.674,10 1,11 1.396,12 12.889,13 4.223,14 17.834,15 107.281,16 7.068,17 0.621,18 3.996,19 4.113,20 3.517,21 3.58,22 5.088,23 3.539,24 4.503,25 4.673,26 3.817,27 3.93,28 5.553,29 3.866,30 4.75,31 4.959,32 3.869,33 4.049,34 5.752,35 3.961,36 4.769,37 4.98,38 3.797,39 4.022,40 5.809,41 3.92,42 4.777,43 5.006,44 3.742,45 4.004,46 5.792,47 3.886,48 4.719,49 4.954,50 3.624,51 3.936,52 5.674,53 3.805,54 4.64,55 4.893,56 3.563,57 3.825,58 5.637,59 3.693,60 4.546,61 4.799,62 3.45,63 3.707,64 5.52,65 3.583,66 0.033,67 0.676,68 10.659,69 4.848,70 5.2}
{0 CHEMBL2007372,1 16.936,2 24.867,3 -0.003,4 -0.236,5 0.391,7 3.791,8 3.791,11 1.64,12 10.806,13 3.646,14 13.294,15 119.22,16 7.664,17 0.647,18 4.117,19 4.249,20 3.701,21 3.605,22 5.281,23 3.607,24 4.631,25 4.82,26 4.079,27 3.994,28 5.759,29 3.982,30 4.864,31 5.064,32 4.167,33 4.147,34 5.994,35 4.106,36 5.043,37 5.308,38 4.119,39 4.143,40 6.087,41 4.093,42 4.862,43 5.086,44 4.144,45 4.151,46 5.901,47 4.109,48 4.896,49 5.105,50 4.198,51 4.187,52 6.083,53 4.146,54 4.908,55 5.12,56 4.103,57 4.17,58 6.002,59 4.104,60 4.932,61 5.18,62 3.938,63 4.06,64 6.012,65 3.962,66 0.084,67 0.944,68 10.867,69 4.402,70 5.2}
{0 CHEMBL2007592,1 15.889,2 20.315,3 0.046,4 0.013,5 0.219,7 3.979,8 3.979,11 1.675,12 8.391,13 4.037,14 16.3,15 88.206,16 8.714,17 0.593,18 3.768,19 3.871,20 3.538,21 3.424,22 4.849,23 3.388,24 4.315,25 4.455,26 3.99,27 3.87,28 5.401,29 3.806,30 4.542,31 4.732,32 4.011,33 3.958,34 5.584,35 3.861,36 4.494,37 4.682,38 3.996,39 3.84,40 5.591,41 3.766,42 4.307,43 4.502,44 3.744,45 3.636,46 5.366,47 3.593,48 4.245,49 4.445,50 3.566,51 3.56,52 5.332,53 3.518,54 4.216,55 4.402,56 3.457,57 3.503,58 5.406,59 3.422,60 3.971,61 4.144,62 3.145,63 3.342,64 5.064,65 3.192,66 0.049,67 0.589,68 6.052,69 3.23,70 5.2}
{0 CHEMBL207253,1 16.228,2 20.445,3 -0.032,4 -0.077,5 0.577,7 3.873,8 3.873,9 5.845,10 1,11 1.713,12 7,13 3.6,14 12.96,15 82.083,16 8.265,17 0.478,18 3.73,19 3.841,20 3.391,21 3.26,22 4.841,23 3.244,24 4.271,25 4.446,26 3.8,27 3.635,28 5.337,29 3.621,30 4.455,31 4.631,32 3.938,33 3.736,34 5.605,35 3.734,36 4.51,37 4.669,38 3.966,39 3.746,40 5.759,41 3.753,42 4.484,43 4.636,44 3.87,45 3.761,46 5.743,47 3.722,48 4.565,49 4.781,50 3.647,51 3.786,52 5.555,53 3.657,54 4.479,55 4.739,56 3.41,57 3.631,58 5.383,59 3.427,60 4.323,61 4.634,62 2.712,63 3.272,64 5.142,65 2.955,66 0.105,67 0.545,68 6.669,69 3.299,70 5.2}
{0 CHEMBL207400,1 16.962,2 22.451,3 0.03,4 -0.032,5 1.335,7 3.918,8 3.918,11 2.158,12 6.524,13 3.407,14 11.609,15 69.07,16 11.345,17 0.478,18 3.542,19 3.621,20 3.414,21 3.04,22 4.926,23 3.11,24 4.078,25 4.191,26 3.956,27 3.442,28 5.994,29 3.533,30 4.227,31 4.334,32 4.022,33 3.559,34 5.837,35 3.641,36 4.348,37 4.46,38 4.08,39 3.515,40 6.023,41 3.634,42 4.305,43 4.42,44 4.006,45 3.335,46 6.321,47 3.45,48 4.203,49 4.39,50 3.647,51 3.066,52 6.096,53 3.148,54 3.651,55 3.851,56 3.192,57 2.593,58 5.286,59 2.637,60 3.233,61 3.444,62 3.156,63 1.965,64 5.258,65 2.095,66 0.37,67 0.659,68 1.088,69 2.35,70 5.2}
{0 CHEMBL207995,1 19.839,2 25.162,3 -0.016,4 -0.256,5 0.792,6 0.247,7 3.698,8 3.698,9 5.1,10 1,11 1.927,12 10.696,13 1.476,14 2.177,15 81.716,16 10.053,17 0.5,18 3.631,19 3.723,20 3.423,21 3.144,22 5.037,23 3.19,24 4.059,25 4.184,26 3.757,27 3.453,28 5.458,29 3.486,30 4.224,31 4.352,32 3.88,33 3.574,34 5.674,35 3.593,36 4.281,37 4.428,38 3.844,39 3.486,40 5.801,41 3.502,42 4.239,43 4.41,44 3.693,45 3.348,46 5.746,47 3.365,48 4.096,49 4.275,50 3.614,51 3.272,52 5.557,53 3.271,54 4.043,55 4.216,56 3.37,57 3.19,58 5.478,59 3.18,60 3.809,61 3.961,62 3.423,63 3.056,64 5.548,65 3.069,66 0.186,67 0.508,68 2.894,69 2.319,70 5.4}
{0 CHEMBL208637,1 15.702,2 22.096,3 -0.006,4 -0.174,5 0.34,6 0.149,7 3.04,8 3.04,9 5.166,10 1,11 1.727,12 6.375,13 0.343,14 0.117,15 59.26,16 7.866,17 0.375,18 3.424,19 3.553,20 2.998,21 2.848,22 4.736,23 2.871,24 3.878,25 4.059,26 3.299,27 3.115,28 5.152,29 3.124,30 4.03,31 4.216,32 3.347,33 3.172,34 5.353,35 3.207,36 3.975,37 4.164,38 3.395,39 3.165,40 5.525,41 3.167,42 3.983,43 4.181,44 3.096,45 3.12,46 5.269,47 3.096,48 3.923,49 4.141,50 2.979,51 3.024,52 5.335,53 2.942,54 3.883,55 4.156,56 2.389,57 2.771,58 5.104,59 2.637,60 3.551,61 3.882,62 1.992,63 2.352,64 4.836,65 2.144,66 0.089,67 0.411,68 5.242,69 1.99,70 5.163}
{0 CHEMBL209534,1 16.608,2 17.782,3 0.012,4 -0.129,5 0.497,6 0.473,7 3.453,8 3.453,9 5.259,10 1,11 1.674,12 9.455,13 0.753,14 0.567,15 81.425,16 8.036,17 0.522,18 3.71,19 3.831,20 3.319,21 3.205,22 4.992,23 3.218,24 4.17,25 4.337,26 3.612,27 3.514,28 5.394,29 3.509,30 4.36,31 4.547,32 3.705,33 3.596,34 5.639,35 3.588,36 4.374,37 4.579,38 3.655,39 3.523,40 5.776,41 3.514,42 4.307,43 4.503,44 3.55,45 3.482,46 5.692,47 3.459,48 4.266,49 4.46,50 3.432,51 3.438,52 5.623,53 3.4,54 4.248,55 4.479,56 3.277,57 3.33,58 5.63,59 3.272,60 4.1,61 4.363,62 3.052,63 3.192,64 5.171,65 3.106,66 0.082,67 0.568,68 6.484,69 2.828,70 5.2}
{0 CHEMBL210032,1 11.616,2 15.684,3 0.068,4 0.036,5 0.192,7 3.416,8 3.416,11 1.589,12 7.105,13 1.418,14 2.011,15 72.499,16 8.139,17 0.6,18 3.528,19 3.651,20 3.152,21 3.107,22 4.839,23 3.102,24 3.95,25 4.103,26 3.472,27 3.432,28 5.214,29 3.407,30 4.18,31 4.36,32 3.529,33 3.53,34 5.454,35 3.504,36 4.178,37 4.385,38 3.551,39 3.496,40 5.574,41 3.459,42 4.134,43 4.327,44 3.442,45 3.452,46 5.481,47 3.423,48 4.115,49 4.321,50 3.32,51 3.376,52 5.5,53 3.312,54 4.057,55 4.301,56 2.937,57 3.157,58 5.363,59 3.052,60 3.796,61 4.078,62 2.444,63 2.757,64 5.146,65 2.597,66 0.047,67 0.471,68 5.1,69 2.343,70 5.163}
{0 CHEMBL210618,1 26.42,2 36.102,3 -0.016,4 -0.141,5 0.75,6 0.86,7 3.919,8 3.919,9 15.759,10 3,11 1.665,12 10.385,13 2.009,14 4.036,15 96.908,16 7.748,17 0.444,18 3.923,19 4.033,20 3.498,21 3.371,22 5.173,23 3.389,24 4.41,25 4.573,26 3.8,27 3.68,28 5.588,29 3.685,30 4.551,31 4.707,32 3.915,33 3.805,34 5.788,35 3.817,36 4.636,37 4.807,38 3.946,39 3.849,40 5.994,41 3.828,42 4.72,43 4.923,44 3.812,45 3.836,46 5.943,47 3.786,48 4.671,49 4.897,50 3.766,51 3.746,52 5.956,53 3.685,54 4.612,55 4.837,56 3.546,57 3.62,58 5.829,59 3.574,60 4.452,61 4.683,62 3.509,63 3.548,64 5.68,65 3.486,66 0.11,67 0.65,68 8.842,69 3.866,70 5.163}
{0 CHEMBL210887,1 16.251,2 17.843,3 0.018,4 -0.06,5 0.496,7 4.015,8 4.015,11 1.712,12 9.52,13 2.295,14 5.268,15 91.076,16 8.302,17 0.593,18 3.84,19 3.947,20 3.481,21 3.34,22 5.103,23 3.355,24 4.327,25 4.468,26 3.824,27 3.714,28 5.685,29 3.709,30 4.566,31 4.767,32 3.866,33 3.79,34 5.767,35 3.777,36 4.605,37 4.802,38 3.831,39 3.739,40 5.891,41 3.731,42 4.507,43 4.697,44 3.795,45 3.682,46 5.787,47 3.68,48 4.54,49 4.73,50 3.769,51 3.677,52 6.049,53 3.658,54 4.463,55 4.661,56 3.6,57 3.646,58 5.701,59 3.597,60 4.377,61 4.573,62 3.518,63 3.561,64 5.738,65 3.494,66 0.198,67 0.626,68 6.911,69 3.334,70 5.2}
{0 CHEMBL210928,1 26.813,2 36.242,3 0.003,4 -0.13,5 1.288,6 0.86,7 4.076,8 4.076,9 15.704,10 3,11 1.88,12 11.172,13 2.321,14 5.385,15 109.73,16 8.705,17 0.4,18 4.035,19 4.123,20 3.839,21 3.535,22 5.21,23 3.513,24 4.561,25 4.703,26 4.118,27 3.858,28 5.911,29 3.842,30 4.717,31 4.842,32 4.304,33 3.988,34 6.061,35 3.985,36 4.795,37 4.928,38 4.284,39 4.048,40 6.163,41 4.013,42 4.912,43 5.078,44 4.195,45 4.053,46 6.228,47 3.995,48 4.897,49 5.087,50 4.023,51 3.996,52 6.176,53 3.903,54 4.872,55 5.092,56 3.91,57 3.841,58 6.097,59 3.772,60 4.694,61 4.935,62 3.813,63 3.723,64 6.036,65 3.64,66 0.213,67 0.721,68 11.008,69 5.134,70 5.163}
{0 CHEMBL210963,1 28.424,2 37.912,3 0.003,4 -0.122,5 1.228,6 0.86,7 4.136,8 4.136,9 15.697,10 3,11 1.81,12 11.267,13 1.535,14 2.356,15 110.663,16 8.356,17 0.387,18 4.051,19 4.141,20 3.821,21 3.546,22 5.275,23 3.533,24 4.567,25 4.712,26 4.072,27 3.861,28 5.923,29 3.854,30 4.727,31 4.857,32 4.208,33 3.999,34 6.061,35 4.007,36 4.828,37 4.966,38 4.299,39 4.065,40 6.291,41 4.052,42 4.945,43 5.118,44 4.166,45 4.077,46 6.279,47 4.03,48 4.922,49 5.119,50 4.025,51 4.012,52 6.236,53 3.934,54 4.909,55 5.135,56 3.848,57 3.868,58 6.141,59 3.804,60 4.712,61 4.952,62 3.823,63 3.734,64 6.138,65 3.67,66 0.198,67 0.757,68 11.625,69 5.098,70 5.163}
{0 CHEMBL211378,1 17.311,2 24.218,3 0.059,4 -0.015,5 0.493,7 3.686,8 3.686,11 1.654,12 11.852,13 2.683,14 7.199,15 101.729,16 8.382,17 0.733,18 3.901,19 4.018,20 3.563,21 3.433,22 5.156,23 3.45,24 4.346,25 4.49,26 3.92,27 3.801,28 5.607,29 3.798,30 4.536,31 4.706,32 3.924,33 3.88,34 5.721,35 3.86,36 4.616,37 4.827,38 3.896,39 3.811,40 5.844,41 3.783,42 4.54,43 4.75,44 3.698,45 3.677,46 5.752,47 3.656,48 4.367,49 4.578,50 3.576,51 3.568,52 5.572,53 3.535,54 4.261,55 4.475,56 3.387,57 3.502,58 5.388,59 3.436,60 4.172,61 4.4,62 3.343,63 3.43,64 5.263,65 3.343,66 0.139,67 0.694,68 7.024,69 3.216,70 5.2}
{0 CHEMBL212382,1 9.319,2 7.869,3 -0.022,4 -0.094,5 0.554,7 4.212,8 4.212,11 1.709,12 9.423,13 4.481,14 20.081,15 93.805,16 8.438,17 0.724,18 3.873,19 3.98,20 3.547,21 3.415,22 5.107,23 3.428,24 4.387,25 4.543,26 3.967,27 3.816,28 5.605,29 3.829,30 4.598,31 4.76,32 4.005,33 3.929,34 5.845,35 3.915,36 4.802,37 5.056,38 4.022,39 3.912,40 6.078,41 3.899,42 4.572,43 4.752,44 3.857,45 3.847,46 5.793,47 3.814,48 4.503,49 4.701,50 3.764,51 3.765,52 5.688,53 3.714,54 4.454,55 4.668,56 3.713,57 3.628,58 5.711,59 3.59,60 4.342,61 4.562,62 3.495,63 3.463,64 5.516,65 3.44,66 0.111,67 0.78,68 6.526,69 3.751,70 5}
{0 CHEMBL212968,1 9.894,2 8.143,3 -0.023,4 -0.085,5 0.853,7 4.255,8 4.255,11 1.772,12 9.481,13 4.687,14 21.965,15 94.022,16 8.866,17 0.7,18 3.884,19 3.987,20 3.589,21 3.412,22 5.167,23 3.44,24 4.4,25 4.55,26 4.022,27 3.814,28 5.681,29 3.845,30 4.621,31 4.774,32 4.101,33 3.925,34 6.07,35 3.937,36 4.814,37 5.062,38 4.076,39 3.909,40 6.136,41 3.916,42 4.591,43 4.763,44 3.969,45 3.844,46 6.026,47 3.834,48 4.522,49 4.71,50 3.873,51 3.761,52 5.84,53 3.739,54 4.472,55 4.678,56 3.787,57 3.624,58 5.815,59 3.613,60 4.368,61 4.579,62 3.596,63 3.458,64 5.667,65 3.468,66 0.179,67 0.86,68 5.675,69 3.783,70 5}
{0 CHEMBL213423,1 8.681,2 5.202,3 -0.027,4 -0.088,5 0.85,7 4.25,8 4.25,11 1.8,12 9.385,13 4.27,14 18.231,15 89.521,16 9.188,17 0.724,18 3.823,19 3.921,20 3.556,21 3.353,22 5.128,23 3.39,24 4.328,25 4.469,26 3.966,27 3.735,28 5.641,29 3.774,30 4.529,31 4.697,32 4.043,33 3.808,34 6.004,35 3.842,36 4.611,37 4.813,38 4.013,39 3.788,40 6.047,41 3.823,42 4.494,43 4.662,44 3.916,45 3.744,46 5.966,47 3.748,48 4.425,49 4.607,50 3.821,51 3.658,52 5.786,53 3.653,54 4.369,55 4.571,56 3.723,57 3.516,58 5.755,59 3.522,60 4.241,61 4.451,62 3.494,63 3.333,64 5.578,65 3.349,66 0.199,67 0.823,68 4.626,69 3.432,70 5}
{0 CHEMBL213451,1 9.533,2 13.162,3 -0.02,4 -0.14,5 0.372,7 4.127,8 4.127,11 1.711,12 9.833,13 3.168,14 10.035,15 89.861,16 8.509,17 0.778,18 3.789,19 3.902,20 3.475,21 3.312,22 5.01,23 3.336,24 4.273,25 4.428,26 3.837,27 3.682,28 5.482,29 3.693,30 4.432,31 4.631,32 3.821,33 3.732,34 5.599,35 3.724,36 4.438,37 4.63,38 3.781,39 3.705,40 5.59,41 3.7,42 4.392,43 4.58,44 3.7,45 3.672,46 5.495,47 3.653,48 4.365,49 4.558,50 3.639,51 3.632,52 5.522,53 3.584,54 4.288,55 4.509,56 3.549,57 3.484,58 5.477,59 3.438,60 4.135,61 4.372,62 3.243,63 3.28,64 5.23,65 3.223,66 0.103,67 0.682,68 5.871,69 3.058,70 5}
{0 CHEMBL213505,1 19.34,2 26.901,3 0.07,4 -0.049,5 1.109,7 3.869,8 3.869,11 1.913,12 12.767,13 3.139,14 9.855,15 102.662,16 9.637,17 0.667,18 3.932,19 4.037,20 3.683,21 3.427,22 5.279,23 3.486,24 4.412,25 4.532,26 4.133,27 3.794,28 6.201,29 3.846,30 4.569,31 4.725,32 4.087,33 3.872,34 5.953,35 3.908,36 4.673,37 4.862,38 4.076,39 3.8,40 6.131,41 3.847,42 4.59,43 4.781,44 3.922,45 3.668,46 6.058,47 3.714,48 4.422,49 4.613,50 3.713,51 3.558,52 5.808,53 3.585,54 4.313,55 4.503,56 3.708,57 3.496,58 6.031,59 3.489,60 4.217,61 4.427,62 3.502,63 3.421,64 5.505,65 3.393,66 0.321,67 0.913,68 4.571,69 3.301,70 5.2}
{0 CHEMBL214198,1 8.106,2 4.266,3 0.013,4 0.002,5 0.646,7 4.212,8 4.212,11 1.64,12 8.8,13 4.32,14 18.659,15 92.405,16 8.484,17 0.75,18 3.829,19 3.95,20 3.506,21 3.38,22 5.063,23 3.389,24 4.327,25 4.489,26 3.897,27 3.773,28 5.541,29 3.776,30 4.539,31 4.73,32 3.934,33 3.855,34 5.77,35 3.843,36 4.608,37 4.83,38 3.927,39 3.836,40 5.84,41 3.83,42 4.539,43 4.742,44 3.875,45 3.803,46 5.922,47 3.77,48 4.479,49 4.696,50 3.731,51 3.725,52 5.678,53 3.677,54 4.419,55 4.653,56 3.604,57 3.579,58 5.637,59 3.527,60 4.252,61 4.492,62 3.407,63 3.387,64 5.442,65 3.339,66 0.119,67 0.789,68 6.192,69 3.403,70 5}
{0 CHEMBL215152,1 34.329,2 51.895,3 0.002,4 -0.137,5 0.771,6 0.4,7 3.75,8 3.75,9 5.889,10 1,11 1.681,12 17.459,13 3.771,14 14.22,15 139.919,16 7.577,17 0.55,18 4.307,19 4.435,20 3.872,21 3.771,22 5.458,23 3.774,24 4.827,25 5.009,26 4.192,27 4.127,28 5.96,29 4.108,30 5.066,31 5.289,32 4.202,33 4.231,34 6.134,35 4.185,36 5.098,37 5.335,38 4.193,39 4.241,40 6.171,41 4.167,42 5.13,43 5.377,44 4.134,45 4.209,46 6.206,47 4.136,48 5.077,49 5.331,50 4.092,51 4.138,52 6.191,53 4.06,54 4.929,55 5.166,56 3.994,57 4.054,58 5.984,59 3.995,60 4.815,61 5.039,62 3.982,63 4.027,64 5.903,65 3.96,66 0.144,67 1.088,68 13.616,69 5.607,70 5.1}
{0 CHEMBL2152382,1 26.79,2 36.216,3 0.028,4 -0.053,5 0.819,6 0.68,7 3.778,8 3.778,9 5.094,10 1,11 1.616,12 12.6,13 4.514,14 20.374,15 133.91,16 8.465,17 0.474,18 4.161,19 4.252,20 3.823,21 3.749,22 5.372,23 3.74,24 4.662,25 4.79,26 4.194,27 4.131,28 5.885,29 4.104,30 4.913,31 5.073,32 4.349,33 4.302,34 6.12,35 4.263,36 5.017,37 5.172,38 4.411,39 4.338,40 6.286,41 4.318,42 5.055,43 5.188,44 4.521,45 4.43,46 6.466,47 4.41,48 5.14,49 5.279,50 4.558,51 4.501,52 6.452,53 4.454,54 5.231,55 5.417,56 4.42,57 4.44,58 6.488,59 4.359,60 5.038,61 5.252,62 4.061,63 4.264,64 6.116,65 4.128,66 0.106,67 0.753,68 9.245,69 5.191,70 5}
{0 CHEMBL215652,1 8.08,2 4.896,3 -0.025,4 -0.109,5 0.435,7 4.207,8 4.207,11 1.789,12 9.32,13 4.523,14 20.459,15 93.893,16 9.149,17 0.75,18 3.807,19 3.907,20 3.553,21 3.386,22 5.024,23 3.392,24 4.309,25 4.452,26 3.962,27 3.781,28 5.505,29 3.777,30 4.496,31 4.666,32 4.021,33 3.878,34 5.681,35 3.849,36 4.585,37 4.784,38 4.074,39 3.858,40 5.817,41 3.839,42 4.464,43 4.632,44 3.898,45 3.806,46 5.605,47 3.757,48 4.398,49 4.583,50 3.774,51 3.717,52 5.551,53 3.652,54 4.34,55 4.54,56 3.724,57 3.583,58 5.558,59 3.526,60 4.202,61 4.417,62 3.475,63 3.414,64 5.333,65 3.354,66 0.102,67 0.653,68 4.996,69 3.242,70 5}
{0 CHEMBL215803,1 19.624,2 25.004,3 0.03,4 -0.12,5 0.743,7 4.485,8 4.485,9 6.358,10 1,11 1.619,12 8.567,13 3.585,14 12.851,15 109.33,16 7.911,17 0.6,18 4.088,19 4.194,20 3.718,21 3.612,22 5.203,23 3.622,24 4.647,25 4.801,26 4.152,27 4.047,28 5.723,29 4.047,30 4.955,31 5.146,32 4.28,33 4.217,34 6.05,35 4.198,36 5.044,37 5.245,38 4.278,39 4.275,40 6.094,41 4.234,42 5.124,43 5.338,44 4.324,45 4.309,46 6.174,47 4.272,48 5.139,49 5.344,50 4.399,51 4.379,52 6.22,53 4.343,54 5.141,55 5.336,56 4.311,57 4.381,58 6.246,59 4.321,60 5.022,61 5.249,62 3.877,63 4.153,64 6.038,65 4.034,66 0.113,67 0.804,68 9.739,69 4.502,70 6}
{0 CHEMBL2178352,1 35.361,2 56.339,3 -0.013,4 -0.322,5 0.46,6 0.4,7 3.707,8 3.707,11 1.404,12 14.543,13 5.517,14 30.433,15 139.765,16 6.995,17 0.55,18 4.311,19 4.453,20 3.848,21 3.824,22 5.293,23 3.8,24 4.885,25 5.088,26 4.217,27 4.244,28 5.81,29 4.192,30 5.158,31 5.408,32 4.221,33 4.371,34 5.995,35 4.276,36 5.183,37 5.453,38 4.18,39 4.359,40 5.994,41 4.247,42 5.14,43 5.405,44 4.204,45 4.334,46 6.013,47 4.246,48 5.075,49 5.317,50 4.147,51 4.332,52 5.956,53 4.238,54 5.04,55 5.279,56 4.097,57 4.3,58 5.922,59 4.197,60 5.058,61 5.324,62 3.964,63 4.244,64 5.883,65 4.113,66 0.059,67 1.094,68 15.12,69 5.525,70 5}
{0 CHEMBL219722,1 14.885,2 20.83,3 0.104,4 0.186,5 0.235,7 3.696,8 3.696,11 1.53,12 11.269,13 3.2,14 10.241,15 101.347,16 7.987,17 0.759,18 3.883,19 4.011,20 3.507,21 3.465,22 5.087,23 3.458,24 4.325,25 4.464,26 3.855,27 3.846,28 5.53,29 3.812,30 4.569,31 4.762,32 3.855,33 3.932,34 5.683,35 3.876,36 4.589,37 4.803,38 3.803,39 3.878,40 5.71,41 3.814,42 4.553,43 4.763,44 3.708,45 3.791,46 5.75,47 3.73,48 4.486,49 4.724,50 3.514,51 3.675,52 5.585,53 3.588,54 4.291,55 4.544,56 3.288,57 3.512,58 5.259,59 3.402,60 4.114,61 4.352,62 3.244,63 3.371,64 5.15,65 3.275,66 0.08,67 0.674,68 7.688,69 3.316,70 5.2}
{0 CHEMBL220057,1 17.311,2 24.218,3 0.096,4 0.175,5 0.249,7 3.701,8 3.701,11 1.511,12 11.37,13 3.964,14 15.712,15 107.698,16 7.771,17 0.733,18 3.94,19 4.071,20 3.542,21 3.519,22 5.124,23 3.505,24 4.396,25 4.547,26 3.898,27 3.904,28 5.574,29 3.865,30 4.626,31 4.812,32 3.906,33 4.01,34 5.724,35 3.946,36 4.699,37 4.922,38 3.861,39 3.967,40 5.787,41 3.89,42 4.651,43 4.873,44 3.746,45 3.863,46 5.804,47 3.791,48 4.566,49 4.812,50 3.588,51 3.737,52 5.652,53 3.648,54 4.385,55 4.632,56 3.346,57 3.572,58 5.403,59 3.47,60 4.201,61 4.446,62 3.323,63 3.464,64 5.206,65 3.364,66 0.073,67 0.714,68 8.656,69 3.665,70 5.2}
{0 CHEMBL220241,1 34.392,2 40.97,3 -0.015,4 -0.191,5 0.857,6 0.86,7 3.888,8 3.888,9 17.246,10 3,11 1.674,12 18.643,13 3.394,14 11.52,15 155.448,16 7.926,17 0.574,18 4.413,19 4.524,20 4.034,21 3.874,22 5.571,23 3.895,24 4.938,25 5.1,26 4.382,27 4.243,28 6.058,29 4.253,30 5.146,31 5.342,32 4.405,33 4.357,34 6.227,35 4.335,36 5.178,37 5.38,38 4.372,39 4.378,40 6.253,41 4.326,42 5.202,43 5.424,44 4.335,45 4.349,46 6.244,47 4.305,48 5.138,49 5.344,50 4.316,51 4.31,52 6.276,53 4.266,54 5.065,55 5.274,56 4.203,57 4.259,58 6.136,59 4.206,60 4.996,61 5.214,62 4.114,63 4.19,64 6.052,65 4.115,66 0.231,67 1.121,68 13.687,69 5.917,70 5.2}
{0 CHEMBL221959,1 16.291,2 21.804,3 -0.052,4 -0.402,5 0.428,6 0.547,7 3.218,8 3.218,11 1.567,12 8.696,13 1.372,14 1.883,15 87.831,16 7.266,17 0.4,18 3.858,19 3.998,20 3.408,21 3.334,22 4.964,23 3.324,24 4.432,25 4.643,26 3.762,27 3.746,28 5.408,29 3.709,30 4.697,31 4.92,32 3.855,33 3.924,34 5.691,35 3.859,36 4.853,37 5.103,38 3.837,39 3.998,40 5.874,41 3.897,42 4.905,43 5.183,44 3.72,45 4.009,46 5.772,47 3.869,48 4.827,49 5.104,50 3.663,51 3.916,52 5.78,53 3.789,54 4.681,55 4.945,56 3.517,57 3.743,58 5.755,59 3.62,60 4.465,61 4.769,62 3.189,63 3.443,64 5.493,65 3.305,66 0.02,67 0.693,68 9.09,69 3.332,70 5}
{0 CHEMBL223257,1 28.96,2 38.343,3 0.002,4 -0.21,5 1.156,6 0.86,7 3.961,8 3.961,9 16.815,10 3,11 1.835,12 12.5,13 2.09,14 4.366,15 112.761,16 8.591,17 0.353,18 4.116,19 4.211,20 3.77,21 3.545,22 5.347,23 3.58,24 4.64,25 4.779,26 4.117,27 3.894,28 5.861,29 3.906,30 4.927,31 5.109,32 4.282,33 4.034,34 6.21,35 4.036,36 4.941,37 5.127,38 4.273,39 4.069,40 6.19,41 4.055,42 4.961,43 5.138,44 4.311,45 4.146,46 6.188,47 4.122,48 5.038,49 5.209,50 4.422,51 4.217,52 6.312,53 4.194,54 5.099,55 5.279,56 4.386,57 4.271,58 6.344,59 4.229,60 5.048,61 5.263,62 4.156,63 4.109,64 6.272,65 4.038,66 0.276,67 0.769,68 9.171,69 4.525,70 5.2}
{0 CHEMBL223360,1 17.267,2 22.095,3 0.099,4 0.119,5 0.537,7 3.891,8 3.891,11 1.634,12 11.429,13 4.169,14 17.383,15 107.914,16 8.162,17 0.71,18 3.95,19 4.077,20 3.584,21 3.517,22 5.182,23 3.516,24 4.409,25 4.555,26 3.957,27 3.901,28 5.658,29 3.881,30 4.647,31 4.824,32 4,33 4.007,34 5.876,35 3.969,36 4.721,37 4.936,38 3.93,39 3.963,40 5.904,41 3.912,42 4.667,43 4.882,44 3.863,45 3.86,46 6.017,47 3.812,48 4.591,49 4.828,50 3.641,51 3.733,52 5.779,53 3.668,54 4.397,55 4.639,56 3.447,57 3.569,58 5.514,59 3.493,60 4.231,61 4.463,62 3.433,63 3.458,64 5.408,65 3.397,66 0.108,67 0.782,68 7.914,69 3.697,70 5.2}
{0 CHEMBL223367,1 27.729,2 35.511,4 -0.184,5 0.983,6 0.86,7 3.961,8 3.961,9 11.459,10 2,11 1.774,12 11.667,13 3.329,14 11.082,15 110.214,16 8.306,17 0.375,18 4.06,19 4.167,20 3.698,21 3.54,22 5.244,23 3.549,24 4.593,25 4.751,26 4.037,27 3.904,28 5.755,29 3.88,30 4.877,31 5.084,32 4.183,33 4.062,34 6.001,35 4.022,36 4.913,37 5.108,38 4.227,39 4.097,40 6.102,41 4.054,42 4.961,43 5.148,44 4.259,45 4.138,46 6.159,47 4.098,48 5.004,49 5.192,50 4.32,51 4.185,52 6.24,53 4.14,54 5.047,55 5.252,56 4.242,57 4.238,58 6.172,59 4.172,60 5.008,61 5.242,62 4.055,63 4.097,64 6.183,65 3.997,66 0.155,67 0.757,68 9.248,69 4.426,70 5.1}
{0 CHEMBL223460,1 27.564,2 35.931,3 -0.007,4 -0.267,5 1.301,6 0.86,7 4.035,8 4.035,9 11.286,10 2,11 1.986,12 11.226,13 2.54,14 6.45,15 112.878,16 9.339,17 0.364,18 4.044,19 4.134,20 3.908,21 3.548,22 5.237,23 3.551,24 4.582,25 4.716,26 4.172,27 3.886,28 5.993,29 3.88,30 4.85,31 5.03,32 4.267,33 4.021,34 6.12,35 4.007,36 4.852,37 5.025,38 4.386,39 4.086,40 6.131,41 4.05,42 4.941,43 5.101,44 4.442,45 4.132,46 6.319,47 4.117,48 4.99,49 5.171,50 4.364,51 4.162,52 6.295,53 4.123,54 5.002,55 5.194,56 4.327,57 4.216,58 6.2,59 4.155,60 4.981,61 5.187,62 4.198,63 4.084,64 6.255,65 4.003,66 0.245,67 0.787,68 9.141,69 4.418,70 5.1}
{0 CHEMBL225519,1 7.745,2 6.909,3 0.052,4 -0.078,5 0.182,7 3.517,8 3.517,11 1.576,12 6.438,13 0.871,14 0.758,15 60.132,16 7.899,17 0.611,18 3.432,19 3.554,20 3.058,21 3.001,22 4.568,23 2.997,24 3.937,25 4.094,26 3.406,27 3.396,28 5.062,29 3.367,30 4.155,31 4.363,32 3.366,33 3.45,34 5.214,35 3.389,36 4.097,37 4.309,38 3.187,39 3.308,40 5.217,41 3.227,42 3.908,43 4.157,44 2.853,45 3.092,46 4.893,47 2.979,48 3.606,49 3.829,50 2.762,51 2.868,52 4.67,53 2.791,54 3.514,55 3.732,56 2.495,57 2.632,58 4.671,59 2.544,60 3.344,61 3.661,62 1.863,63 2.091,64 4.431,65 1.924,66 0.032,67 0.426,68 4.916,69 2.173,70 7.5}
{0 CHEMBL226403,1 7.745,2 6.909,3 0.054,4 -0.041,5 0.189,7 4.185,8 4.185,11 1.482,12 10.231,13 3.004,14 9.023,15 98.818,16 8.105,17 0.733,18 3.871,19 3.981,20 3.527,21 3.504,22 5.01,23 3.492,24 4.373,25 4.513,26 3.905,27 3.915,28 5.499,29 3.885,30 4.622,31 4.811,32 3.938,33 4.016,34 5.699,35 3.961,36 4.617,37 4.822,38 3.803,39 3.93,40 5.717,41 3.855,42 4.491,43 4.714,44 3.629,45 3.811,46 5.486,47 3.719,48 4.327,49 4.526,50 3.619,51 3.713,52 5.392,53 3.648,54 4.339,55 4.542,56 3.546,57 3.67,58 5.419,59 3.598,60 4.3,61 4.538,62 3.412,63 3.553,64 5.333,65 3.463,66 0.021,67 0.617,68 6.983,69 3.375,70 5.3}
{0 CHEMBL226471,1 9.373,2 7.571,3 0.059,4 -0.018,5 0.309,7 4.005,8 4.005,11 1.612,12 8.783,13 3.023,14 9.139,15 85.113,16 8.307,17 0.654,18 3.743,19 3.852,20 3.405,21 3.352,22 4.929,23 3.349,24 4.246,25 4.385,26 3.783,27 3.75,28 5.446,29 3.73,30 4.501,31 4.693,32 3.825,33 3.832,34 5.683,35 3.796,36 4.481,37 4.677,38 3.728,39 3.74,40 5.755,41 3.695,42 4.36,43 4.576,44 3.526,45 3.636,46 5.496,47 3.568,48 4.2,49 4.395,50 3.484,51 3.543,52 5.364,53 3.488,54 4.195,55 4.402,56 3.373,57 3.44,58 5.389,59 3.374,60 4.118,61 4.363,62 3.201,63 3.248,64 5.295,65 3.182,66 0.053,67 0.61,68 5.887,69 3.122,70 5.7}
{0 CHEMBL230011,1 10.638,2 9.826,3 0.139,4 0.048,5 0.445,7 3.974,8 3.974,11 1.675,12 7.885,13 2.637,14 6.954,15 95.202,16 8.659,17 0.793,18 3.843,19 3.954,20 3.515,21 3.384,22 5.164,23 3.411,24 4.25,25 4.376,26 3.905,27 3.754,28 5.605,29 3.767,30 4.496,31 4.657,32 3.98,33 3.858,34 5.801,35 3.863,36 4.507,37 4.696,38 3.942,39 3.821,40 5.799,41 3.817,42 4.496,43 4.674,44 3.931,45 3.849,46 5.791,47 3.846,48 4.514,49 4.684,50 3.954,51 3.893,52 5.791,53 3.878,54 4.559,55 4.734,56 3.901,57 3.861,58 5.867,59 3.837,60 4.566,61 4.771,62 3.675,63 3.667,64 5.923,65 3.619,66 0.151,67 0.65,68 6.242,69 2.923,70 5}
{0 CHEMBL2309006,1 22.317,2 33.429,3 0.081,4 -0.042,5 0.663,6 0.297,7 4.711,8 4.711,9 6.686,10 1,11 1.547,12 7.727,13 3.097,14 9.588,15 120.91,16 8.139,17 0.6,18 4.166,19 4.257,20 3.825,21 3.754,22 5.256,23 3.76,24 4.761,25 4.88,26 4.355,27 4.261,28 5.837,29 4.266,30 5.105,31 5.244,32 4.581,33 4.502,34 6.247,35 4.5,36 5.272,37 5.421,38 4.66,39 4.645,40 6.369,41 4.624,42 5.354,43 5.532,44 4.675,45 4.696,46 6.412,47 4.657,48 5.343,49 5.511,50 4.583,51 4.661,52 6.447,53 4.604,54 5.32,55 5.527,56 4.257,57 4.47,58 6.426,59 4.363,60 5.075,61 5.343,62 3.604,63 4.018,64 6.113,65 3.844,66 0.099,67 0.784,68 9.631,69 4.91,70 6.432}
{0 CHEMBL2309609,1 30.079,2 44.101,3 0.023,4 -0.151,5 0.87,6 0.86,7 4.71,8 4.71,9 13.578,10 2,11 1.495,12 10.884,13 5.28,14 27.873,15 161.613,16 7.818,17 0.588,18 4.432,19 4.533,20 4.067,21 4.023,22 5.496,23 4.016,24 5.025,25 5.167,26 4.544,27 4.493,28 6.056,29 4.483,30 5.333,31 5.485,32 4.773,33 4.738,34 6.359,35 4.721,36 5.534,37 5.691,38 4.914,39 4.904,40 6.564,41 4.88,42 5.692,43 5.865,44 4.973,45 5.013,46 6.721,47 4.969,48 5.784,49 5.982,50 4.947,51 5.063,52 6.789,53 4.989,54 5.803,55 6.024,56 4.802,57 5.003,58 6.787,59 4.902,60 5.655,61 5.887,62 4.571,63 4.828,64 6.63,65 4.71,66 0.025,67 1.045,68 13.58,69 6.639,70 5}
{0 CHEMBL231209,1 16.513,2 22.779,3 0.101,4 0.065,5 0.398,7 3.686,8 3.686,11 1.748,12 11.852,13 3.751,14 14.066,15 105.985,16 9.011,17 0.733,18 3.867,19 3.973,20 3.631,21 3.514,22 5.115,23 3.489,24 4.311,25 4.429,26 4.002,27 3.896,28 5.607,29 3.846,30 4.547,31 4.717,32 4.004,33 3.968,34 5.758,35 3.906,36 4.557,37 4.74,38 4.011,39 3.916,40 5.809,41 3.839,42 4.532,43 4.731,44 3.777,45 3.808,46 5.756,47 3.715,48 4.373,49 4.58,50 3.643,51 3.643,52 5.727,53 3.566,54 4.226,55 4.44,56 3.435,57 3.533,58 5.32,59 3.445,60 4.155,61 4.377,62 3.409,63 3.447,64 5.293,65 3.349,66 0.087,67 0.693,68 6.163,69 3.456,70 5.2}
{0 CHEMBL234085,1 16.291,2 21.804,3 -0.052,4 -0.402,5 0.428,6 0.547,7 3.218,8 3.218,11 1.567,12 8.696,13 1.372,14 1.883,15 87.831,16 7.266,17 0.4,18 3.858,19 3.998,20 3.408,21 3.334,22 4.964,23 3.324,24 4.432,25 4.643,26 3.762,27 3.746,28 5.408,29 3.709,30 4.697,31 4.92,32 3.855,33 3.924,34 5.691,35 3.859,36 4.853,37 5.103,38 3.837,39 3.998,40 5.874,41 3.897,42 4.905,43 5.183,44 3.72,45 4.009,46 5.772,47 3.869,48 4.827,49 5.104,50 3.663,51 3.916,52 5.78,53 3.789,54 4.681,55 4.945,56 3.517,57 3.743,58 5.755,59 3.62,60 4.465,61 4.769,62 3.189,63 3.443,64 5.493,65 3.305,66 0.02,67 0.693,68 9.09,69 3.332,70 5.2}
{0 CHEMBL243088,1 23.408,2 42.894,3 0.076,4 -0.056,5 0.488,7 3.729,8 3.729,11 1.681,12 9.667,13 3.549,14 12.593,15 88.407,16 8.483,17 0.692,18 3.77,19 3.873,20 3.421,21 3.296,22 5.077,23 3.318,24 4.178,25 4.301,26 3.759,27 3.63,28 5.594,29 3.631,30 4.425,31 4.606,32 3.758,33 3.696,34 5.656,35 3.684,36 4.429,37 4.628,38 3.711,39 3.604,40 5.738,41 3.586,42 4.376,43 4.576,44 3.606,45 3.556,46 5.648,47 3.551,48 4.272,49 4.464,50 3.611,51 3.531,52 5.621,53 3.507,54 4.215,55 4.412,56 3.448,57 3.424,58 5.461,59 3.399,60 4.117,61 4.331,62 3.268,63 3.254,64 5.442,65 3.198,66 0.137,67 0.573,68 6.105,69 2.97,70 6.8}
{0 CHEMBL244378,1 21.251,2 40.027,3 0.071,4 -0.002,5 0.481,7 3.95,8 3.95,11 1.675,12 10.462,13 3.597,14 12.938,15 96.478,16 8.659,17 0.759,18 3.84,19 3.955,20 3.525,21 3.376,22 5.114,23 3.401,24 4.271,25 4.403,26 3.875,27 3.738,28 5.634,29 3.744,30 4.479,31 4.666,32 3.848,33 3.793,34 5.659,35 3.777,36 4.488,37 4.687,38 3.791,39 3.701,40 5.751,41 3.68,42 4.443,43 4.66,44 3.67,45 3.619,46 5.659,47 3.605,48 4.304,49 4.498,50 3.663,51 3.585,52 5.59,53 3.566,54 4.272,55 4.473,56 3.582,57 3.502,58 5.495,59 3.483,60 4.186,61 4.41,62 3.411,63 3.365,64 5.454,65 3.326,66 0.139,67 0.662,68 6.045,69 2.928,70 7.5}
{0 CHEMBL246970,1 22.364,2 32.577,3 0.033,4 -0.013,5 0.505,7 3.774,8 3.774,11 1.684,12 12.107,13 3.864,14 14.93,15 113.914,16 7.641,17 0.4,18 4.062,19 4.201,20 3.635,21 3.555,22 5.166,23 3.529,24 4.614,25 4.801,26 3.979,27 3.977,28 5.745,29 3.907,30 4.937,31 5.182,32 4.075,33 4.132,34 5.863,35 4.019,36 5.025,37 5.3,38 3.972,39 4.04,40 6.099,41 3.909,42 4.87,43 5.163,44 3.768,45 3.895,46 5.763,47 3.775,48 4.702,49 4.954,50 3.881,51 3.807,52 5.782,53 3.75,54 4.668,55 4.888,56 3.896,57 3.839,58 5.784,59 3.794,60 4.744,61 4.97,62 3.834,63 3.808,64 5.911,65 3.753,66 0.164,67 0.809,68 11.149,69 4.396,70 5.2}
{0 CHEMBL24828,1 25.914,2 33.11,3 -0.023,4 -0.203,5 0.799,6 0.4,7 3.883,8 3.883,9 11.67,10 2,11 1.715,12 12.633,13 5.087,14 25.882,15 118.666,16 8.804,17 0.515,18 4.096,19 4.21,20 3.809,21 3.624,22 5.183,23 3.608,24 4.654,25 4.831,26 4.207,27 4.022,28 5.692,29 3.985,30 4.896,31 5.087,32 4.303,33 4.185,34 5.942,35 4.112,36 5,37 5.239,38 4.249,39 4.119,40 5.993,41 4.028,42 4.9,43 5.149,44 4.082,45 4.02,46 5.885,47 3.947,48 4.725,49 4.904,50 4.108,51 4.046,52 5.806,53 3.985,54 4.877,55 5.093,56 4.17,57 4.064,58 5.938,59 3.991,60 4.807,61 5.035,62 4.136,63 4.001,64 5.805,65 3.888,66 0.058,67 0.853,68 9.037,69 4.983,70 5}
{0 CHEMBL248757,1 32.403,2 46.934,3 0.005,4 -0.207,5 1.108,6 0.86,7 3.961,8 3.961,9 11.488,10 2,11 1.926,12 12.563,13 2.839,14 8.06,15 121.278,16 9.439,17 0.486,18 4.052,19 4.153,20 3.843,21 3.593,22 5.274,23 3.596,24 4.558,25 4.697,26 4.204,27 3.951,28 5.77,29 3.93,30 4.79,31 4.965,32 4.257,33 4.04,34 5.981,35 4.014,36 4.849,37 5.029,38 4.282,39 4.079,40 6.085,41 4.048,42 4.91,43 5.085,44 4.336,45 4.16,46 6.143,47 4.118,48 4.938,49 5.11,50 4.49,51 4.253,52 6.167,53 4.198,54 4.99,55 5.186,56 4.35,57 4.217,58 6.17,59 4.149,60 4.867,61 5.091,62 4.095,63 3.976,64 6.09,65 3.894,66 0.18,67 0.804,68 6.61,69 4.085,70 5.163}
{0 CHEMBL249282,1 23.097,2 28.072,3 0.002,4 -0.091,5 0.45,6 0.8,7 3.849,8 3.849,9 11.388,10 2,11 1.565,12 13.379,13 3.142,14 9.873,15 109.968,16 7.75,17 0.515,18 4.041,19 4.152,20 3.658,21 3.585,22 5.141,23 3.583,24 4.601,25 4.763,26 4.002,27 3.989,28 5.609,29 3.971,30 4.806,31 5.002,32 4.015,33 4.11,34 5.792,35 4.046,36 4.83,37 5.059,38 3.887,39 4.068,40 5.757,41 3.968,42 4.828,43 5.091,44 3.808,45 3.927,46 5.725,47 3.837,48 4.584,49 4.806,50 3.717,51 3.802,52 5.536,53 3.737,54 4.43,55 4.614,56 3.672,57 3.823,58 5.442,59 3.742,60 4.568,61 4.803,62 3.628,63 3.795,64 5.559,65 3.694,66 0.052,67 0.767,68 9.516,69 4.407,70 5.2}
{0 CHEMBL249697,1 12.293,2 14.709,3 0.019,4 -0.209,5 0.184,7 3.81,8 3.81,11 1.437,12 7.316,13 1.761,14 3.1,15 76.664,16 7.093,17 0.714,18 3.69,19 3.839,20 3.224,21 3.19,22 4.767,23 3.172,24 4.205,25 4.411,26 3.589,27 3.567,28 5.202,29 3.531,30 4.386,31 4.615,32 3.648,33 3.681,34 5.395,35 3.624,36 4.446,37 4.695,38 3.586,39 3.681,40 5.378,41 3.609,42 4.341,43 4.568,44 3.465,45 3.618,46 5.314,47 3.534,48 4.36,49 4.611,50 3.224,51 3.548,52 5.303,53 3.415,54 4.271,55 4.552,56 2.73,57 3.342,58 5.081,59 3.119,60 4.082,61 4.442,62 2.203,63 2.933,64 4.749,65 2.65,66 0.039,67 0.587,68 7.979,69 2.761,70 5}
{0 CHEMBL253969,1 30.806,2 38.283,3 0.016,4 -0.131,5 0.901,6 0.8,7 4.066,8 4.066,9 5.337,10 1,11 1.971,12 14.594,13 3.593,14 12.91,15 122.946,16 9.508,17 0.324,18 4.133,19 4.25,20 3.922,21 3.639,22 5.295,23 3.622,24 4.685,25 4.857,26 4.319,27 4.032,28 5.896,29 3.98,30 4.939,31 5.156,32 4.348,33 4.102,34 6.059,35 4.026,36 4.96,37 5.183,38 4.574,39 4.007,40 6.418,41 3.959,42 4.828,43 5.06,44 4.062,45 3.939,46 5.934,47 3.848,48 4.756,49 4.964,50 4.206,51 3.922,52 6.144,53 3.847,54 4.762,55 4.981,56 4.226,57 3.911,58 5.974,59 3.852,60 4.704,61 4.903,62 4.225,63 3.837,64 6.259,65 3.782,66 0.206,67 0.978,68 8.502,69 5.056,70 5.2}
{0 CHEMBL255863,1 30.805,2 46.278,3 -0.001,4 -0.147,5 1.003,7 3.987,8 3.987,11 1.716,12 14.769,13 5.084,14 25.849,15 140.252,16 8.681,17 0.674,18 4.236,19 4.35,20 3.921,21 3.781,22 5.478,23 3.8,24 4.739,25 4.893,26 4.349,27 4.15,28 6.333,29 4.161,30 4.908,31 5.077,32 4.326,33 4.265,34 6.178,35 4.25,36 5.037,37 5.246,38 4.309,39 4.247,40 6.287,41 4.228,42 5.006,43 5.216,44 4.393,45 4.231,46 6.329,47 4.226,48 4.99,49 5.176,50 4.366,51 4.232,52 6.37,53 4.24,54 5.048,55 5.25,56 4.376,57 4.214,58 6.634,59 4.208,60 4.881,61 5.068,62 4.22,63 4.165,64 6.205,65 4.141,66 0.17,67 1.169,68 8.678,69 4.973,70 5}
{0 CHEMBL256835,1 14.422,2 11.476,3 -0.007,4 -0.193,5 0.448,7 3.662,8 3.662,9 5.179,10 1,11 1.654,12 9.037,13 3.661,14 13.404,15 99.287,16 7.676,17 0.567,18 3.988,19 4.101,20 3.58,21 3.499,22 5.12,23 3.499,24 4.538,25 4.705,26 3.946,27 3.899,28 5.65,29 3.876,30 4.797,31 5.013,32 3.99,33 4.036,34 5.835,35 3.981,36 4.849,37 5.085,38 3.967,39 4.042,40 5.853,41 3.981,42 4.798,43 5.02,44 3.998,45 4.078,46 5.776,47 4.011,48 4.807,49 5.012,50 4.03,51 4.085,52 5.883,53 4.024,54 4.853,55 5.066,56 3.968,57 4.069,58 5.924,59 3.993,60 4.88,61 5.121,62 3.765,63 3.962,64 5.922,65 3.85,66 0.069,67 0.787,68 9.408,69 4.349,70 5.2}
{0 CHEMBL258202,1 21.958,2 30.594,3 0.018,4 -0.1,5 0.396,7 3.839,8 3.839,11 1.663,12 10.75,13 2.656,14 7.056,15 98.219,16 7.533,17 0.44,18 3.897,19 4.029,20 3.503,21 3.439,22 5.012,23 3.383,24 4.409,25 4.605,26 3.888,27 3.792,28 5.499,29 3.71,30 4.599,31 4.807,32 3.899,33 3.868,34 5.716,35 3.781,36 4.695,37 4.922,38 3.837,39 3.882,40 5.838,41 3.767,42 4.628,43 4.87,44 3.794,45 3.857,46 5.709,47 3.713,48 4.481,49 4.67,50 3.71,51 3.768,52 5.632,53 3.645,54 4.441,55 4.645,56 3.604,57 3.639,58 5.72,59 3.521,60 4.359,61 4.595,62 3.431,63 3.437,64 5.503,65 3.339,66 0.035,67 0.696,68 10.19,69 4.232,70 4.523}
{0 CHEMBL259084,1 25.112,2 35.76,3 0.049,4 -0.037,5 0.701,7 4.046,8 4.046,11 1.805,12 12.382,13 6.167,14 38.036,15 123.999,16 9.732,17 0.632,18 4.038,19 4.122,20 3.816,21 3.667,22 5.347,23 3.681,24 4.508,25 4.617,26 4.228,27 4.057,28 5.92,29 4.061,30 4.792,31 4.932,32 4.383,33 4.222,34 6.131,35 4.224,36 4.87,37 5.039,38 4.381,39 4.18,40 6.355,41 4.184,42 4.817,43 4.98,44 4.353,45 4.193,46 6.118,47 4.187,48 4.846,49 5.019,50 4.384,51 4.181,52 6.209,53 4.165,54 4.792,55 4.977,56 4.335,57 4.091,58 6.219,59 4.054,60 4.613,61 4.797,62 4.07,63 3.902,64 6.046,65 3.858,66 0.191,67 0.819,68 4.764,69 3.856,70 5.1}
{0 CHEMBL259850,1 21.215,2 29.606,3 0.004,4 -0.063,5 0.455,6 0.564,7 3.636,8 3.636,9 5.034,10 1,11 1.952,12 10.857,13 1.53,14 2.339,15 76.993,16 9.344,17 0.5,18 3.636,19 3.733,20 3.423,21 3.13,22 4.951,23 3.133,24 4.092,25 4.221,26 3.793,27 3.45,28 5.551,29 3.439,30 4.193,31 4.342,32 3.703,33 3.457,34 5.476,35 3.427,36 4.242,37 4.428,38 3.559,39 3.349,40 5.617,41 3.318,42 4.116,43 4.357,44 3.327,45 3.209,46 5.317,47 3.143,48 3.99,49 4.18,50 3.242,51 3.087,52 5.303,53 3.05,54 3.809,55 3.953,56 3.308,57 3.011,58 5.513,59 2.984,60 3.792,61 4.004,62 3.165,63 3.005,64 5.027,65 2.92,66 0.216,67 0.523,68 4.717,69 2.782,70 5.2}
{0 CHEMBL259922,1 23.925,2 32.402,3 0.005,4 -0.083,5 0.527,7 3.966,8 3.966,11 1.642,12 12.29,13 3.89,14 15.134,15 116.248,16 8.572,17 0.771,18 4.021,19 4.133,20 3.714,21 3.563,22 5.261,23 3.583,24 4.478,25 4.621,26 4.067,27 3.928,28 5.693,29 3.936,30 4.656,31 4.832,32 4.075,33 3.991,34 5.832,35 3.98,36 4.726,37 4.928,38 4.052,39 3.992,40 5.927,41 3.97,42 4.707,43 4.915,44 4.025,45 4.005,46 5.887,47 3.971,48 4.635,49 4.811,50 4.002,51 3.997,52 5.801,53 3.969,54 4.708,55 4.914,56 3.916,57 3.93,58 5.855,59 3.885,60 4.602,61 4.848,62 3.75,63 3.739,64 5.679,65 3.699,66 0.148,67 0.789,68 7.225,69 3.611,70 5.2}
{0 CHEMBL260092,1 29.567,2 44.48,3 0.061,4 -0.095,5 0.973,6 0.4,7 3.869,8 3.869,11 1.81,12 13.531,13 3.338,14 11.142,15 115.957,16 8.829,17 0.514,18 4.051,19 4.176,20 3.734,21 3.546,22 5.314,23 3.582,24 4.56,25 4.712,26 4.173,27 3.918,28 6.239,29 3.938,30 4.795,31 4.987,32 4.205,33 4.071,34 6.088,35 4.071,36 4.861,37 5.075,38 4.115,39 4.015,40 6.175,41 4.004,42 4.806,43 5.02,44 4.053,45 3.948,46 6.147,47 3.936,48 4.752,49 4.987,50 3.843,51 3.865,52 5.97,53 3.82,54 4.6,55 4.834,56 3.846,57 3.733,58 6.151,59 3.694,60 4.438,61 4.669,62 3.613,63 3.622,64 5.643,65 3.571,66 0.235,67 1.029,68 7.225,69 3.863,70 5.8}
{0 CHEMBL260135,1 3.162,2 2.5,3 0.095,4 0.283,5 0.129,7 3.785,8 3.785,11 1.438,12 7.136,13 3.032,14 9.191,15 85.894,16 8.21,17 0.88,18 3.694,19 3.819,20 3.357,21 3.312,22 4.911,23 3.302,24 4.126,25 4.263,26 3.699,27 3.693,28 5.277,29 3.665,30 4.338,31 4.526,32 3.752,33 3.775,34 5.441,35 3.728,36 4.354,37 4.554,38 3.755,39 3.754,40 5.451,41 3.715,42 4.355,43 4.534,44 3.806,45 3.79,46 5.531,47 3.763,48 4.442,49 4.636,50 3.713,51 3.796,52 5.6,53 3.74,54 4.428,55 4.683,56 3.311,57 3.6,58 5.454,59 3.472,60 4.136,61 4.457,62 2.476,63 3.11,64 4.948,65 2.878,66 0.08,67 0.566,68 5.798,69 2.638,70 5.2}
{0 CHEMBL261849,1 26.546,2 34.768,3 0.022,4 -0.053,5 0.426,6 0.68,7 3.841,8 3.841,9 16.531,10 3,11 1.588,12 12.778,13 3.127,14 9.779,15 106.122,16 7.479,17 0.621,18 3.994,19 4.11,20 3.552,21 3.474,22 5.177,23 3.477,24 4.473,25 4.635,26 3.859,27 3.811,28 5.61,29 3.797,30 4.61,31 4.764,32 3.924,33 3.939,34 5.724,35 3.903,36 4.754,37 4.963,38 3.786,39 3.943,40 5.791,41 3.858,42 4.764,43 5.007,44 3.693,45 3.901,46 5.695,47 3.8,48 4.633,49 4.857,50 3.695,51 3.83,52 5.638,53 3.746,54 4.618,55 4.854,56 3.676,57 3.765,58 5.626,59 3.681,60 4.53,61 4.751,62 3.531,63 3.647,64 5.563,65 3.56,66 0.069,67 0.705,68 10.086,69 4.218,70 5}
{0 CHEMBL262433,1 17.267,2 22.095,3 0.066,4 -0.069,5 0.629,7 3.891,8 3.891,11 1.826,12 11.929,13 3.447,14 11.88,15 108.389,16 9.174,17 0.71,18 3.901,19 4.013,20 3.681,21 3.492,22 5.169,23 3.488,24 4.349,25 4.487,26 4.054,27 3.866,28 5.652,29 3.844,30 4.551,31 4.712,32 4.085,33 3.948,34 5.848,35 3.913,36 4.627,37 4.828,38 4.069,39 3.899,40 5.901,41 3.846,42 4.544,43 4.744,44 3.886,45 3.775,46 5.941,47 3.716,48 4.389,49 4.588,50 3.671,51 3.621,52 5.688,53 3.578,54 4.271,55 4.478,56 3.53,57 3.521,58 5.483,59 3.471,60 4.195,61 4.41,62 3.497,63 3.476,64 5.435,65 3.397,66 0.127,67 0.778,68 6.305,69 3.321,70 5.2}
{0 CHEMBL271381,1 20.842,2 27.457,3 0.063,4 0.092,5 0.527,7 3.723,8 3.723,9 5.304,10 1,11 1.731,12 12.483,13 4.22,14 17.806,15 114.497,16 9.855,17 0.688,18 3.963,19 4.063,20 3.762,21 3.541,22 5.198,23 3.54,24 4.415,25 4.535,26 4.167,27 3.921,28 5.643,29 3.9,30 4.62,31 4.767,32 4.223,33 4.036,34 5.805,35 3.991,36 4.68,37 4.846,38 4.216,39 4.004,40 5.872,41 3.961,42 4.694,43 4.88,44 4.014,45 3.939,46 5.907,47 3.881,48 4.621,49 4.829,50 4.023,51 3.799,52 5.794,53 3.742,54 4.404,55 4.614,56 3.672,57 3.659,58 5.464,59 3.574,60 4.318,61 4.538,62 3.762,63 3.613,64 5.369,65 3.505,66 0.15,67 0.663,68 5.345,69 3.709,70 5.2}
{0 CHEMBL272453,1 19.564,2 26.323,3 0.065,4 0.086,5 0.546,7 3.894,8 3.894,9 5.099,10 1,11 1.731,12 12.759,13 4.136,14 17.104,15 111.679,16 8.888,17 0.688,18 3.964,19 4.064,20 3.672,21 3.526,22 5.211,23 3.534,24 4.417,25 4.537,26 4.045,27 3.901,28 5.661,29 3.892,30 4.623,31 4.771,32 4.131,33 4.012,34 5.839,35 3.985,36 4.678,37 4.848,38 4.068,39 3.998,40 5.875,41 3.948,42 4.68,43 4.873,44 3.873,45 3.913,46 5.89,47 3.84,48 4.571,49 4.791,50 3.778,51 3.728,52 5.751,53 3.667,54 4.34,55 4.557,56 3.538,57 3.57,58 5.449,59 3.493,60 4.22,61 4.429,62 3.572,63 3.491,64 5.366,65 3.425,66 0.16,67 0.666,68 6.794,69 3.673,70 5.2}
{0 CHEMBL274064,1 17.439,2 20.662,3 0.026,4 -0.163,5 0.296,7 3.653,8 3.653,11 1.567,12 8.48,13 1.884,14 3.551,15 94.999,16 7.692,17 0.607,18 3.906,19 4.044,20 3.503,21 3.422,22 5.036,23 3.42,24 4.437,25 4.622,26 3.865,27 3.823,28 5.551,29 3.796,30 4.704,31 4.943,32 3.881,33 3.952,34 5.701,35 3.89,36 4.709,37 4.947,38 3.881,39 3.962,40 5.694,41 3.892,42 4.707,43 4.938,44 3.92,45 3.996,46 5.686,47 3.93,48 4.719,49 4.94,50 3.93,51 3.997,52 5.806,53 3.93,54 4.747,55 4.981,56 3.789,57 3.971,58 5.782,59 3.865,60 4.755,61 5.037,62 3.528,63 3.792,64 5.763,65 3.647,66 0.054,67 0.791,68 8.626,69 3.514,70 5.2}
{0 CHEMBL278041,1 3.784,2 1.825,3 0.058,4 -0.021,5 0.248,7 3.726,8 3.726,11 1.58,12 9.16,13 4.187,14 17.527,15 93.158,16 8.497,17 0.821,18 3.793,19 3.892,20 3.47,21 3.418,22 5.047,23 3.416,24 4.233,25 4.354,26 3.825,27 3.783,28 5.498,29 3.769,30 4.469,31 4.641,32 3.834,33 3.853,34 5.686,35 3.817,36 4.469,37 4.667,38 3.758,39 3.797,40 5.606,41 3.755,42 4.441,43 4.651,44 3.757,45 3.818,46 5.496,47 3.768,48 4.394,49 4.568,50 3.776,51 3.841,52 5.609,53 3.782,54 4.432,55 4.607,56 3.713,57 3.845,58 5.621,59 3.768,60 4.486,61 4.72,62 3.503,63 3.718,64 5.586,65 3.604,66 0.063,67 0.605,68 5.82,69 3.203,70 5.254}
{0 CHEMBL288441,1 34.549,2 46.674,3 -0.042,4 -0.293,5 0.786,6 0.86,7 4.047,8 4.047,9 17.025,10 3,11 1.692,12 14.556,13 4.883,14 23.847,15 142.137,16 8.162,17 0.436,18 4.273,19 4.384,20 3.916,21 3.784,22 5.376,23 3.77,24 4.831,25 5.013,26 4.276,27 4.168,28 5.83,29 4.139,30 5.047,31 5.227,32 4.462,33 4.366,34 6.1,35 4.306,36 5.171,37 5.39,38 4.438,39 4.411,40 6.182,41 4.3,42 5.173,43 5.417,44 4.323,45 4.353,46 6.121,47 4.252,48 5.067,49 5.27,50 4.381,51 4.327,52 6.127,53 4.251,54 5.082,55 5.292,56 4.382,57 4.291,58 6.218,59 4.216,60 4.969,61 5.165,62 4.319,63 4.22,64 6.095,65 4.143,66 0.069,67 0.928,68 12.114,69 5.76,70 5}
{0 CHEMBL296468,1 26.932,2 36.798,3 0.02,4 -0.12,5 0.453,6 0.149,7 3.744,8 3.744,11 1.706,12 11.8,13 2.284,14 5.216,15 101.699,16 7.767,17 0.37,18 3.979,19 4.1,20 3.665,21 3.55,22 4.99,23 3.47,24 4.551,25 4.736,26 4.127,27 3.973,28 5.51,29 3.851,30 4.782,31 4.99,32 3.999,33 4.025,34 5.719,35 3.878,36 4.895,37 5.161,38 3.92,39 3.959,40 5.827,41 3.792,42 4.614,43 4.87,44 3.825,45 3.766,46 5.612,47 3.614,48 4.288,49 4.455,50 3.875,51 3.739,52 5.319,53 3.56,54 4.388,55 4.617,56 3.622,57 3.732,58 5.218,59 3.493,60 4.129,61 4.299,62 3.55,63 3.559,64 5.096,65 3.378,66 0.023,67 0.759,68 11.51,69 5.054,70 5}
{0 CHEMBL296586,1 12.06,2 15.404,3 0.075,4 0.083,5 0.213,7 3.88,8 3.88,11 1.598,12 6.8,13 3.671,14 13.478,15 81.527,16 10.555,17 0.696,18 3.578,19 3.674,20 3.453,21 3.281,22 4.708,23 3.251,24 4.076,25 4.189,26 3.916,27 3.716,28 5.211,29 3.664,30 4.379,31 4.53,32 4.018,33 3.885,34 5.471,35 3.812,36 4.407,37 4.589,38 3.951,39 3.827,40 5.478,41 3.743,42 4.328,43 4.522,44 3.962,45 3.702,46 5.477,47 3.606,48 4.167,49 4.37,50 3.589,51 3.484,52 5.281,53 3.33,54 3.766,55 3.986,56 3.72,57 3.087,58 4.923,59 2.928,60 3.241,61 3.487,62 2.923,63 2.584,64 4.122,65 2.298,66 0.03,67 0.403,68 2.468,69 2.318,70 5.2}
{0 CHEMBL300138,1 25.266,2 30.58,3 0.015,4 -0.177,5 0.425,6 0.172,7 4.604,8 4.604,11 1.463,12 13.769,13 4.534,14 20.558,15 151.757,16 7.583,17 0.578,18 4.333,19 4.449,20 3.937,21 3.93,22 5.403,23 3.909,24 4.891,25 5.057,26 4.336,27 4.371,28 5.922,29 4.332,30 5.159,31 5.356,32 4.405,33 4.538,34 6.128,35 4.466,36 5.263,37 5.477,38 4.438,39 4.597,40 6.268,41 4.508,42 5.31,43 5.525,44 4.491,45 4.613,46 6.325,47 4.532,48 5.321,49 5.528,50 4.488,51 4.613,52 6.389,53 4.535,54 5.332,55 5.549,56 4.383,57 4.562,58 6.387,59 4.469,60 5.254,61 5.487,62 4.229,63 4.439,64 6.266,65 4.338,66 0.024,67 1.003,68 13.098,69 5.962,70 5}
{0 CHEMBL302449,1 16.148,2 16.191,3 0.033,4 -0.105,5 0.222,7 4.686,8 4.686,11 1.446,12 8,13 4.169,14 17.379,15 112.475,16 8.052,17 0.706,18 3.987,19 4.093,20 3.647,21 3.632,22 5.111,23 3.617,24 4.535,25 4.685,26 4.074,27 4.089,28 5.577,29 4.061,30 4.766,31 4.934,32 4.21,33 4.264,34 5.792,35 4.22,36 4.871,37 5.023,38 4.307,39 4.368,40 5.915,41 4.323,42 4.984,43 5.152,44 4.344,45 4.433,46 6.031,47 4.373,48 5.087,49 5.286,50 4.257,51 4.422,52 6.16,53 4.335,54 5.064,55 5.307,56 3.936,57 4.258,58 6.124,59 4.123,60 4.818,61 5.114,62 3.42,63 3.855,64 5.844,65 3.671,66 0.014,67 0.673,68 7.871,69 3.851,70 5.2}
{0 CHEMBL306380,1 13.493,2 13.971,3 0.012,4 -0.061,5 0.222,7 3.683,8 3.683,11 1.414,12 7.333,13 3.117,14 9.718,15 86.242,16 7.035,17 0.696,18 3.78,19 3.925,20 3.308,21 3.308,22 4.881,23 3.278,24 4.296,25 4.501,26 3.719,27 3.699,28 5.314,29 3.661,30 4.506,31 4.7,32 3.776,33 3.853,34 5.555,35 3.792,36 4.735,37 5.02,38 3.758,39 3.875,40 5.693,41 3.777,42 4.518,43 4.757,44 3.597,45 3.782,46 5.48,47 3.694,48 4.41,49 4.606,50 3.555,51 3.742,52 5.491,53 3.646,54 4.587,55 4.869,56 3.136,57 3.668,58 5.525,59 3.486,60 4.43,61 4.781,62 2.574,63 3.346,64 5.038,65 3.057,66 0.063,67 0.637,68 8.78,69 3.354,70 5.2}
{0 CHEMBL316264,1 3.255,2 1.325,3 0.032,4 -0.041,5 0.273,7 3.726,8 3.726,11 1.53,12 9.16,13 4.659,14 21.71,15 91.68,16 8.773,17 0.821,18 3.767,19 3.869,20 3.474,21 3.408,22 5.03,23 3.408,24 4.223,25 4.347,26 3.834,27 3.768,28 5.523,29 3.76,30 4.453,31 4.632,32 3.842,33 3.829,34 5.712,35 3.802,36 4.43,37 4.627,38 3.76,39 3.768,40 5.611,41 3.737,42 4.41,43 4.615,44 3.76,45 3.8,46 5.495,47 3.757,48 4.386,49 4.565,50 3.787,51 3.83,52 5.643,53 3.774,54 4.41,55 4.587,56 3.721,57 3.827,58 5.632,59 3.755,60 4.457,61 4.691,62 3.513,63 3.689,64 5.595,65 3.584,66 0.06,67 0.669,68 4.99,69 3.097,70 5.2}
{0 CHEMBL31965,1 31.688,2 45.905,3 -0.021,4 -0.212,5 0.746,6 0.8,7 3.872,8 3.872,9 11.398,10 2,11 1.772,12 13.382,13 4.038,14 16.303,15 128.881,16 8.237,17 0.459,18 4.189,19 4.302,20 3.832,21 3.687,22 5.339,23 3.692,24 4.727,25 4.89,26 4.185,27 4.051,28 5.872,29 4.039,30 4.974,31 5.173,32 4.295,33 4.187,34 6.14,35 4.149,36 4.987,37 5.209,38 4.153,39 4.174,40 6.024,41 4.1,42 4.981,43 5.213,44 4.15,45 4.173,46 6.025,47 4.098,48 4.966,49 5.177,50 4.196,51 4.161,52 6.05,53 4.111,54 4.953,55 5.157,56 4.23,57 4.162,58 6.137,59 4.106,60 4.887,61 5.09,62 4.185,63 4.122,64 6.058,65 4.065,66 0.126,67 0.934,68 10.471,69 5.109,70 5}
{0 CHEMBL326282,1 14.609,2 11.645,3 0.057,4 0.054,5 0.591,7 3.933,8 3.933,11 1.683,12 9.28,13 5.555,14 30.854,15 98.576,16 10.613,17 0.607,18 3.747,19 3.811,20 3.608,21 3.473,22 4.95,23 3.444,24 4.262,25 4.354,26 4.073,27 3.916,28 5.46,29 3.869,30 4.597,31 4.727,32 4.224,33 4.085,34 5.809,35 4.02,36 4.629,37 4.766,38 4.282,39 4.024,40 6.017,41 3.952,42 4.578,43 4.742,44 3.941,45 3.902,46 5.792,47 3.812,48 4.416,49 4.594,50 4.01,51 3.748,52 5.746,53 3.669,54 4.188,55 4.334,56 3.741,57 3.585,58 5.448,59 3.481,60 3.917,61 4.043,62 3.836,63 3.365,64 5.458,65 3.294,66 0.1,67 0.411,68 2.558,69 2.641,70 5.2}
{0 CHEMBL336961,1 12.06,2 15.404,3 0.063,4 -0.001,5 0.303,7 3.88,8 3.88,11 1.688,12 6.8,13 2.949,14 8.697,15 78.998,16 10.939,17 0.696,18 3.56,19 3.658,20 3.461,21 3.237,22 4.723,23 3.221,24 4.055,25 4.17,26 3.923,27 3.665,28 5.226,29 3.629,30 4.342,31 4.492,32 4.027,33 3.829,34 5.485,35 3.772,36 4.359,37 4.539,38 3.957,39 3.753,40 5.478,41 3.69,42 4.252,43 4.436,44 3.966,45 3.621,46 5.492,47 3.549,48 4.098,49 4.298,50 3.591,51 3.412,52 5.243,53 3.277,54 3.686,55 3.895,56 3.742,57 3,58 4.909,59 2.871,60 3.16,61 3.4,62 2.892,63 2.522,64 4.059,65 2.256,66 0.049,67 0.43,68 1.818,69 2.178,70 5.2}
{0 CHEMBL340384,1 17.465,2 23.987,3 0.076,4 0.034,5 0.46,7 3.888,8 3.888,11 1.701,12 9.286,13 2.888,14 8.339,15 105.583,16 9.329,17 0.581,18 3.871,19 3.959,20 3.616,21 3.502,22 5.17,23 3.505,24 4.316,25 4.418,26 4.018,27 3.897,28 5.649,29 3.888,30 4.599,31 4.726,32 4.178,33 4.061,34 5.903,35 4.04,36 4.673,37 4.813,38 4.206,39 4.08,40 6.119,41 4.037,42 4.677,43 4.844,44 4.107,45 4.089,46 5.89,47 4.026,48 4.636,49 4.795,50 4.145,51 4.041,52 5.931,53 3.997,54 4.632,55 4.783,56 4.142,57 3.933,58 6.114,59 3.902,60 4.506,61 4.685,62 3.766,63 3.731,64 5.833,65 3.67,66 0.119,67 0.568,68 5.051,69 3.232,70 5.4}
{0 CHEMBL340921,1 18.125,2 25.696,3 0.07,4 0.027,5 0.371,7 3.888,8 3.888,11 1.556,12 9.286,13 2.71,14 7.341,15 105.819,16 8.254,17 0.581,18 3.923,19 4.023,20 3.569,21 3.529,22 5.184,23 3.525,24 4.38,25 4.507,26 3.951,27 3.919,28 5.65,29 3.905,30 4.644,31 4.782,32 4.084,33 4.087,34 5.895,35 4.063,36 4.764,37 4.931,38 4.082,39 4.121,40 6.104,41 4.072,42 4.794,43 4.981,44 4.017,45 4.144,46 5.945,47 4.075,48 4.773,49 4.97,50 4.024,51 4.104,52 5.952,53 4.044,54 4.744,55 4.922,56 3.96,57 4.01,58 6.06,59 3.961,60 4.686,61 4.887,62 3.697,63 3.816,64 5.977,65 3.75,66 0.074,67 0.621,68 7.265,69 3.754,70 5.2}
{0 CHEMBL362558,1 24.978,2 28.135,3 -0.005,4 -0.237,5 1.003,6 0.791,7 4.542,8 4.542,11 1.676,12 12.763,13 3.133,14 9.813,15 138.257,16 8.136,17 0.455,18 4.286,19 4.399,20 3.939,21 3.83,22 5.403,23 3.838,24 4.868,25 5.033,26 4.368,27 4.288,28 5.996,29 4.278,30 5.159,31 5.352,32 4.485,33 4.476,34 6.235,35 4.444,36 5.254,37 5.454,38 4.524,39 4.501,40 6.437,41 4.47,42 5.232,43 5.416,44 4.551,45 4.471,46 6.493,47 4.452,48 5.237,49 5.437,50 4.513,51 4.457,52 6.447,53 4.432,54 5.253,55 5.462,56 4.476,57 4.42,58 6.581,59 4.389,60 5.156,61 5.376,62 4.255,63 4.309,64 6.357,65 4.245,66 0.097,67 1.073,68 10.829,69 5.369,70 5.2}
{0 CHEMBL363648,1 13.583,2 13.633,3 0.036,4 -0.032,5 0.202,7 3.73,8 3.73,11 1.503,12 11,13 5.629,14 31.689,15 118.509,16 7.991,17 0.719,18 3.996,19 4.103,20 3.675,21 3.673,22 5.121,23 3.614,24 4.478,25 4.629,26 4.054,27 4.044,28 5.575,29 3.961,30 4.681,31 4.865,32 4.078,33 4.136,34 5.746,35 4.029,36 4.709,37 4.898,38 4.08,39 4.123,40 5.819,41 4.009,42 4.655,43 4.827,44 4.092,45 4.106,46 5.757,47 4.012,48 4.669,49 4.842,50 4.036,51 4.135,52 5.753,53 4.031,54 4.775,55 4.98,56 3.919,57 4.147,58 5.742,59 4.002,60 4.765,61 5.013,62 3.771,63 4.015,64 5.728,65 3.863,66 0.027,67 0.667,68 9.328,69 4.497,70 5.1}
{0 CHEMBL365847,1 37.553,2 62.041,3 0.002,4 -0.239,5 0.551,6 0.4,7 3.719,8 3.719,11 1.52,12 12.697,13 3.273,14 10.709,15 129.309,16 7.089,17 0.324,18 4.241,19 4.375,20 3.774,21 3.756,22 5.261,23 3.733,24 4.827,25 5.026,26 4.162,27 4.182,28 5.807,29 4.134,30 5.114,31 5.345,32 4.259,33 4.345,34 6.067,35 4.277,36 5.145,37 5.369,38 4.312,39 4.37,40 6.271,41 4.301,42 5.188,43 5.409,44 4.238,45 4.368,46 6.277,47 4.295,48 5.114,49 5.346,50 4.126,51 4.287,52 6.181,53 4.188,54 5.036,55 5.291,56 3.909,57 4.157,58 5.965,59 4.041,60 4.958,61 5.241,62 3.745,63 4.048,64 5.827,65 3.903,66 0.028,67 0.987,68 13.83,69 5.47,70 5}
{0 CHEMBL371206,1 22.161,2 30.547,3 0.071,4 0.024,5 0.264,7 3.819,8 3.819,11 1.605,12 12,13 4.094,14 16.762,15 119.498,16 8.071,17 0.688,18 4.013,19 4.134,20 3.689,21 3.632,22 5.172,23 3.589,24 4.49,25 4.652,26 4.097,27 4.026,28 5.635,29 3.957,30 4.67,31 4.827,32 4.1,33 4.149,34 5.77,35 4.06,36 4.807,37 5.019,38 4.136,39 4.147,40 5.879,41 4.045,42 4.784,43 4.981,44 3.95,45 4.074,46 5.918,47 3.963,48 4.79,49 5.056,50 3.751,51 3.92,52 5.83,53 3.794,54 4.551,55 4.805,56 3.529,57 3.701,58 5.583,59 3.595,60 4.314,61 4.549,62 3.491,63 3.633,64 5.292,65 3.514,66 0.038,67 0.765,68 9.579,69 4.319,70 5.2}
{0 CHEMBL373598,1 29.592,2 39.265,3 -0.016,4 -0.23,5 1.058,6 0.86,7 3.961,8 3.961,9 17,10 3,11 1.808,12 12.387,13 2.663,14 7.09,15 111.663,16 8.451,17 0.364,18 4.089,19 4.189,20 3.738,21 3.538,22 5.289,23 3.562,24 4.619,25 4.769,26 4.072,27 3.883,28 5.805,29 3.88,30 4.888,31 5.085,32 4.227,33 4.015,34 6.055,35 4.005,36 4.891,37 5.073,38 4.251,39 4.051,40 6.135,41 4.033,42 4.942,43 5.122,44 4.276,45 4.135,46 6.147,47 4.102,48 5.015,49 5.196,50 4.341,51 4.202,52 6.224,53 4.163,54 5.066,55 5.252,56 4.342,57 4.25,58 6.273,59 4.203,60 5.022,61 5.241,62 4.11,63 4.096,64 6.224,65 4.015,66 0.205,67 0.762,68 9.158,69 4.475,70 5.1}
{0 CHEMBL375284,1 14.148,2 21.718,3 0.064,4 0.116,5 0.228,7 3.688,8 3.688,11 1.475,12 11.269,13 4.171,14 17.4,15 102.684,16 7.782,17 0.759,18 3.893,19 4.015,20 3.504,21 3.497,22 5.055,23 3.478,24 4.356,25 4.503,26 3.846,27 3.877,28 5.509,29 3.834,30 4.579,31 4.764,32 3.827,33 3.975,34 5.64,35 3.901,36 4.635,37 4.86,38 3.776,39 3.912,40 5.694,41 3.826,42 4.566,43 4.789,44 3.648,45 3.787,46 5.693,47 3.709,48 4.453,49 4.696,50 3.502,51 3.647,52 5.518,53 3.56,54 4.255,55 4.487,56 3.287,57 3.489,58 5.288,59 3.398,60 4.112,61 4.342,62 3.269,63 3.416,64 5.127,65 3.323,66 0.058,67 0.653,68 8.061,69 3.611,70 5.2}
{0 CHEMBL377300,1 16.375,2 17.207,3 0.001,4 -0.103,5 0.713,7 4.557,8 4.557,9 11.394,10 2,11 1.737,12 10.667,13 3.998,14 15.98,15 99.425,16 8.053,17 0.667,18 3.969,19 4.075,20 3.595,21 3.442,22 5.155,23 3.465,24 4.486,25 4.641,26 3.993,27 3.812,28 5.66,29 3.837,30 4.673,31 4.828,32 4.062,33 3.886,34 5.958,35 3.901,36 4.729,37 4.929,38 3.971,39 3.855,40 5.902,41 3.848,42 4.586,43 4.771,44 3.866,45 3.781,46 5.811,47 3.768,48 4.608,49 4.805,50 3.857,51 3.815,52 5.79,53 3.786,54 4.648,55 4.862,56 3.806,57 3.755,58 5.861,59 3.727,60 4.533,61 4.767,62 3.644,63 3.611,64 5.74,65 3.565,66 0.152,67 0.756,68 8.482,69 4.074,70 5}
{0 CHEMBL377383,1 18.149,2 18.596,3 0.042,4 -0.035,5 0.744,6 0.473,7 4.114,8 4.114,9 5.256,10 1,11 1.896,12 11.08,13 2.215,14 4.905,15 96.404,16 8.928,17 0.462,18 3.86,19 3.953,20 3.708,21 3.432,22 5.022,23 3.389,24 4.375,25 4.512,26 3.98,27 3.764,28 5.771,29 3.722,30 4.591,31 4.744,32 4.113,33 3.856,34 5.971,35 3.813,36 4.581,37 4.752,38 3.893,39 3.791,40 5.896,41 3.725,42 4.551,43 4.757,44 3.779,45 3.694,46 5.848,47 3.618,48 4.404,49 4.59,50 3.711,51 3.602,52 5.672,53 3.521,54 4.387,55 4.588,56 3.502,57 3.514,58 5.651,59 3.425,60 4.336,61 4.588,62 3.477,63 3.449,64 5.401,65 3.339,66 0.153,67 0.631,68 9.053,69 4.323,70 5.163}
{0 CHEMBL377408,1 18.249,2 17.182,3 0.075,4 -0.008,5 0.969,6 0.473,7 4.167,8 4.167,9 5.237,10 1,11 1.866,12 9.808,13 0.732,14 0.535,15 96.924,16 8.731,17 0.444,18 3.869,19 3.97,20 3.699,21 3.403,22 5.124,23 3.389,24 4.355,25 4.489,26 3.935,27 3.729,28 5.869,29 3.71,30 4.57,31 4.729,32 4.039,33 3.854,34 5.93,35 3.83,36 4.616,37 4.773,38 4.047,39 3.832,40 6.096,41 3.814,42 4.683,43 4.877,44 3.869,45 3.769,46 6.136,47 3.733,48 4.555,49 4.768,50 3.728,51 3.667,52 5.862,53 3.614,54 4.459,55 4.663,56 3.715,57 3.548,58 6.095,59 3.509,60 4.316,61 4.535,62 3.558,63 3.48,64 5.637,65 3.407,66 0.18,67 0.677,68 9.514,69 3.803,70 5.2}
{0 CHEMBL378627,1 29.502,2 40.237,3 0.002,4 -0.118,5 1.219,6 0.86,7 4.138,8 4.138,9 15.927,10 3,11 1.782,12 11.355,13 1.912,14 3.658,15 115.081,16 8.155,17 0.375,18 4.1,19 4.194,20 3.847,21 3.595,22 5.306,23 3.577,24 4.625,25 4.775,26 4.114,27 3.916,28 5.957,29 3.905,30 4.807,31 4.942,32 4.234,33 4.06,34 6.114,35 4.058,36 4.912,37 5.073,38 4.329,39 4.122,40 6.323,41 4.098,42 4.989,43 5.163,44 4.216,45 4.138,46 6.311,47 4.092,48 4.984,49 5.176,50 4.109,51 4.102,52 6.295,53 4.024,54 5,55 5.227,56 3.898,57 3.964,58 6.239,59 3.891,60 4.827,61 5.088,62 3.876,63 3.821,64 6.19,65 3.741,66 0.185,67 0.795,68 12.71,69 5.428,70 5.163}
{0 CHEMBL379218,1 11.017,2 9.41,3 0.055,4 0.112,5 0.171,7 3.816,8 3.816,9 5.892,10 1,11 1.447,12 11.889,13 3.212,14 10.318,15 107.094,16 7.316,17 0.733,18 3.988,19 4.113,20 3.548,21 3.566,22 5.096,23 3.538,24 4.486,25 4.649,26 3.875,27 3.946,28 5.513,29 3.897,30 4.722,31 4.921,32 3.882,33 4.052,34 5.728,35 3.964,36 4.797,37 5.045,38 3.741,39 3.999,40 5.685,41 3.879,42 4.677,43 4.916,44 3.705,45 3.912,46 5.619,47 3.805,48 4.661,49 4.897,50 3.667,51 3.85,52 5.636,53 3.748,54 4.59,55 4.847,56 3.557,57 3.746,58 5.517,59 3.64,60 4.42,61 4.66,62 3.467,63 3.656,64 5.379,65 3.548,66 0.07,67 0.719,68 10.103,69 4.355,70 5}
{0 CHEMBL379835,1 18.095,2 22.268,3 0.036,4 0.084,5 0.586,7 3.935,8 3.935,11 1.722,12 8.087,13 3.896,14 15.176,15 87.838,16 9.308,17 0.654,18 3.711,19 3.802,20 3.468,21 3.327,22 4.949,23 3.325,24 4.183,25 4.302,26 3.895,27 3.725,28 5.394,29 3.722,30 4.429,31 4.572,32 4.03,33 3.827,34 5.698,35 3.83,36 4.498,37 4.646,38 4.042,39 3.794,40 5.891,41 3.811,42 4.442,43 4.59,44 3.947,45 3.744,46 5.888,47 3.738,48 4.376,49 4.535,50 3.736,51 3.697,52 5.668,53 3.634,54 4.292,55 4.513,56 3.451,57 3.526,58 5.422,59 3.392,60 3.989,61 4.235,62 2.807,63 3.179,64 4.983,65 2.982,66 0.136,67 0.506,68 4.383,69 2.756,70 5.2}
{0 CHEMBL379929,1 4.851,2 2.941,3 -0.021,4 -0.132,5 0.205,7 4.121,8 4.121,11 1.515,12 8.652,13 3.653,14 13.347,15 88.871,16 7.805,17 0.808,18 3.788,19 3.901,20 3.419,21 3.359,22 4.93,23 3.351,24 4.286,25 4.445,26 3.78,27 3.744,28 5.35,29 3.72,30 4.459,31 4.654,32 3.776,33 3.82,34 5.473,35 3.768,36 4.551,37 4.777,38 3.765,39 3.799,40 5.579,41 3.758,42 4.442,43 4.631,44 3.637,45 3.752,46 5.472,47 3.688,48 4.372,49 4.577,50 3.535,51 3.669,52 5.365,53 3.584,54 4.3,55 4.531,56 3.393,57 3.529,58 5.266,59 3.436,60 4.165,61 4.406,62 3.144,63 3.349,64 5.094,65 3.253,66 0.028,67 0.594,68 7.143,69 3.335,70 5}
{0 CHEMBL383172,1 26.991,2 41.965,3 0.018,4 -0.115,5 0.502,6 0.4,7 3.935,8 3.935,11 1.631,12 11.667,13 4.033,14 16.268,15 114.263,16 7.912,17 0.515,18 4.049,19 4.173,20 3.664,21 3.563,22 5.243,23 3.567,24 4.56,25 4.731,26 4.001,27 3.95,28 5.672,29 3.924,30 4.812,31 5.037,32 4,33 4.023,34 5.883,35 3.968,36 4.819,37 5.062,38 4.001,39 3.989,40 6.014,41 3.939,42 4.743,43 4.958,44 4.032,45 4.014,46 5.943,47 3.978,48 4.723,49 4.908,50 4.037,51 4.054,52 5.931,53 4.019,54 4.817,55 5.035,56 3.944,57 3.984,58 6.039,59 3.93,60 4.682,61 4.94,62 3.717,63 3.772,64 5.839,65 3.714,66 0.12,67 0.818,68 9.382,69 4.034,70 4.523}
{0 CHEMBL38380,1 13.45,2 18.948,3 0.012,4 -0.239,5 0.534,7 4.166,8 4.166,11 1.708,12 7.1,13 0.713,14 0.509,15 78.321,16 7.876,17 0.5,18 3.721,19 3.828,20 3.536,21 3.305,22 4.699,23 3.248,24 4.303,25 4.473,26 3.816,27 3.711,28 5.53,29 3.631,30 4.599,31 4.802,32 3.986,33 3.946,34 5.61,35 3.825,36 4.716,37 4.917,38 3.916,39 3.903,40 5.871,41 3.768,42 4.588,43 4.795,44 3.706,45 3.676,46 5.884,47 3.599,48 4.349,49 4.556,50 3.266,51 3.502,52 5.541,53 3.4,54 4.205,55 4.46,56 2.969,57 3.429,58 4.944,59 3.246,60 4.16,61 4.481,62 2.567,63 3.132,64 4.844,65 2.903,66 0.079,67 0.592,68 10.365,69 3.712,70 5.2}
{0 CHEMBL384304,1 28.462,2 46.697,3 0.008,4 -0.177,5 1.361,7 4.285,8 4.285,9 4.952,10 1,11 1.968,12 12.033,13 1.658,14 2.749,15 109.44,16 8.657,17 0.375,18 4.056,19 4.16,20 3.858,21 3.537,22 5.251,23 3.538,24 4.617,25 4.777,26 4.158,27 3.908,28 5.995,29 3.907,30 4.88,31 5.061,32 4.271,33 4.064,34 6.262,35 4.058,36 4.97,37 5.157,38 4.23,39 4.054,40 6.454,41 4.03,42 4.944,43 5.176,44 4.081,45 3.955,46 6.289,47 3.925,48 4.789,49 5.011,50 4.025,51 3.819,52 6.221,53 3.798,54 4.649,55 4.869,56 3.851,57 3.69,58 6.013,59 3.657,60 4.55,61 4.811,62 3.677,63 3.553,64 5.847,65 3.48,66 0.25,67 0.925,68 11.052,69 4.708,70 5}
{0 CHEMBL386051,1 23.154,2 34.898,3 0.01,4 -0.137,5 0.52,6 0.293,7 3.954,8 3.954,11 1.798,12 11.517,13 5.639,14 31.799,15 120.773,16 9.853,17 0.563,18 3.925,19 4.019,20 3.771,21 3.606,22 5.109,23 3.562,24 4.407,25 4.542,26 4.162,27 3.993,28 5.588,29 3.932,30 4.606,31 4.736,32 4.319,33 4.134,34 5.827,35 4.071,36 4.7,37 4.859,38 4.382,39 4.114,40 5.972,41 4.039,42 4.663,43 4.826,44 4.251,45 4.029,46 5.964,47 3.963,48 4.617,49 4.812,50 4.146,51 3.951,52 5.833,53 3.877,54 4.534,55 4.731,56 3.974,57 3.865,58 5.693,59 3.748,60 4.302,61 4.512,62 3.657,63 3.654,64 5.367,65 3.54,66 0.062,67 0.634,68 4.901,69 3.483,70 5}
{0 CHEMBL387971,1 22.157,2 24.611,3 0.001,4 -0.103,5 0.447,6 0.8,7 3.931,8 3.931,9 10.34,10 2,11 1.606,12 16.118,13 3.853,14 14.843,15 138.642,16 7.688,17 0.421,18 4.233,19 4.344,20 3.873,21 3.795,22 5.281,23 3.759,24 4.805,25 4.983,26 4.211,27 4.198,28 5.777,29 4.145,30 4.944,31 5.128,32 4.211,33 4.309,34 5.935,35 4.219,36 5.083,37 5.329,38 4.2,39 4.312,40 6.029,41 4.191,42 5.009,43 5.253,44 4.166,45 4.228,46 5.96,47 4.114,48 4.771,49 4.948,50 4.084,51 4.141,52 5.83,53 4.037,54 4.78,55 5.005,56 4.005,57 4.12,58 5.715,59 3.996,60 4.724,61 4.904,62 3.998,63 4.065,64 5.762,65 3.952,66 0.04,67 0.917,68 13.044,69 5.977,70 5.2}
{0 CHEMBL392642,1 23.167,2 32.931,3 0.039,4 0.013,5 0.399,6 0.4,7 3.801,8 3.801,11 1.648,12 12.241,13 3.741,14 13.997,15 122.016,16 7.309,17 0.387,18 4.124,19 4.264,20 3.702,21 3.643,22 5.199,23 3.588,24 4.674,25 4.867,26 4,27 4.052,28 5.756,29 3.953,30 4.965,31 5.208,32 4.099,33 4.202,34 5.856,35 4.074,36 5.08,37 5.348,38 4.025,39 4.155,40 6.11,41 4.007,42 4.989,43 5.28,44 3.834,45 4.041,46 5.848,47 3.895,48 4.862,49 5.138,50 3.904,51 3.93,52 5.839,53 3.837,54 4.758,55 4.992,56 3.937,57 3.923,58 5.828,59 3.857,60 4.811,61 5.04,62 3.875,63 3.898,64 5.947,65 3.829,66 0.145,67 0.891,68 13.308,69 5.179,70 5.2}
{0 CHEMBL394619,1 17.311,2 24.218,3 0.091,4 0.094,5 0.244,7 3.686,8 3.686,11 1.596,12 11.852,13 4.031,14 16.251,15 110.81,16 8.322,17 0.733,18 3.915,19 4.029,20 3.622,21 3.567,22 5.091,23 3.523,24 4.371,25 4.508,26 3.985,27 3.954,28 5.546,29 3.882,30 4.587,31 4.759,32 3.99,33 4.044,34 5.686,35 3.955,36 4.652,37 4.856,38 3.997,39 4.002,40 5.76,41 3.896,42 4.609,43 4.822,44 3.774,45 3.882,46 5.738,47 3.765,48 4.458,49 4.687,50 3.612,51 3.713,52 5.565,53 3.614,54 4.312,55 4.529,56 3.435,57 3.595,58 5.379,59 3.495,60 4.224,61 4.46,62 3.379,63 3.536,64 5.209,65 3.407,66 0.037,67 0.662,68 8.085,69 3.793,70 5.2}
{0 CHEMBL394790,1 16.486,2 22.737,3 0.097,4 0.107,5 0.327,7 3.686,8 3.686,11 1.748,12 11.852,13 4.209,14 17.719,15 110.574,16 9.403,17 0.733,18 3.863,19 3.966,20 3.666,21 3.541,22 5.075,23 3.502,24 4.306,25 4.42,26 4.05,27 3.933,28 5.548,29 3.865,30 4.539,31 4.701,32 4.057,33 4.015,34 5.686,35 3.928,36 4.551,37 4.728,38 4.065,39 3.952,40 5.743,41 3.858,42 4.526,43 4.719,44 3.813,45 3.843,46 5.71,47 3.731,48 4.367,49 4.57,50 3.729,51 3.669,52 5.599,53 3.584,54 4.22,55 4.43,56 3.482,57 3.57,58 5.268,59 3.463,60 4.149,61 4.367,62 3.496,63 3.504,64 5.211,65 3.379,66 0.069,67 0.609,68 5.629,69 3.238,70 5.2}
{0 CHEMBL396523,1 21.251,2 40.027,3 0.071,4 -0.002,5 0.48,7 3.95,8 3.95,11 1.675,12 10.462,13 3.46,14 11.97,15 96.728,16 8.659,17 0.759,18 3.84,19 3.955,20 3.525,21 3.376,22 5.115,23 3.401,24 4.271,25 4.403,26 3.875,27 3.738,28 5.63,29 3.744,30 4.48,31 4.663,32 3.85,33 3.798,34 5.661,35 3.781,36 4.508,37 4.713,38 3.787,39 3.711,40 5.753,41 3.687,42 4.431,43 4.643,44 3.67,45 3.622,46 5.656,47 3.606,48 4.313,49 4.509,50 3.657,51 3.592,52 5.578,53 3.571,54 4.278,55 4.48,56 3.586,57 3.509,58 5.518,59 3.489,60 4.179,61 4.396,62 3.408,63 3.375,64 5.436,65 3.331,66 0.139,67 0.662,68 6.045,69 2.928,70 7.4}
{0 CHEMBL398951,1 24.866,2 29.046,3 0.004,4 -0.086,5 0.442,6 0.8,7 3.849,8 3.849,9 11.425,10 2,11 1.526,12 14.968,13 3.785,14 14.322,15 119.477,16 7.42,17 0.486,18 4.137,19 4.254,20 3.717,21 3.678,22 5.201,23 3.664,24 4.708,25 4.88,26 4.05,27 4.083,28 5.674,29 4.048,30 4.933,31 5.148,32 4.062,33 4.204,34 5.862,35 4.123,36 4.959,37 5.202,38 3.937,39 4.167,40 5.838,41 4.053,42 4.935,43 5.205,44 3.86,45 4.067,46 5.78,47 3.95,48 4.768,49 5.01,50 3.768,51 3.969,52 5.613,53 3.862,54 4.715,55 4.951,56 3.713,57 3.902,58 5.624,59 3.801,60 4.642,61 4.885,62 3.656,63 3.806,64 5.623,65 3.715,66 0.035,67 0.845,68 11.471,69 5.1,70 5.2}
{0 CHEMBL402846,1 20.429,2 27.095,3 0.051,4 -0.012,5 0.647,7 3.891,8 3.891,11 1.659,12 12,13 3.225,14 10.398,15 110.654,16 8.135,17 0.688,18 3.993,19 4.122,20 3.627,21 3.529,22 5.222,23 3.534,24 4.466,25 4.63,26 4.004,27 3.909,28 5.7,29 3.901,30 4.676,31 4.851,32 4.064,33 4.037,34 5.918,35 4.011,36 4.778,37 4.988,38 4.011,39 4.011,40 5.974,41 3.965,42 4.742,43 4.965,44 3.925,45 3.9,46 6.093,47 3.859,48 4.661,49 4.906,50 3.702,51 3.789,52 5.823,53 3.725,54 4.448,55 4.677,56 3.526,57 3.656,58 5.576,59 3.578,60 4.371,61 4.616,62 3.487,63 3.563,64 5.496,65 3.481,66 0.11,67 0.836,68 8.332,69 3.797,70 5.2}
{0 CHEMBL404367,1 20.473,2 29.218,3 0.049,4 0.007,5 0.361,7 3.739,8 3.739,11 1.539,12 11.929,13 3.019,14 9.115,15 110.437,16 7.76,17 0.71,18 3.984,19 4.116,20 3.586,21 3.53,22 5.165,23 3.523,24 4.454,25 4.623,26 3.947,27 3.911,28 5.619,29 3.885,30 4.656,31 4.839,32 3.977,33 4.04,34 5.772,35 3.989,36 4.757,37 4.975,38 3.948,39 4.014,40 5.866,41 3.944,42 4.727,43 4.957,44 3.815,45 3.902,46 5.898,47 3.839,48 4.638,49 4.891,50 3.652,51 3.793,52 5.702,53 3.706,54 4.436,55 4.67,56 3.434,57 3.659,58 5.473,59 3.557,60 4.345,61 4.601,62 3.382,63 3.567,64 5.313,65 3.451,66 0.071,67 0.769,68 9.087,69 3.767,70 5.2}
{0 CHEMBL411903,1 29.523,2 42.357,3 0.064,4 -0.096,5 1.237,6 0.4,7 3.996,8 3.996,11 1.856,12 13.576,13 3.544,14 12.556,15 116.173,16 9.189,17 0.5,18 4.06,19 4.181,20 3.769,21 3.544,22 5.363,23 3.592,24 4.57,25 4.718,26 4.218,27 3.916,28 6.283,29 3.953,30 4.813,31 4.998,32 4.275,33 4.068,34 6.197,35 4.091,36 4.88,37 5.087,38 4.169,39 4.012,40 6.256,41 4.023,42 4.82,43 5.028,44 4.14,45 3.945,46 6.28,47 3.954,48 4.779,49 5.003,50 4.014,51 3.862,52 6.357,53 3.846,54 4.611,55 4.839,56 3.908,57 3.73,58 6.205,59 3.712,60 4.461,61 4.683,62 3.697,63 3.617,64 5.778,65 3.598,66 0.308,67 1.108,68 6.406,69 3.891,70 6}
{0 CHEMBL412142,1 22.72,2 29.273,3 0.013,4 -0.193,5 0.363,7 3.814,8 3.814,11 1.661,12 13.563,13 4.476,14 20.037,15 127.573,16 9.308,17 0.657,18 4.031,19 4.15,20 3.783,21 3.618,22 5.253,23 3.614,24 4.506,25 4.669,26 4.157,27 3.988,28 5.692,29 3.96,30 4.719,31 4.915,32 4.213,33 4.086,34 5.87,35 4.031,36 4.722,37 4.931,38 4.264,39 4.039,40 5.931,41 3.982,42 4.673,43 4.877,44 4.132,45 4.021,46 5.786,47 3.966,48 4.709,49 4.91,50 4.217,51 4.022,52 5.874,53 3.963,54 4.73,55 4.956,56 4.098,57 4.016,58 5.803,59 3.927,60 4.64,61 4.849,62 4.034,63 3.931,64 5.756,65 3.826,66 0.094,67 0.803,68 6.356,69 3.566,70 5.2}
{0 CHEMBL412281,1 27.087,2 37.402,3 0.005,4 -0.147,5 0.342,7 3.962,8 3.962,11 1.561,12 10.69,13 3.65,14 13.324,15 114.822,16 7.75,17 0.688,18 4.025,19 4.16,20 3.629,21 3.542,22 5.189,23 3.54,24 4.509,25 4.694,26 3.985,27 3.906,28 5.648,29 3.889,30 4.681,31 4.873,32 4.069,33 4.005,34 5.826,35 3.985,36 4.772,37 4.983,38 4.038,39 4.015,40 5.923,41 3.982,42 4.752,43 4.972,44 4.01,45 4.044,46 5.813,47 3.991,48 4.764,49 4.976,50 4.014,51 4.062,52 5.834,53 4.011,54 4.821,55 5.046,56 3.945,57 4.03,58 5.909,59 3.963,60 4.778,61 5.032,62 3.771,63 3.931,64 5.782,65 3.839,66 0.069,67 0.82,68 9.519,69 3.838,70 4.523}
{0 CHEMBL413779,1 28.198,2 37.762,3 -0.016,4 -0.24,5 1.072,6 0.86,7 3.961,8 3.961,9 16.767,10 3,11 1.836,12 11.667,13 2.6,14 6.762,15 106.798,16 8.678,17 0.375,18 4.039,19 4.136,20 3.71,21 3.485,22 5.262,23 3.517,24 4.562,25 4.705,26 4.049,27 3.826,28 5.777,29 3.835,30 4.824,31 5.01,32 4.208,33 3.963,34 6.048,35 3.963,36 4.816,37 4.991,38 4.223,39 4.012,40 6.058,41 3.999,42 4.909,43 5.084,44 4.263,45 4.096,46 6.146,47 4.07,48 4.987,49 5.167,50 4.325,51 4.139,52 6.248,53 4.112,54 4.999,55 5.186,56 4.254,57 4.179,58 6.2,59 4.136,60 4.95,61 5.17,62 4.057,63 4.031,64 6.154,65 3.953,66 0.225,67 0.723,68 8.126,69 4.15,70 5.2}
{0 CHEMBL41783,1 15.19,2 18.855,3 -0.01,4 -0.072,5 0.759,7 4.061,8 4.061,11 1.776,12 10.923,13 2.367,14 5.602,15 92.456,16 8.191,17 0.571,18 3.904,19 4.038,20 3.534,21 3.37,22 5.139,23 3.388,24 4.418,25 4.608,26 3.885,27 3.731,28 5.627,29 3.739,30 4.632,31 4.833,32 3.962,33 3.815,34 6.023,35 3.806,36 4.711,37 4.972,38 3.855,39 3.747,40 5.933,41 3.719,42 4.548,43 4.778,44 3.796,45 3.646,46 5.892,47 3.636,48 4.465,49 4.694,50 3.751,51 3.583,52 5.75,53 3.581,54 4.408,55 4.619,56 3.676,57 3.479,58 5.795,59 3.492,60 4.317,61 4.56,62 3.521,63 3.387,64 5.596,65 3.364,66 0.165,67 0.836,68 7.672,69 3.607,70 5.2}
{0 CHEMBL422897,1 20.975,2 26.694,3 0.069,4 0.009,5 1.022,7 3.939,8 3.939,9 6.002,10 1,11 1.621,12 9.179,13 3.058,14 9.351,15 107.239,16 8.372,17 0.387,18 3.998,19 4.081,20 3.643,21 3.551,22 5.185,23 3.547,24 4.526,25 4.657,26 4.068,27 3.981,28 5.672,29 3.964,30 4.86,31 5.01,32 4.257,33 4.182,34 6.024,35 4.146,36 4.993,37 5.169,38 4.32,39 4.174,40 6.329,41 4.136,42 4.957,43 5.122,44 4.179,45 4.12,46 6.224,47 4.086,48 4.873,49 5.039,50 4.168,51 4.068,52 6.187,53 4.031,54 4.776,55 4.936,56 4.086,57 3.998,58 6.148,59 3.954,60 4.756,61 4.918,62 3.985,63 3.903,64 6.093,65 3.826,66 0.15,67 0.625,68 8.515,69 4.62,70 6.4}
{0 CHEMBL424872,1 19.76,2 20.266,3 0.043,4 -0.032,5 0.712,6 0.86,7 4.167,8 4.167,9 5.257,10 1,11 1.811,12 11.192,13 1.429,14 2.043,15 97.336,16 8.51,17 0.444,18 3.879,19 3.975,20 3.689,21 3.445,22 5.1,23 3.412,24 4.383,25 4.523,26 3.928,27 3.767,28 5.786,29 3.735,30 4.602,31 4.76,32 3.995,33 3.869,34 5.97,35 3.839,36 4.623,37 4.797,38 3.914,39 3.812,40 6.061,41 3.777,42 4.598,43 4.812,44 3.742,45 3.726,46 5.925,47 3.667,48 4.441,49 4.637,50 3.639,51 3.634,52 5.718,53 3.57,54 4.455,55 4.662,56 3.535,57 3.545,58 5.874,59 3.476,60 4.355,61 4.612,62 3.445,63 3.463,64 5.441,65 3.367,66 0.141,67 0.666,68 9.712,69 4.313,70 5.2}
{0 CHEMBL428690,1 20.975,2 26.694,3 0.069,4 0.009,5 1.022,7 3.939,8 3.939,9 6.002,10 1,11 1.621,12 9.179,13 3.058,14 9.351,15 107.239,16 8.372,17 0.387,18 3.998,19 4.081,20 3.643,21 3.551,22 5.185,23 3.547,24 4.526,25 4.657,26 4.068,27 3.981,28 5.672,29 3.964,30 4.86,31 5.01,32 4.257,33 4.182,34 6.024,35 4.146,36 4.993,37 5.169,38 4.32,39 4.174,40 6.329,41 4.136,42 4.957,43 5.122,44 4.179,45 4.12,46 6.224,47 4.086,48 4.873,49 5.039,50 4.168,51 4.068,52 6.187,53 4.031,54 4.776,55 4.936,56 4.086,57 3.998,58 6.148,59 3.954,60 4.756,61 4.918,62 3.985,63 3.903,64 6.093,65 3.826,66 0.15,67 0.625,68 8.515,69 4.62,70 5}
{0 CHEMBL437747,1 25.741,2 33.9,3 0.012,4 -0.179,5 0.526,7 3.854,8 3.854,11 1.487,12 11.029,13 7.07,14 49.989,15 144.886,16 7.443,17 0.436,18 4.317,19 4.453,20 3.891,21 3.877,22 5.256,23 3.826,24 4.916,25 5.115,26 4.283,27 4.313,28 5.804,29 4.225,30 5.236,31 5.495,32 4.446,33 4.473,34 6.059,35 4.348,36 5.233,37 5.497,38 4.347,39 4.441,40 6.065,41 4.336,42 5.184,43 5.416,44 4.434,45 4.498,46 6.09,47 4.415,48 5.269,49 5.478,50 4.533,51 4.626,52 6.187,53 4.524,54 5.426,55 5.664,56 4.542,57 4.709,58 6.272,59 4.567,60 5.503,61 5.77,62 4.521,63 4.688,64 6.32,65 4.516,66 0.049,67 1.039,68 15.05,69 6.273,70 6}
{0 CHEMBL440084,1 9.425,2 10.192,3 0.053,4 -0.021,5 0.402,7 3.898,8 3.898,9 10.922,10 2,11 1.606,12 10.207,13 3.447,14 11.883,15 105.223,16 8.543,17 0.697,18 3.957,19 4.051,20 3.643,21 3.535,22 5.176,23 3.553,24 4.434,25 4.545,26 4.02,27 3.915,28 5.695,29 3.921,30 4.594,31 4.749,32 4.013,33 3.993,34 5.775,35 3.97,36 4.636,37 4.811,38 3.971,39 3.955,40 5.818,41 3.931,42 4.634,43 4.841,44 3.904,45 3.946,46 5.704,47 3.9,48 4.537,49 4.718,50 3.938,51 3.936,52 5.626,53 3.901,54 4.564,55 4.719,56 3.968,57 3.968,58 5.784,59 3.929,60 4.65,61 4.842,62 3.824,63 3.933,64 5.743,65 3.866,66 0.091,67 0.655,68 6.777,69 3.634,70 5}
{0 CHEMBL443962,1 5.957,2 5.327,3 -0.037,4 -0.119,5 0.183,7 3.794,8 3.794,9 5.139,10 1,11 1.733,12 8.389,13 2.733,14 7.47,15 72.677,16 10.863,17 0.8,18 3.478,19 3.574,20 3.379,21 3.089,22 4.66,23 3.078,24 3.945,25 4.081,26 3.79,27 3.454,28 5.081,29 3.431,30 4.051,31 4.194,32 3.97,33 3.517,34 5.206,35 3.466,36 4.017,37 4.196,38 3.594,39 3.436,40 5.057,41 3.328,42 3.999,43 4.252,44 3.269,45 3.241,46 4.908,47 3.097,48 3.697,49 3.945,50 3.149,51 2.955,52 4.653,53 2.88,54 3.389,55 3.521,56 3.293,57 2.872,58 4.528,59 2.778,60 3.321,61 3.491,62 3.171,63 2.734,64 4.373,65 2.554,66 0.055,67 0.412,68 1.709,69 2.209,70 5.2}
{0 CHEMBL445813,1 24.567,2 37.709,3 0.051,4 0.014,5 0.729,7 3.961,8 3.961,11 1.842,12 10.12,13 1.599,14 2.557,15 95.872,16 9.102,17 0.407,18 3.859,19 3.982,20 3.576,21 3.39,22 5.015,23 3.383,24 4.388,25 4.548,26 3.967,27 3.795,28 5.554,29 3.756,30 4.68,31 4.897,32 4.075,33 3.91,34 5.81,35 3.833,36 4.655,37 4.867,38 4.232,39 3.795,40 6.037,41 3.747,42 4.505,43 4.704,44 3.776,45 3.629,46 5.817,47 3.6,48 4.35,49 4.516,50 3.873,51 3.634,52 5.752,53 3.61,54 4.413,55 4.599,56 3.951,57 3.659,58 5.635,59 3.611,60 4.405,61 4.639,62 3.707,63 3.471,64 5.673,65 3.399,66 0.148,67 0.646,68 6.342,69 3.323,70 5}
{0 CHEMBL450786,1 34.756,2 41.308,3 0.036,4 -0.094,5 1.257,6 0.8,7 4.334,8 4.334,11 1.709,12 15.419,13 5.69,14 32.372,15 171.59,16 8.333,17 0.354,18 4.444,19 4.548,20 4.198,21 4.062,22 5.463,23 4.009,24 5.04,25 5.2,26 4.583,27 4.506,28 6.166,29 4.438,30 5.321,31 5.513,32 4.683,33 4.666,34 6.394,35 4.564,36 5.408,37 5.607,38 4.83,39 4.684,40 6.545,41 4.57,42 5.401,43 5.596,44 4.765,45 4.644,46 6.664,47 4.572,48 5.397,49 5.589,50 4.677,51 4.71,52 6.491,53 4.618,54 5.514,55 5.744,56 4.543,57 4.69,58 6.624,59 4.552,60 5.394,61 5.657,62 4.505,63 4.555,64 6.445,65 4.424,66 0.103,67 1.119,68 16.315,69 7.664,70 5}
{0 CHEMBL451964,1 13.942,2 21.654,3 0.015,4 -0.018,5 0.657,7 3.833,8 3.833,11 1.758,12 9.348,13 3.664,14 13.427,15 81.975,16 9.123,17 0.615,18 3.729,19 3.847,20 3.455,21 3.24,22 4.942,23 3.277,24 4.253,25 4.407,26 3.884,27 3.562,28 5.994,29 3.595,30 4.371,31 4.585,32 3.808,33 3.592,34 5.666,35 3.613,36 4.38,37 4.593,38 3.748,39 3.507,40 5.761,41 3.553,42 4.259,43 4.481,44 3.536,45 3.412,46 5.526,47 3.424,48 4.077,49 4.285,50 3.388,51 3.364,52 5.172,53 3.335,54 4.075,55 4.286,56 3.484,57 3.258,58 5.474,59 3.248,60 4.026,61 4.254,62 3.377,63 3.079,64 5.622,65 3.091,66 0.197,67 0.814,68 4.478,69 3.008,70 5.2}
{0 CHEMBL458997,1 36.264,2 58.098,3 -0.021,4 -0.278,5 0.637,6 0.8,7 3.943,8 3.943,9 11.021,10 2,11 1.713,12 13.182,13 3.918,14 15.348,15 128.203,16 8.086,17 0.5,18 4.174,19 4.293,20 3.805,21 3.656,22 5.306,23 3.661,24 4.698,25 4.87,26 4.153,27 4.02,28 5.807,29 4.006,30 4.895,31 5.085,32 4.286,33 4.164,34 6.006,35 4.131,36 4.936,37 5.13,38 4.198,39 4.197,40 6.039,41 4.132,42 5.01,43 5.235,44 4.239,45 4.217,46 6.067,47 4.147,48 4.994,49 5.214,50 4.237,51 4.183,52 6.055,53 4.114,54 4.905,55 5.117,56 4.207,57 4.077,58 6.036,59 4.01,60 4.83,61 5.069,62 4.034,63 3.978,64 5.899,65 3.88,66 0.103,67 0.88,68 10.837,69 4.726,70 5.2}
{0 CHEMBL462120,1 10.664,2 12.133,3 0.11,4 0.204,5 0.165,7 3.591,8 3.591,11 1.618,12 6.368,13 2.199,14 4.835,15 76.305,16 9.024,17 0.571,18 3.523,19 3.626,20 3.248,21 3.192,22 4.744,23 3.169,24 3.969,25 4.08,26 3.646,27 3.586,28 5.195,29 3.543,30 4.242,31 4.393,32 3.743,33 3.718,34 5.494,35 3.655,36 4.256,37 4.427,38 3.664,39 3.663,40 5.454,41 3.598,42 4.24,43 4.413,44 3.701,45 3.621,46 5.521,47 3.557,48 4.234,49 4.434,50 3.543,51 3.482,52 5.517,53 3.376,54 3.967,55 4.213,56 3.031,57 3.075,58 5.163,59 2.883,60 3.23,61 3.545,62 1.858,63 2.223,64 4.054,65 1.935,66 0.046,67 0.401,68 4.148,69 2.265,70 5.2}
{0 CHEMBL464552,1 39.545,2 63.795,3 -0.011,4 -0.258,5 1.107,6 0.835,7 4.128,8 4.128,9 5.63,10 1,11 1.705,12 13.282,13 3.582,14 12.832,15 146.018,16 7.833,17 0.512,18 4.338,19 4.466,20 3.94,21 3.803,22 5.502,23 3.818,24 4.868,25 5.055,26 4.32,27 4.196,28 6.012,29 4.197,30 5.056,31 5.235,32 4.419,33 4.335,34 6.24,35 4.322,36 5.189,37 5.394,38 4.486,39 4.357,40 6.484,41 4.341,42 5.204,43 5.413,44 4.396,45 4.351,46 6.39,47 4.335,48 5.181,49 5.389,50 4.423,51 4.424,52 6.317,53 4.38,54 5.271,55 5.504,56 4.445,57 4.439,58 6.349,59 4.386,60 5.233,61 5.467,62 4.417,63 4.344,64 6.455,65 4.302,66 0.14,67 1.145,68 13.017,69 5.346,70 5}
{0 CHEMBL468280,1 16.893,2 25.798,3 0.025,4 -0.059,5 0.751,7 3.923,8 3.923,11 2.023,12 6.211,13 3.229,14 10.428,15 66.431,16 10.469,17 0.524,18 3.488,19 3.554,20 3.312,21 3.022,22 4.835,23 3.067,24 3.976,25 4.083,26 3.76,27 3.421,28 5.351,29 3.466,30 4.2,31 4.325,32 3.953,33 3.527,34 5.698,35 3.585,36 4.225,37 4.329,38 3.871,39 3.511,40 5.817,41 3.552,42 4.199,43 4.343,44 3.696,45 3.412,46 5.696,47 3.405,48 4.102,49 4.256,50 3.513,51 3.091,52 5.582,53 3.081,54 3.646,55 3.832,56 2.955,57 2.311,58 5.473,59 2.319,60 2.538,61 2.828,62 1.719,63 1.101,64 4.148,65 1.099,66 0.247,67 0.452,68 2.073,69 2.277,70 5.2}
{0 CHEMBL474432,1 26.266,2 28.948,3 -0.004,4 -0.102,5 1.943,6 0.86,7 4.08,8 4.08,9 16.14,10 3,11 1.925,12 11.818,13 5.287,14 27.951,15 114.465,16 9.57,17 0.583,18 4.065,19 4.133,20 3.851,21 3.591,22 5.353,23 3.617,24 4.59,25 4.698,26 4.316,27 3.959,28 6.286,29 3.986,30 4.668,31 4.766,32 4.374,33 4.058,34 6.007,35 4.074,36 4.836,37 4.959,38 4.396,39 4.11,40 6.264,41 4.112,42 4.937,43 5.116,44 4.254,45 4.045,46 6.331,47 4.024,48 4.699,49 4.856,50 4.166,51 3.979,52 5.981,53 3.96,54 4.723,55 4.874,56 4.26,57 3.985,58 6.112,59 3.97,60 4.7,61 4.839,62 4.282,63 3.86,64 6.169,65 3.881,66 0.349,67 0.898,68 5.928,69 4.939,70 5.2}
{0 CHEMBL475251,1 39.73,2 67.244,3 -0.04,4 -0.275,5 1.125,6 0.86,7 3.999,8 3.999,9 21.647,10 4,11 1.811,12 13.294,13 3.881,14 15.065,15 120.223,16 8.255,17 0.486,18 4.181,19 4.287,20 3.819,21 3.59,22 5.41,23 3.639,24 4.696,25 4.852,26 4.212,27 3.93,28 5.928,29 3.987,30 4.871,31 5.003,32 4.354,33 4.072,34 6.256,35 4.124,36 4.965,37 5.15,38 4.237,39 4.11,40 6.19,41 4.106,42 4.971,43 5.17,44 4.157,45 4.096,46 6.144,47 4.074,48 4.931,49 5.145,50 4.061,51 4.021,52 6.123,53 3.982,54 4.857,55 5.115,56 4.009,57 3.875,58 5.993,59 3.849,60 4.682,61 4.9,62 3.99,63 3.738,64 5.985,65 3.776,66 0.241,67 0.916,68 9.999,69 4.578,70 6.655}
{0 CHEMBL477772,1 26.988,2 41.389,3 0.011,4 -0.169,5 0.678,7 4.582,8 4.582,11 1.719,12 11.968,13 3.864,14 14.932,15 122.737,16 8.103,17 0.647,18 4.104,19 4.224,20 3.876,21 3.648,22 5.22,23 3.62,24 4.618,25 4.794,26 4.174,27 4.016,28 5.962,29 3.99,30 4.786,31 4.955,32 4.224,33 4.173,34 5.958,35 4.124,36 4.937,37 5.132,38 4.161,39 4.214,40 6.076,41 4.121,42 5.003,43 5.255,44 4.006,45 4.116,46 6.109,47 4.009,48 4.823,49 5.085,50 3.915,51 3.953,52 5.83,53 3.865,54 4.627,55 4.861,56 3.942,57 3.859,58 5.821,59 3.799,60 4.578,61 4.779,62 3.856,63 3.88,64 5.703,65 3.799,66 0.138,67 0.904,68 12.929,69 4.722,70 5}
{0 CHEMBL481491,1 19.58,2 21.755,3 0.045,4 -0.033,5 1.456,7 4.054,8 4.054,9 5.587,10 1,11 1.909,12 10.31,13 4.718,14 22.255,15 103.36,16 9.708,17 0.656,18 3.911,19 3.998,20 3.721,21 3.509,22 5.187,23 3.514,24 4.425,25 4.534,26 4.203,27 3.891,28 6.162,29 3.89,30 4.559,31 4.692,32 4.212,33 3.954,34 5.863,35 3.937,36 4.655,37 4.801,38 4.21,39 3.948,40 6.081,41 3.928,42 4.688,43 4.873,44 4.032,45 3.841,46 6.136,47 3.806,48 4.401,49 4.554,50 3.933,51 3.771,52 5.722,53 3.742,54 4.456,55 4.598,56 4.039,57 3.81,58 5.893,59 3.789,60 4.537,61 4.703,62 4.085,63 3.689,64 6.017,65 3.71,66 0.221,67 0.844,68 4.718,69 3.921,70 5.2}
{0 CHEMBL482767,1 23.036,2 35.147,3 0.048,4 -0.097,5 0.435,7 3.746,8 3.746,11 1.911,12 12.821,13 3.954,14 15.631,15 115.077,16 10.023,17 0.677,18 3.9,19 4.002,20 3.79,21 3.557,22 5.086,23 3.509,24 4.37,25 4.502,26 4.191,27 3.935,28 5.589,29 3.853,30 4.541,31 4.719,32 4.088,33 3.923,34 5.641,35 3.819,36 4.495,37 4.685,38 4.052,39 3.822,40 5.678,41 3.727,42 4.443,43 4.64,44 3.791,45 3.735,46 5.58,47 3.621,48 4.336,49 4.53,50 3.886,51 3.695,52 5.509,53 3.578,54 4.273,55 4.464,56 3.926,57 3.724,58 5.366,59 3.574,60 4.168,61 4.332,62 3.989,63 3.669,64 5.342,65 3.529,66 0.103,67 0.706,68 4.9,69 3.48,70 5.2}
{0 CHEMBL482967,1 25.529,2 38.25,3 0.018,4 -0.189,5 0.294,7 3.717,8 3.717,9 5.399,10 1,11 1.676,12 11.692,13 2.744,14 7.528,15 105.217,16 8.011,17 0.586,18 3.952,19 4.077,20 3.63,21 3.493,22 5.047,23 3.465,24 4.472,25 4.646,26 4.02,27 3.864,28 5.535,29 3.815,30 4.644,31 4.853,32 3.958,33 3.963,34 5.611,35 3.878,36 4.64,37 4.851,38 3.848,39 3.979,40 5.581,41 3.849,42 4.67,43 4.916,44 3.807,45 3.894,46 5.644,47 3.782,48 4.601,49 4.867,50 3.618,51 3.739,52 5.526,53 3.62,54 4.342,55 4.596,56 3.47,57 3.547,58 5.289,59 3.427,60 4.182,61 4.418,62 3.445,63 3.476,64 5.113,65 3.36,66 0.046,67 0.757,68 9.387,69 3.959,70 5.3}
{0 CHEMBL483158,1 32.111,2 47.196,3 0.019,4 -0.095,5 0.78,6 0.795,7 4.059,8 4.059,9 10.633,10 2,11 1.783,12 12.595,13 5.929,14 35.153,15 136.709,16 9.105,17 0.585,18 4.178,19 4.263,20 3.904,21 3.751,22 5.443,23 3.766,24 4.664,25 4.788,26 4.294,27 4.129,28 5.983,29 4.137,30 4.877,31 5,32 4.473,33 4.32,34 6.144,35 4.325,36 5.017,37 5.165,38 4.522,39 4.348,40 6.392,41 4.345,42 5.064,43 5.228,44 4.497,45 4.392,46 6.296,47 4.371,48 5.118,49 5.303,50 4.486,51 4.368,52 6.381,53 4.332,54 5.022,55 5.222,56 4.442,57 4.293,58 6.254,59 4.236,60 4.903,61 5.101,62 4.255,63 4.151,64 6.176,65 4.088,66 0.188,67 0.856,68 7.414,69 4.838,70 5.2}
{0 CHEMBL483321,1 26.984,2 35.961,3 -0.009,4 -0.171,5 0.388,6 0.546,7 3.911,8 3.911,9 10.781,10 2,11 1.549,12 16.286,13 4.201,14 17.647,15 136.188,16 7.574,17 0.605,18 4.219,19 4.334,20 3.798,21 3.75,22 5.372,23 3.741,24 4.713,25 4.881,26 4.114,27 4.088,28 5.834,29 4.065,30 4.892,31 5.066,32 4.171,33 4.211,34 6.035,35 4.164,36 4.97,37 5.189,38 4.054,39 4.205,40 5.978,41 4.122,42 4.93,43 5.153,44 4.037,45 4.194,46 5.95,47 4.11,48 4.912,49 5.13,50 4.015,51 4.194,52 5.905,53 4.104,54 4.919,55 5.161,56 3.979,57 4.16,58 5.887,59 4.063,60 4.817,61 5.03,62 3.921,63 4.071,64 5.859,65 3.981,66 0.036,67 0.9,68 12.045,69 5.384,70 5}
{0 CHEMBL484390,1 23.435,2 26.047,3 -0.004,4 -0.184,5 0.461,6 0.555,7 3.8,8 3.8,11 1.475,12 13.471,13 5.538,14 30.671,15 131.385,16 7.04,17 0.432,18 4.245,19 4.375,20 3.764,21 3.794,22 5.313,23 3.758,24 4.814,25 5.007,26 4.119,27 4.203,28 5.797,29 4.135,30 5.117,31 5.353,32 4.223,33 4.347,34 6.108,35 4.263,36 5.173,37 5.411,38 4.195,39 4.316,40 6.276,41 4.234,42 5.11,43 5.35,44 4.149,45 4.278,46 6.155,47 4.199,48 5.088,49 5.319,50 4.143,51 4.315,52 6.128,53 4.221,54 5.109,55 5.348,56 4.099,57 4.317,58 6.157,59 4.208,60 5.052,61 5.299,62 3.988,63 4.265,64 5.996,65 4.135,66 0.031,67 0.961,68 13.892,69 5.914,70 5.2}
{0 CHEMBL485556,1 24.946,2 28.086,3 0.018,4 -0.132,5 0.524,6 1.058,7 3.8,8 3.8,11 1.579,12 13.486,13 3.311,14 10.966,15 130.118,16 7.502,17 0.421,18 4.23,19 4.356,20 3.793,21 3.763,22 5.382,23 3.748,24 4.778,25 4.957,26 4.16,27 4.173,28 5.887,29 4.127,30 5.087,31 5.303,32 4.247,33 4.32,34 6.177,35 4.257,36 5.151,37 5.377,38 4.22,39 4.295,40 6.322,41 4.227,42 5.087,43 5.319,44 4.189,45 4.251,46 6.198,47 4.192,48 5.065,49 5.286,50 4.228,51 4.275,52 6.255,53 4.211,54 5.072,55 5.297,56 4.161,57 4.265,58 6.251,59 4.191,60 5.009,61 5.239,62 4.067,63 4.213,64 6.177,65 4.118,66 0.052,67 0.96,68 12.43,69 5.387,70 5.2}
{0 CHEMBL491473,1 25.689,2 29.075,3 -0.017,4 -0.195,5 0.719,6 0.8,7 4.504,8 4.504,9 17.449,10 3,11 1.62,12 13.576,13 4.761,14 22.67,15 124.882,16 7.509,17 0.568,18 4.211,19 4.322,20 3.792,21 3.709,22 5.292,23 3.709,24 4.775,25 4.948,26 4.155,27 4.097,28 5.811,29 4.084,30 4.983,31 5.18,32 4.213,33 4.194,34 6.059,35 4.156,36 5.01,37 5.231,38 4.148,39 4.152,40 6.061,41 4.1,42 4.934,43 5.142,44 4.089,45 4.104,46 6.004,47 4.047,48 4.941,49 5.159,50 4.06,51 4.078,52 5.997,53 4.026,54 4.887,55 5.106,56 4.015,57 4.038,58 5.957,59 3.996,60 4.778,61 4.973,62 3.993,63 4.034,64 5.831,65 3.979,66 0.058,67 0.944,68 12.288,69 5.569,70 5.1}
{0 CHEMBL491758,1 18.93,2 35.377,3 0.023,4 -0.108,5 0.257,7 3.473,8 3.473,11 1.555,12 9.238,13 4.417,14 19.511,15 80.171,16 8.245,17 0.783,18 3.645,19 3.768,20 3.297,21 3.218,22 4.871,23 3.219,24 4.078,25 4.227,26 3.61,27 3.536,28 5.33,29 3.517,30 4.313,31 4.531,32 3.607,33 3.554,34 5.567,35 3.513,36 4.211,37 4.453,38 3.406,39 3.399,40 5.314,41 3.348,42 4.099,43 4.327,44 3.453,45 3.357,46 5.336,47 3.346,48 4.062,49 4.253,50 3.426,51 3.355,52 5.376,53 3.347,54 4.031,55 4.247,56 3.239,57 3.254,58 5.28,59 3.215,60 3.896,61 4.142,62 2.947,63 3.071,64 5.069,65 2.998,66 0.046,67 0.593,68 5.516,69 2.662,70 5.2}
{0 CHEMBL494089,1 25.311,2 27.057,3 0.009,4 -0.13,5 0.445,7 3.942,8 3.942,9 6.211,10 1,11 1.633,12 10.226,13 1.839,14 3.383,15 117.484,16 7.337,17 0.441,18 4.177,19 4.306,20 3.724,21 3.613,22 5.301,23 3.615,24 4.724,25 4.917,26 4.099,27 4.009,28 5.793,29 3.997,30 4.962,31 5.18,32 4.127,33 4.137,34 6.028,35 4.082,36 5.008,37 5.256,38 4.141,39 4.13,40 5.989,41 4.073,42 4.865,43 5.063,44 4.153,45 4.107,46 5.923,47 4.086,48 4.962,49 5.152,50 4.205,51 4.179,52 6.093,53 4.151,54 5.06,55 5.28,56 4.191,57 4.198,58 6.178,59 4.144,60 5.003,61 5.247,62 3.964,63 4.127,64 5.95,65 4.031,66 0.189,67 0.894,68 12.784,69 4.687,70 5}
{0 CHEMBL497151,1 10.388,2 10.078,3 0.029,4 -0.011,5 0.256,7 3.808,8 3.808,9 5.928,10 1,11 1.983,12 9.826,13 3.635,14 13.216,15 91.792,16 14.104,17 0.808,18 3.628,19 3.677,20 3.769,21 3.346,22 4.932,23 3.302,24 4.05,25 4.113,26 4.246,27 3.753,28 5.412,29 3.67,30 4.163,31 4.255,32 4.231,33 3.772,34 5.411,35 3.643,36 4.086,37 4.203,38 3.999,39 3.616,40 5.249,41 3.517,42 3.964,43 4.08,44 3.921,45 3.457,46 5.176,47 3.431,48 4.015,49 4.144,50 3.866,51 3.519,52 5.308,53 3.449,54 4,55 4.147,56 3.954,57 3.508,58 5.182,59 3.355,60 3.718,61 3.854,62 4.014,63 3.312,64 5.047,65 3.087,66 0.169,67 0.42,68 4.176,69 2.159,70 5.2}
{0 CHEMBL504950,1 8.013,2 6.912,3 0.069,4 -0.039,5 0.19,7 3.8,8 3.8,11 1.651,12 5.625,13 2.012,14 4.046,15 66.437,16 8.858,17 0.833,18 3.401,19 3.516,20 3.194,21 3.054,22 4.575,23 3.005,24 3.873,25 4.038,26 3.64,27 3.448,28 5.001,29 3.382,30 3.951,31 4.089,32 3.716,33 3.512,34 5.097,35 3.444,36 4.032,37 4.214,38 3.563,39 3.511,40 5.104,41 3.376,42 3.969,43 4.179,44 2.98,45 3.257,46 4.984,47 3.074,48 3.672,49 3.943,50 2.568,51 2.788,52 4.638,53 2.658,54 3.378,55 3.68,56 1.838,57 2.328,58 4.357,59 2.155,60 3.011,61 3.376,62 0.765,63 1.77,64 3.738,65 1.466,66 0.029,67 0.439,68 4.354,69 2.184,70 5.2}
{0 CHEMBL507249,1 16.494,2 21.604,3 0.051,4 -0.01,5 0.295,7 3.495,8 3.495,11 1.477,12 9.958,13 3.209,14 10.298,15 95.438,16 6.683,17 0.407,18 3.991,19 4.133,20 3.471,21 3.493,22 4.955,23 3.457,24 4.588,25 4.783,26 3.827,27 3.942,28 5.482,29 3.864,30 4.918,31 5.187,32 3.774,33 4.039,34 5.702,35 3.907,36 4.879,37 5.168,38 3.756,39 3.95,40 5.703,41 3.833,42 4.741,43 5.007,44 3.746,45 3.885,46 5.631,47 3.798,48 4.655,49 4.906,50 3.653,51 3.835,52 5.595,53 3.732,54 4.587,55 4.837,56 3.481,57 3.757,58 5.482,59 3.628,60 4.531,61 4.804,62 3.33,63 3.629,64 5.372,65 3.485,66 0.082,67 0.767,68 11.777,69 4.455,70 5.208}
{0 CHEMBL507936,1 17.311,2 24.218,3 0.068,4 0.01,5 0.268,7 3.772,8 3.772,11 1.503,12 12.464,13 3.245,14 10.531,15 108.761,16 7.861,17 0.742,18 3.956,19 4.08,20 3.569,21 3.548,22 5.152,23 3.535,24 4.41,25 4.561,26 3.918,27 3.918,28 5.594,29 3.884,30 4.651,31 4.834,32 3.973,33 4.039,34 5.796,35 3.986,36 4.71,37 4.928,38 3.889,39 3.99,40 5.844,41 3.915,42 4.687,43 4.912,44 3.751,45 3.896,46 5.839,47 3.817,48 4.579,49 4.832,50 3.601,51 3.758,52 5.635,53 3.665,54 4.364,55 4.589,56 3.475,57 3.639,58 5.442,59 3.557,60 4.268,61 4.49,62 3.403,63 3.58,64 5.309,65 3.486,66 0.039,67 0.712,68 8.457,69 3.716,70 5.2}
{0 CHEMBL508928,1 20.473,2 26.718,3 0.033,4 -0.014,5 0.59,7 3.929,8 3.929,11 1.561,12 14.606,13 2.726,14 7.433,15 127.739,16 7.973,17 0.73,18 4.134,19 4.267,20 3.764,21 3.668,22 5.324,23 3.67,24 4.607,25 4.775,26 4.133,27 4.055,28 5.77,29 4.043,30 4.798,31 4.98,32 4.145,33 4.168,34 5.938,35 4.128,36 4.9,37 5.119,38 4.138,39 4.15,40 6.031,41 4.096,42 4.89,43 5.129,44 4.041,45 4.038,46 6.047,47 3.995,48 4.722,49 4.951,50 3.907,51 3.951,52 5.832,53 3.895,54 4.657,55 4.889,56 3.761,57 3.898,58 5.744,59 3.821,60 4.537,61 4.765,62 3.679,63 3.836,64 5.554,65 3.747,66 0.108,67 0.917,68 9.971,69 4.185,70 5.2}
{0 CHEMBL50894,1 15.369,2 19.872,3 0.084,4 0.177,5 0.414,7 3.945,8 3.945,11 1.664,12 7.636,13 2.817,14 7.937,15 81.229,16 8.888,17 0.64,18 3.66,19 3.756,20 3.375,21 3.26,22 4.924,23 3.272,24 4.148,25 4.253,26 3.777,27 3.689,28 5.532,29 3.686,30 4.443,31 4.591,32 3.893,33 3.859,34 5.668,35 3.845,36 4.525,37 4.699,38 3.836,39 3.825,40 5.754,41 3.798,42 4.426,43 4.611,44 3.707,45 3.683,46 5.689,47 3.653,48 4.288,49 4.481,50 3.475,51 3.449,52 5.603,53 3.415,54 4.025,55 4.227,56 3.117,57 3.062,58 5.376,59 3.037,60 3.623,61 3.799,62 2.928,63 2.564,64 5.487,65 2.609,66 0.158,67 0.497,68 4.456,69 2.587,70 5.2}
{0 CHEMBL509032,1 45.937,2 76.143,3 -0.016,4 -0.294,5 0.721,6 0.8,7 3.977,8 3.977,9 5.735,10 1,11 1.669,12 16.976,13 5.342,14 28.539,15 170.073,16 7.491,17 0.391,18 4.496,19 4.621,20 4.163,21 4.017,22 5.479,23 3.968,24 5.087,25 5.281,26 4.512,27 4.43,28 6.136,29 4.363,30 5.368,31 5.577,32 4.642,33 4.636,34 6.374,35 4.539,36 5.512,37 5.748,38 4.531,39 4.679,40 6.503,41 4.55,42 5.508,43 5.768,44 4.534,45 4.659,46 6.41,47 4.527,48 5.461,49 5.721,50 4.567,51 4.606,52 6.38,53 4.475,54 5.352,55 5.6,56 4.534,57 4.505,58 6.362,59 4.394,60 5.262,61 5.504,62 4.401,63 4.44,64 6.273,65 4.314,66 0.076,67 1.264,68 20.736,69 7.815,70 5.114}
{0 CHEMBL513846,1 14.069,2 20.133,3 0.041,4 -0.126,5 0.224,7 3.767,8 3.767,11 1.675,12 10.043,13 3.933,14 15.47,15 90.565,16 8.714,17 0.808,18 3.751,19 3.854,20 3.508,21 3.379,22 4.928,23 3.348,24 4.207,25 4.342,26 3.898,27 3.736,28 5.368,29 3.699,30 4.376,31 4.557,32 3.803,33 3.768,34 5.489,35 3.709,36 4.391,37 4.59,38 3.807,39 3.767,40 5.44,41 3.673,42 4.302,43 4.494,44 3.803,45 3.759,46 5.347,47 3.614,48 4.237,49 4.448,50 3.492,51 3.597,52 5.199,53 3.423,54 3.994,55 4.219,56 3.299,57 3.302,58 5.003,59 3.185,60 3.817,61 4.018,62 3.113,63 3.181,64 4.868,65 3.113,66 0.047,67 0.57,68 6.162,69 3.128,70 5.2}
{0 CHEMBL513909,1 41.796,2 69.22,3 -0.029,4 -0.336,5 1.011,6 0.835,7 3.964,8 3.964,9 5.625,10 1,11 1.525,12 14.237,13 3.655,14 13.36,15 148.213,16 6.776,17 0.286,18 4.432,19 4.57,20 3.921,21 3.892,22 5.424,23 3.869,24 5.038,25 5.248,26 4.303,27 4.321,28 5.967,29 4.272,30 5.327,31 5.562,32 4.434,33 4.515,34 6.261,35 4.439,36 5.431,37 5.678,38 4.445,39 4.554,40 6.405,41 4.474,42 5.442,43 5.683,44 4.457,45 4.572,46 6.485,47 4.487,48 5.406,49 5.644,50 4.35,51 4.546,52 6.381,53 4.44,54 5.411,55 5.686,56 4.183,57 4.452,58 6.3,59 4.321,60 5.263,61 5.539,62 4.107,63 4.326,64 6.139,65 4.205,66 0.032,67 1.179,68 18.11,69 6.578,70 5}
{0 CHEMBL514499,1 26.813,2 29.695,3 0.01,4 -0.08,5 1.854,6 0.86,7 4.08,8 4.08,9 16.257,10 3,11 1.934,12 11.818,13 4.685,14 21.946,15 116.287,16 9.363,17 0.583,18 4.078,19 4.161,20 3.849,21 3.604,22 5.347,23 3.624,24 4.604,25 4.724,26 4.312,27 3.973,28 6.258,29 3.993,30 4.685,31 4.79,32 4.369,33 4.075,34 6.011,35 4.083,36 4.847,37 4.977,38 4.393,39 4.133,40 6.243,41 4.123,42 4.956,43 5.14,44 4.252,45 4.067,46 6.328,47 4.039,48 4.718,49 4.892,50 4.16,51 4.005,52 5.955,53 3.973,54 4.754,55 4.927,56 4.251,57 4.027,58 6.077,59 3.991,60 4.741,61 4.904,62 4.276,63 3.919,64 6.146,65 3.912,66 0.297,67 0.94,68 6.594,69 4.885,70 5.2}
{0 CHEMBL514582,1 11.722,2 9.503,3 0.183,4 0.318,5 0.596,7 4.28,8 4.28,11 1.778,12 10.69,13 0.953,14 0.908,15 111.534,16 8.734,17 0.581,18 3.96,19 4.063,20 3.777,21 3.574,22 5.231,23 3.547,24 4.41,25 4.514,26 4.063,27 3.957,28 5.987,29 3.921,30 4.679,31 4.808,32 4.134,33 4.121,34 6.041,35 4.071,36 4.796,37 4.959,38 4.076,39 4.119,40 6.182,41 4.055,42 4.837,43 5.059,44 3.943,45 4.071,46 6.025,47 3.985,48 4.678,49 4.888,50 3.955,51 4.003,52 5.861,53 3.918,54 4.649,55 4.818,56 4.013,57 3.952,58 6.029,59 3.889,60 4.71,61 4.921,62 3.887,63 3.858,64 6.088,65 3.765,66 0.178,67 0.719,68 10.076,69 4.18,70 7.102}
{0 CHEMBL519697,1 21.854,2 26.047,3 -0.006,4 -0.202,5 0.382,6 0.555,7 3.8,8 3.8,11 1.526,12 13.516,13 4.209,14 17.719,15 117.512,16 7.42,17 0.471,18 4.113,19 4.236,20 3.679,21 3.668,22 5.233,23 3.645,24 4.666,25 4.849,26 4.048,27 4.08,28 5.708,29 4.031,30 4.952,31 5.164,32 4.146,33 4.226,34 6.026,35 4.159,36 5.034,37 5.263,38 4.064,39 4.173,40 6.2,41 4.097,42 4.931,43 5.169,44 3.965,45 4.076,46 6.03,47 4,48 4.864,49 5.1,50 3.923,51 4.064,52 5.944,53 3.978,54 4.82,55 5.054,56 3.881,57 4.049,58 5.92,59 3.953,60 4.772,61 5.02,62 3.727,63 3.982,64 5.74,65 3.855,66 0.009,67 0.843,68 11.107,69 4.892,70 5.2}
{0 CHEMBL521851,1 24.599,2 35.664,3 -0.008,4 -0.254,5 0.887,6 0.4,7 4.51,8 4.51,9 5.586,10 1,11 1.78,12 12.029,13 2.892,14 8.361,15 136.875,16 8.286,17 0.5,18 4.265,19 4.373,20 4.076,21 3.821,22 5.256,23 3.78,24 4.867,25 5.038,26 4.41,27 4.247,28 6.005,29 4.193,30 5.085,31 5.279,32 4.431,33 4.39,34 6.061,35 4.298,36 5.148,37 5.363,38 4.399,39 4.418,40 6.122,41 4.302,42 5.146,43 5.383,44 4.367,45 4.396,46 6.121,47 4.26,48 4.99,49 5.187,50 4.34,51 4.365,52 5.882,53 4.246,54 4.978,55 5.161,56 4.376,57 4.342,58 5.958,59 4.235,60 5.064,61 5.284,62 4.373,63 4.333,64 5.977,65 4.213,66 0.138,67 1.053,68 14.833,69 6.041,70 5}
{0 CHEMBL522892,1 24.416,2 38.408,3 0.043,4 -0.139,5 0.638,7 4.229,8 4.229,11 1.644,12 11.483,13 1.782,14 3.174,15 110.583,16 7.85,17 0.485,18 4.047,19 4.179,20 3.661,21 3.564,22 5.18,23 3.569,24 4.589,25 4.768,26 4.07,27 3.99,28 5.696,29 3.982,30 4.85,31 5.047,32 4.167,33 4.158,34 5.955,35 4.124,36 4.961,37 5.19,38 4.158,39 4.149,40 6.204,41 4.082,42 4.929,43 5.188,44 3.955,45 4.015,46 6.03,47 3.953,48 4.683,49 4.915,50 3.899,51 3.876,52 5.946,53 3.823,54 4.553,55 4.765,56 3.733,57 3.765,58 5.709,59 3.722,60 4.466,61 4.715,62 3.529,63 3.669,64 5.461,65 3.571,66 0.083,67 0.886,68 9.549,69 4.013,70 5.1}
{0 CHEMBL523823,1 17.229,2 26.084,3 0.063,4 -0.018,5 0.651,7 3.923,8 3.923,11 1.895,12 6.211,13 2.756,14 7.597,15 67.908,16 10.024,17 0.524,18 3.522,19 3.586,20 3.307,21 3.037,22 4.856,23 3.079,24 3.989,25 4.092,26 3.75,27 3.442,28 5.324,29 3.478,30 4.22,31 4.338,32 3.932,33 3.563,34 5.65,35 3.606,36 4.277,37 4.383,38 3.869,39 3.56,40 5.818,41 3.582,42 4.233,43 4.377,44 3.678,45 3.451,46 5.637,47 3.43,48 4.149,49 4.301,50 3.499,51 3.144,52 5.585,53 3.12,54 3.696,55 3.858,56 2.902,57 2.457,58 5.347,59 2.417,60 2.917,61 3.173,62 1.777,63 1.497,64 4.274,65 1.399,66 0.241,67 0.397,68 2.98,69 2.358,70 5.2}
{0 CHEMBL52387,1 24.833,2 38.665,3 -0.016,4 -0.298,5 0.557,7 3.451,8 3.451,11 1.5,12 9.462,13 3.181,14 10.12,15 106.143,16 6.817,17 0.571,18 4.034,19 4.18,20 3.519,21 3.496,22 5.088,23 3.472,24 4.572,25 4.785,26 3.856,27 3.869,28 5.559,29 3.815,30 4.81,31 5.061,32 3.912,33 3.985,34 5.757,35 3.906,36 4.882,37 5.147,38 3.89,39 3.981,40 5.84,41 3.892,42 4.843,43 5.117,44 3.806,45 3.913,46 5.833,47 3.834,48 4.671,49 4.9,50 3.827,51 3.894,52 5.652,53 3.838,54 4.764,55 4.999,56 3.846,57 3.969,58 5.745,59 3.896,60 4.877,61 5.132,62 3.736,63 4.031,64 5.779,65 3.9,66 0.052,67 0.803,68 12.071,69 4.161,70 5.2}
{0 CHEMBL525191,1 10.747,2 8.152,3 0.054,4 0.08,5 0.304,7 3.985,8 3.985,11 1.571,12 9.36,13 2.407,14 5.796,15 95.753,16 7.777,17 0.607,18 3.887,19 3.997,20 3.491,21 3.444,22 5.086,23 3.433,24 4.376,25 4.534,26 3.818,27 3.851,28 5.433,29 3.817,30 4.601,31 4.805,32 3.851,33 3.954,34 5.622,35 3.889,36 4.61,37 4.801,38 3.855,39 3.935,40 5.719,41 3.874,42 4.636,43 4.853,44 3.777,45 3.9,46 5.678,47 3.828,48 4.539,49 4.74,50 3.71,51 3.879,52 5.524,53 3.791,54 4.612,55 4.842,56 3.659,57 3.849,58 5.599,59 3.744,60 4.589,61 4.841,62 3.498,63 3.676,64 5.628,65 3.571,66 0.128,67 0.648,68 8.273,69 3.802,70 5}
{0 CHEMBL526133,1 10.63,2 16.814,3 0.06,4 0.091,5 0.148,7 3.859,8 3.859,11 1.543,12 8.591,13 2.837,14 8.05,15 85.795,16 8.48,17 0.64,18 3.67,19 3.78,20 3.358,21 3.291,22 4.883,23 3.291,24 4.123,25 4.25,26 3.714,27 3.675,28 5.374,29 3.655,30 4.326,31 4.501,32 3.676,33 3.753,34 5.438,35 3.7,36 4.324,37 4.529,38 3.575,39 3.66,40 5.422,41 3.599,42 4.244,43 4.448,44 3.537,45 3.557,46 5.421,47 3.513,48 4.17,49 4.354,50 3.488,51 3.452,52 5.462,53 3.432,54 4.022,55 4.211,56 3.282,57 3.306,58 5.25,59 3.27,60 3.87,61 4.077,62 3.059,63 3.131,64 5.093,65 3.054,66 0.059,67 0.523,68 5.077,69 2.58,70 5.6}
{0 CHEMBL535,1 25.99,2 30.71,3 0.012,4 -0.12,5 0.714,7 4.111,8 4.111,11 1.584,12 11.655,13 2.998,14 8.987,15 113.678,16 7.117,17 0.355,18 4.101,19 4.238,20 3.612,21 3.603,22 5.199,23 3.578,24 4.649,25 4.852,26 3.983,27 3.985,28 5.735,29 3.943,30 4.864,31 5.08,32 4.051,33 4.122,34 5.954,35 4.066,36 4.978,37 5.196,38 4.03,39 4.168,40 6.076,41 4.077,42 5.06,43 5.324,44 3.954,45 4.095,46 6.164,47 3.994,48 4.949,49 5.221,50 3.905,51 4.029,52 6.047,53 3.935,54 4.824,55 5.053,56 3.867,57 3.978,58 5.943,59 3.895,60 4.825,61 5.057,62 3.837,63 3.927,64 6.073,65 3.851,66 0.042,67 0.89,68 12.112,69 4.992,70 5}
{0 CHEMBL535331,1 5.093,2 2.5,3 0.066,4 0.051,5 0.158,7 4.401,8 4.401,11 1.449,12 9.619,13 3.635,14 13.211,15 83.932,16 8.098,17 0.833,18 3.672,19 3.801,20 3.326,21 3.255,22 4.836,23 3.253,24 4.12,25 4.268,26 3.663,27 3.635,28 5.248,29 3.61,30 4.303,31 4.514,32 3.581,33 3.634,34 5.351,35 3.575,36 4.243,37 4.482,38 3.361,39 3.454,40 5.245,41 3.375,42 4.02,43 4.283,44 3.072,45 3.149,46 4.997,47 3.072,48 3.844,49 4.104,50 3.018,51 3.028,52 4.835,53 2.981,54 3.713,55 3.933,56 3.05,57 3.049,58 4.762,59 3.011,60 3.742,61 3.953,62 3.031,63 3.129,64 4.726,65 3.069,66 0.056,67 0.564,68 5.91,69 2.517,70 5.2}
{0 CHEMBL539474,1 22.608,2 30.643,3 0.007,4 -0.222,5 0.233,6 0.079,7 3.622,8 3.622,11 1.577,12 8.048,13 1.541,14 2.374,15 78.274,16 7.815,17 0.458,18 3.719,19 3.833,20 3.342,21 3.276,22 4.811,23 3.273,24 4.277,25 4.437,26 3.743,27 3.705,28 5.363,29 3.682,30 4.531,31 4.732,32 3.735,33 3.799,34 5.612,35 3.741,36 4.508,37 4.721,38 3.609,39 3.716,40 5.64,41 3.652,42 4.355,43 4.582,44 3.39,45 3.59,46 5.408,47 3.492,48 4.219,49 4.45,50 3.196,51 3.389,52 5.247,53 3.284,54 4.056,55 4.302,56 3.042,57 3.134,58 5.106,59 3.045,60 3.836,61 4.066,62 2.957,63 2.969,64 4.901,65 2.92,66 0.031,67 0.556,68 6.689,69 3.074,70 6}
{0 CHEMBL553,1 25.355,2 33.398,3 -0.05,4 -0.249,5 0.58,6 0.86,7 3.734,8 3.734,9 21.802,10 4,11 1.568,12 11.345,13 4.31,14 18.575,15 110.749,16 7.567,17 0.548,18 4.05,19 4.152,20 3.627,21 3.526,22 5.216,23 3.534,24 4.559,25 4.716,26 3.895,27 3.835,28 5.642,29 3.833,30 4.683,31 4.845,32 3.989,33 3.966,34 5.793,35 3.938,36 4.733,37 4.933,38 3.953,39 3.987,40 5.768,41 3.933,42 4.809,43 5.016,44 3.978,45 3.993,46 5.841,47 3.949,48 4.756,49 4.929,50 4.008,51 4.017,52 5.839,53 3.974,54 4.81,55 5.008,56 3.969,57 4.04,58 5.839,59 3.981,60 4.868,61 5.089,62 3.861,63 3.961,64 5.891,65 3.89,66 0.054,67 0.714,68 10.332,69 4.677,70 5.1}
{0 CHEMBL554,1 28.108,2 40.3,3 0.023,4 -0.083,5 0.9,6 0.4,7 4.423,8 4.423,9 5.772,10 1,11 1.816,12 17.4,13 6.255,14 39.126,15 152.448,16 8.805,17 0.636,18 4.306,19 4.395,20 4.109,21 3.908,22 5.446,23 3.881,24 4.829,25 4.958,26 4.397,27 4.268,28 6.123,29 4.239,30 5.076,31 5.243,32 4.42,33 4.346,34 6.269,35 4.299,36 5.076,37 5.278,38 4.34,39 4.305,40 6.187,41 4.234,42 5.025,43 5.23,44 4.277,45 4.306,46 6.114,47 4.221,48 4.952,49 5.129,50 4.381,51 4.311,52 6.078,53 4.24,54 4.986,55 5.172,56 4.433,57 4.32,58 6.18,59 4.243,60 4.938,61 5.12,62 4.341,63 4.213,64 6.171,65 4.146,66 0.16,67 1.011,68 12.31,69 6.42,70 5.1}
{0 CHEMBL558752,1 25.984,2 34.25,3 -0.004,4 -0.13,5 1.325,6 0.4,7 4.058,8 4.058,9 5.855,10 1,11 1.859,12 15.514,13 6.607,14 43.648,15 120.68,16 9.782,17 0.659,18 4.14,19 4.241,20 3.906,21 3.631,22 5.441,23 3.695,24 4.683,25 4.815,26 4.421,27 3.997,28 6.599,29 4.072,30 4.805,31 4.965,32 4.34,33 4.068,34 6.253,35 4.114,36 4.895,37 5.085,38 4.275,39 4.037,40 6.334,41 4.074,42 4.791,43 4.996,44 4.103,45 4.001,46 6.06,47 3.997,48 4.741,49 4.935,50 4.143,51 4.003,52 6.101,53 3.988,54 4.747,55 4.941,56 4.074,57 3.937,58 6.053,59 3.946,60 4.679,61 4.874,62 4.136,63 3.832,64 6.21,65 3.859,66 0.433,67 1.298,68 4.994,69 4.463,70 5}
{0 CHEMBL560813,1 17.325,2 22.325,3 0.061,4 -0.082,5 0.508,6 0.247,7 3.699,8 3.699,11 1.728,12 12.2,13 1.581,14 2.5,15 87.065,16 9.259,17 0.63,18 3.723,19 3.817,20 3.449,21 3.284,22 5.112,23 3.32,24 4.138,25 4.249,26 3.797,27 3.632,28 5.631,29 3.648,30 4.383,31 4.538,32 3.821,33 3.741,34 5.766,35 3.737,36 4.401,37 4.581,38 3.698,39 3.624,40 5.803,41 3.605,42 4.289,43 4.485,44 3.567,45 3.433,46 5.681,47 3.437,48 4.103,49 4.281,50 3.44,51 3.293,52 5.512,53 3.308,54 4.011,55 4.187,56 3.344,57 3.215,58 5.428,59 3.228,60 3.886,61 4.073,62 3.259,63 3.137,64 5.4,65 3.129,66 0.152,67 0.558,68 4.175,69 2.591,70 5.2}
{0 CHEMBL561932,1 30.984,2 43.846,3 0.02,4 -0.072,5 0.675,6 0.293,7 3.963,8 3.963,11 1.783,12 12.094,13 3.467,14 12.018,15 121.677,16 8.861,17 0.472,18 4.069,19 4.18,20 3.781,21 3.639,22 5.258,23 3.643,24 4.566,25 4.716,26 4.159,27 4.002,28 5.785,29 3.993,30 4.797,31 4.977,32 4.283,33 4.111,34 6.046,35 4.1,36 4.85,37 5.028,38 4.239,39 4.129,40 6.113,41 4.105,42 4.821,43 5.004,44 4.208,45 4.149,46 6.048,47 4.103,48 4.804,49 4.975,50 4.281,51 4.167,52 6.063,53 4.112,54 4.863,55 5.069,56 4.256,57 4.08,58 6.113,59 4.026,60 4.697,61 4.903,62 4.042,63 3.904,64 5.934,65 3.855,66 0.135,67 0.854,68 7.339,69 4.195,70 5}
{0 CHEMBL565612,1 17.659,2 23.387,3 0.015,4 -0.204,5 0.52,6 0.8,7 4.477,8 4.477,11 1.568,12 10.576,13 3.484,14 12.137,15 126.137,16 7.973,17 0.553,18 4.142,19 4.259,20 3.781,21 3.707,22 5.259,23 3.706,24 4.687,25 4.854,26 4.185,27 4.138,28 5.795,29 4.121,30 4.921,31 5.109,32 4.258,33 4.284,34 5.987,35 4.242,36 4.999,37 5.212,38 4.281,39 4.28,40 6.158,41 4.235,42 4.98,43 5.19,44 4.334,45 4.26,46 6.153,47 4.244,48 4.917,49 5.065,50 4.378,51 4.284,52 6.223,53 4.279,54 5.013,55 5.188,56 4.284,57 4.313,58 6.232,59 4.273,60 5.035,61 5.246,62 4.106,63 4.249,64 6.118,65 4.168,66 0.045,67 0.876,68 9.78,69 4.486,70 5.2}
{0 CHEMBL572878,1 36.777,2 58.816,3 0.006,4 -0.188,5 0.399,6 0.8,7 3.699,8 3.699,11 1.625,12 12.697,13 4.445,14 19.761,15 134.268,16 7.617,17 0.459,18 4.223,19 4.36,20 3.852,21 3.746,22 5.264,23 3.713,24 4.754,25 4.955,26 4.209,27 4.106,28 5.761,29 4.045,30 4.954,31 5.18,32 4.195,33 4.222,34 5.917,35 4.121,36 5.007,37 5.26,38 4.138,39 4.196,40 5.957,41 4.072,42 4.907,43 5.156,44 4.169,45 4.155,46 5.872,47 4.06,48 4.828,49 5.024,50 4.211,51 4.193,52 5.828,53 4.088,54 4.877,55 5.098,56 4.185,57 4.188,58 5.82,59 4.069,60 4.879,61 5.109,62 4.1,63 4.188,64 5.766,65 4.061,66 0.058,67 1.019,68 13.326,69 5.246,70 5.1}
{0 CHEMBL572881,1 27.538,2 44.521,3 0.035,4 -0.095,5 0.314,7 3.938,8 3.938,11 1.481,12 11.607,13 2.721,14 7.405,15 112.492,16 7.324,17 0.581,18 4.026,19 4.158,20 3.583,21 3.584,22 5.127,23 3.56,24 4.543,25 4.722,26 3.947,27 3.989,28 5.597,29 3.943,30 4.804,31 5.002,32 3.986,33 4.133,34 5.824,35 4.048,36 4.944,37 5.207,38 3.872,39 4.072,40 5.953,41 3.953,42 4.791,43 5.051,44 3.727,45 3.926,46 5.79,47 3.819,48 4.617,49 4.86,50 3.735,51 3.836,52 5.672,53 3.762,54 4.517,55 4.719,56 3.767,57 3.836,58 5.639,59 3.782,60 4.591,61 4.81,62 3.688,63 3.821,64 5.705,65 3.736,66 0.04,67 0.782,68 10.48,69 4.319,70 5}
{0 CHEMBL573339,1 12.611,2 16.024,3 -0.008,4 -0.256,5 0.525,7 3.917,8 3.917,9 5.462,10 1,11 1.643,12 8.038,13 2.634,14 6.936,15 93.122,16 8.295,17 0.7,18 3.901,19 3.993,20 3.57,21 3.427,22 5.053,23 3.451,24 4.429,25 4.567,26 3.953,27 3.814,28 5.57,29 3.831,30 4.632,31 4.81,32 4.004,33 3.906,34 5.74,35 3.897,36 4.601,37 4.8,38 3.93,39 3.856,40 5.661,41 3.843,42 4.552,43 4.727,44 3.948,45 3.85,46 5.691,47 3.845,48 4.563,49 4.716,50 3.948,51 3.915,52 5.647,53 3.901,54 4.608,55 4.774,56 3.86,57 3.933,58 5.677,59 3.88,60 4.659,61 4.872,62 3.658,63 3.843,64 5.7,65 3.738,66 0.093,67 0.64,68 7.051,69 3.599,70 5}
{0 CHEMBL574738,1 41.64,2 62.867,3 -0.03,4 -0.229,5 1.48,6 0.86,7 3.737,8 3.737,9 5.666,10 1,11 1.737,12 17.421,13 4.513,14 20.37,15 141.564,16 7.789,17 0.439,18 4.326,19 4.457,20 3.911,21 3.768,22 5.463,23 3.782,24 4.887,25 5.079,26 4.318,27 4.137,28 6.358,29 4.135,30 5.094,31 5.307,32 4.297,33 4.305,34 6.174,35 4.264,36 5.208,37 5.442,38 4.301,39 4.321,40 6.33,41 4.256,42 5.246,43 5.511,44 4.289,45 4.258,46 6.458,47 4.203,48 5.069,49 5.294,50 4.205,51 4.184,52 6.242,53 4.15,54 5.071,55 5.299,56 4.255,57 4.121,58 6.562,59 4.093,60 4.978,61 5.224,62 4.019,63 4.011,64 6.218,65 3.971,66 0.176,67 1.234,68 13.199,69 5.62,70 7.538}
{0 CHEMBL576982,1 30.283,2 41.564,3 -0.004,4 -0.182,5 0.825,6 0.8,7 3.918,8 3.918,9 11.425,10 2,11 1.664,12 19.05,13 5.719,14 32.712,15 154.689,16 7.788,17 0.556,18 4.397,19 4.508,20 4.039,21 3.919,22 5.471,23 3.899,24 4.952,25 5.118,26 4.449,27 4.327,28 5.997,29 4.293,30 5.17,31 5.359,32 4.416,33 4.461,34 6.168,35 4.373,36 5.269,37 5.512,38 4.326,39 4.417,40 6.213,41 4.304,42 5.153,43 5.405,44 4.221,45 4.254,46 6.148,47 4.156,48 4.877,49 5.083,50 4.138,51 4.153,52 5.874,53 4.067,54 4.826,55 5.007,56 4.166,57 4.191,58 5.877,59 4.113,60 4.957,61 5.158,62 4.128,63 4.199,64 6.038,65 4.11,66 0.11,67 1.104,68 14.964,69 6.645,70 5}
{0 CHEMBL583144,1 12.19,2 14.256,3 0.07,4 0.015,5 0.214,7 3.529,8 3.529,11 2.061,12 5.125,13 3.264,14 10.656,15 65.057,16 13.557,17 0.556,18 3.201,19 3.246,20 3.318,21 3.001,22 4.483,23 2.96,24 3.661,25 3.713,26 3.805,27 3.444,28 5.012,29 3.374,30 3.832,31 3.89,32 4.067,33 3.528,34 5.222,35 3.44,36 3.675,37 3.713,38 3.909,39 3.355,40 5.178,41 3.255,42 3.322,43 3.394,44 3.506,45 2.888,46 4.805,47 2.813,48 3.153,49 3.231,50 3.244,51 2.438,52 5.002,53 2.449,54 2.633,55 2.862,56 0.92,57 1.59,58 3.722,59 1.325,60 1.298,61 1.682,62 0.021,63 0.361,64 1.386,65 0.189,66 0.113,67 0.258,68 1.504,69 0.957,70 5.2}
{0 CHEMBL590109,1 7.443,2 5,3 0.101,4 0.111,5 0.223,7 4.555,8 4.555,11 1.556,12 10.161,13 3.758,14 14.126,15 126.379,16 8.511,17 0.833,18 4.059,19 4.181,20 3.789,21 3.691,22 5.213,23 3.663,24 4.545,25 4.693,26 4.204,27 4.131,28 5.649,29 4.078,30 4.743,31 4.925,32 4.225,33 4.242,34 5.763,35 4.154,36 4.797,37 4.982,38 4.226,39 4.261,40 5.793,41 4.164,42 4.801,43 5.002,44 4.211,45 4.227,46 5.806,47 4.135,48 4.782,49 4.964,50 4.185,51 4.218,52 5.861,53 4.143,54 4.85,55 5.067,56 4.184,57 4.184,58 5.893,59 4.103,60 4.796,61 5.025,62 4.044,63 4.104,64 5.817,65 4,66 0.078,67 0.832,68 8.664,69 3.98,70 5.349}
{0 CHEMBL592030,1 9.487,2 7.5,3 0.096,4 0.104,5 0.233,7 4.555,8 4.555,11 1.541,12 10.781,13 3.821,14 14.599,15 131.245,16 8.294,17 0.811,18 4.107,19 4.231,20 3.815,21 3.734,22 5.241,23 3.701,24 4.604,25 4.757,26 4.223,27 4.173,28 5.681,29 4.114,30 4.813,31 5.006,32 4.244,33 4.284,34 5.797,35 4.189,36 4.866,37 5.064,38 4.247,39 4.302,40 5.834,41 4.199,42 4.86,43 5.069,44 4.241,45 4.278,46 5.826,47 4.182,48 4.844,49 5.024,50 4.235,51 4.284,52 5.892,53 4.207,54 4.939,55 5.16,56 4.243,57 4.262,58 5.981,59 4.176,60 4.881,61 5.112,62 4.104,63 4.185,64 5.865,65 4.08,66 0.073,67 0.873,68 9.718,69 4.337,70 5.9}
{0 CHEMBL597592,1 36.447,2 53.829,3 0.03,4 -0.046,5 0.669,6 0.247,7 4.07,8 4.07,9 5.987,10 1,11 1.586,12 13.583,13 5.126,14 26.275,15 135.016,16 7.784,17 0.575,18 4.241,19 4.363,20 3.845,21 3.771,22 5.4,23 3.77,24 4.74,25 4.894,26 4.246,27 4.162,28 5.922,29 4.144,30 4.998,31 5.181,32 4.246,33 4.264,34 6.119,35 4.223,36 5.097,37 5.344,38 4.228,39 4.234,40 6.15,41 4.18,42 4.965,43 5.166,44 4.201,45 4.184,46 6.161,47 4.156,48 4.921,49 5.113,50 4.181,51 4.237,52 6.07,53 4.186,54 5.046,55 5.254,56 4.178,57 4.29,58 6.175,59 4.214,60 5.109,61 5.354,62 4.021,63 4.207,64 6.199,65 4.111,66 0.095,67 0.956,68 11.746,69 5.14,70 5.742}
{0 CHEMBL598626,1 32.244,2 44.486,3 0.029,4 -0.023,5 0.7,6 0.247,7 4.071,8 4.071,9 6,10 1,11 1.56,12 12.714,13 5.218,14 27.224,15 131.838,16 7.793,17 0.59,18 4.206,19 4.322,20 3.814,21 3.759,22 5.363,23 3.753,24 4.708,25 4.858,26 4.218,27 4.152,28 5.875,29 4.133,30 4.966,31 5.141,32 4.24,33 4.257,34 6.108,35 4.215,36 5.075,37 5.316,38 4.203,39 4.222,40 6.141,41 4.172,42 4.929,43 5.124,44 4.193,45 4.186,46 6.144,47 4.151,48 4.886,49 5.07,50 4.154,51 4.256,52 5.993,53 4.201,54 5.037,55 5.238,56 4.195,57 4.333,58 6.167,59 4.251,60 5.081,61 5.298,62 4.071,63 4.255,64 6.228,65 4.16,66 0.076,67 0.898,68 11.186,69 5.127,70 5}
{0 CHEMBL601719,1 23.489,2 28.517,3 0.028,4 -0.029,5 0.89,7 4.065,8 4.065,9 5.975,10 1,11 1.778,12 11.767,13 3.694,14 13.646,15 118.112,16 8.661,17 0.515,18 4.068,19 4.188,20 3.755,21 3.612,22 5.194,23 3.597,24 4.613,25 4.779,26 4.164,27 4.02,28 5.709,29 3.988,30 4.9,31 5.103,32 4.332,33 4.171,34 6.028,35 4.108,36 4.921,37 5.125,38 4.366,39 4.168,40 6.033,41 4.081,42 4.893,43 5.122,44 4.105,45 4.074,46 6.038,47 3.981,48 4.725,49 4.942,50 4.013,51 3.993,52 5.803,53 3.908,54 4.692,55 4.901,56 4.129,57 3.992,58 5.855,59 3.904,60 4.731,61 4.963,62 3.976,63 3.926,64 5.886,65 3.828,66 0.124,67 0.843,68 8.72,69 4.5,70 5}
{0 CHEMBL602123,1 26.953,2 36.537,3 0.049,4 -0.056,5 2.057,6 0.86,7 4.05,8 4.05,9 9.018,10 2,11 1.968,12 12.471,13 5.774,14 33.341,15 104.152,16 10.741,17 0.486,18 3.998,19 4.071,20 3.817,21 3.47,22 5.424,23 3.567,24 4.51,25 4.59,26 4.313,27 3.825,28 6.424,29 3.928,30 4.697,31 4.814,32 4.318,33 3.891,34 6.415,35 3.99,36 4.701,37 4.837,38 4.277,39 3.817,40 6.393,41 3.931,42 4.688,43 4.823,44 4.235,45 3.788,46 6.439,47 3.904,48 4.609,49 4.735,50 4.239,51 3.783,52 6.346,53 3.904,54 4.671,55 4.814,56 4.301,57 3.73,58 6.619,59 3.87,60 4.588,61 4.737,62 4.13,63 3.568,64 6.372,65 3.731,66 0.626,67 1.12,68 2.445,69 3.956,70 5}
{0 CHEMBL607707,1 30.281,2 40.331,3 -0.012,4 -0.156,5 0.634,6 0.86,7 3.874,8 3.874,9 5.701,10 1,11 1.741,12 12.182,13 4.455,14 19.85,15 127.416,16 8.357,17 0.486,18 4.115,19 4.23,20 3.765,21 3.654,22 5.338,23 3.648,24 4.613,25 4.785,26 4.116,27 4.002,28 5.798,29 3.984,30 4.834,31 5.005,32 4.271,33 4.151,34 6.105,35 4.119,36 4.919,37 5.142,38 4.193,39 4.161,40 6.08,41 4.103,42 4.857,43 5.044,44 4.198,45 4.183,46 6.093,47 4.131,48 4.91,49 5.104,50 4.252,51 4.211,52 6.133,53 4.168,54 4.947,55 5.136,56 4.283,57 4.194,58 6.265,59 4.149,60 4.882,61 5.08,62 4.226,63 4.09,64 6.218,65 4.042,66 0.095,67 0.876,68 9.303,69 4.733,70 5}
{0 CHEMBL608154,1 12.855,2 14.608,3 0.021,4 -0.122,5 0.648,7 3.967,8 3.967,9 5.449,10 1,11 1.716,12 8.731,13 2.737,14 7.493,15 98.273,16 8.947,17 0.724,18 3.849,19 3.95,20 3.571,21 3.435,22 5.058,23 3.438,24 4.334,25 4.472,26 3.963,27 3.819,28 5.516,29 3.813,30 4.508,31 4.644,32 4.123,33 3.947,34 5.74,35 3.933,36 4.608,37 4.76,38 4.124,39 3.954,40 5.859,41 3.923,42 4.66,43 4.842,44 4.045,45 3.912,46 5.908,47 3.857,48 4.542,49 4.731,50 4.015,51 3.825,52 5.792,53 3.79,54 4.455,55 4.606,56 3.916,57 3.776,58 5.711,59 3.739,60 4.424,61 4.589,62 3.766,63 3.745,64 5.642,65 3.67,66 0.082,67 0.605,68 5.726,69 3.248,70 5}
{0 CHEMBL7064,1 1.291,2 0.417,3 0.083,4 0.248,5 0.251,7 3.831,8 3.831,11 1.472,12 5.647,13 2.995,14 8.969,15 65.355,16 8.81,17 0.8,18 3.39,19 3.48,20 3.123,21 3.091,22 4.591,23 3.084,24 3.868,25 3.967,26 3.527,27 3.515,28 5.044,29 3.5,30 4.091,31 4.232,32 3.619,33 3.605,34 5.288,35 3.583,36 4.099,37 4.248,38 3.54,39 3.478,40 5.396,41 3.469,42 3.933,43 4.118,44 3.127,45 3.177,46 5.269,47 3.125,48 3.519,49 3.755,50 2.312,51 2.727,52 4.531,53 2.582,54 2.938,55 3.224,56 1.401,57 2.098,58 3.655,59 1.863,60 2.219,61 2.574,62 0.316,63 1.178,64 2.639,65 0.876,66 0.042,67 0.336,68 3.207,69 1.844,70 5.41}
{0 CHEMBL91829,1 21.829,2 21.51,3 0.003,4 -0.211,5 0.571,6 0.8,7 4.601,8 4.601,9 6.377,10 1,11 1.502,12 9.743,13 3.479,14 12.106,15 135.851,16 7.438,17 0.5,18 4.257,19 4.372,20 3.84,21 3.811,22 5.311,23 3.796,24 4.831,25 5.002,26 4.238,27 4.25,28 5.851,29 4.221,30 5.087,31 5.269,32 4.344,33 4.446,34 6.081,35 4.384,36 5.26,37 5.47,38 4.46,39 4.561,40 6.273,41 4.488,42 5.371,43 5.576,44 4.55,45 4.626,46 6.383,47 4.562,48 5.455,49 5.667,50 4.625,51 4.699,52 6.486,53 4.634,54 5.519,55 5.746,56 4.566,57 4.705,58 6.531,59 4.625,60 5.405,61 5.634,62 4.318,63 4.565,64 6.422,65 4.453,66 0.01,67 0.931,68 12.794,69 5.704,70 5}
{0 CHEMBL939,1 28.856,2 41.089,3 -0.038,4 -0.241,5 0.769,6 0.8,7 3.872,8 3.872,9 16.905,10 3,11 1.765,12 12.935,13 4.203,14 17.668,15 117.539,16 8.126,17 0.5,18 4.125,19 4.233,20 3.763,21 3.608,22 5.232,23 3.614,24 4.683,25 4.851,26 4.108,27 3.975,28 5.763,29 3.967,30 4.893,31 5.085,32 4.228,33 4.114,34 6.01,35 4.075,36 4.91,37 5.131,38 4.063,39 4.094,40 5.891,41 4.01,42 4.924,43 5.162,44 3.998,45 4.066,46 5.867,47 3.975,48 4.855,49 5.07,50 4.024,51 4.022,52 5.847,53 3.955,54 4.822,55 5.037,56 4.035,57 4,58 5.867,59 3.93,60 4.743,61 4.957,62 4.007,63 3.938,64 5.802,65 3.875,66 0.111,67 0.856,68 10.201,69 4.964,70 5.2}
{0 CHEMBL941,1 30.255,2 48.345,3 -0.009,4 -0.243,5 0.4,6 0.4,7 3.87,8 3.87,11 1.468,12 16.73,13 4.221,14 17.813,15 146.651,16 7.26,17 0.585,18 4.309,19 4.443,20 3.863,21 3.85,22 5.388,23 3.826,24 4.838,25 5.033,26 4.197,27 4.233,28 5.866,29 4.187,30 5.077,31 5.286,32 4.239,33 4.395,34 6.061,35 4.31,36 5.205,37 5.466,38 4.145,39 4.367,40 6.139,41 4.247,42 5.13,43 5.402,44 4.135,45 4.291,46 6.073,47 4.196,48 4.967,49 5.186,50 4.111,51 4.268,52 6.004,53 4.179,54 5.016,55 5.264,56 4.026,57 4.248,58 5.971,59 4.136,60 4.9,61 5.125,62 3.986,63 4.166,64 5.937,65 4.067,66 0.042,67 1.057,68 14.153,69 5.707,70 5.1}
{0 CHEMBL95692,1 18.59,2 22.813,3 -0.025,4 -0.242,5 0.345,7 3.662,8 3.662,9 5.188,10 1,11 1.638,12 8.615,13 2.615,14 6.836,15 96.762,16 7.683,17 0.586,18 3.948,19 4.072,20 3.549,21 3.452,22 5.063,23 3.454,24 4.495,25 4.677,26 3.897,27 3.841,28 5.587,29 3.82,30 4.714,31 4.941,32 3.932,33 3.973,34 5.712,35 3.918,36 4.756,37 4.99,38 3.933,39 3.99,40 5.745,41 3.933,42 4.739,43 4.956,44 3.971,45 4.041,46 5.715,47 3.979,48 4.774,49 4.984,50 3.989,51 4.043,52 5.836,53 3.98,54 4.798,55 5.022,56 3.89,57 4.014,58 5.811,59 3.929,60 4.823,61 5.072,62 3.672,63 3.883,64 5.817,65 3.766,66 0.048,67 0.788,68 8.968,69 3.918,70 5.2}
{0 CHEMBL97162,1 14.422,2 11.476,3 -0.007,4 -0.193,5 0.448,7 3.662,8 3.662,9 5.179,10 1,11 1.654,12 9.037,13 3.661,14 13.404,15 99.287,16 7.676,17 0.567,18 3.988,19 4.101,20 3.58,21 3.499,22 5.12,23 3.499,24 4.538,25 4.705,26 3.946,27 3.899,28 5.65,29 3.876,30 4.797,31 5.013,32 3.99,33 4.036,34 5.835,35 3.981,36 4.849,37 5.085,38 3.967,39 4.042,40 5.853,41 3.981,42 4.798,43 5.02,44 3.998,45 4.078,46 5.776,47 4.011,48 4.807,49 5.012,50 4.03,51 4.085,52 5.883,53 4.024,54 4.853,55 5.066,56 3.968,57 4.069,58 5.924,59 3.993,60 4.88,61 5.121,62 3.765,63 3.962,64 5.922,65 3.85,66 0.069,67 0.787,68 9.408,69 4.349,70 4}