@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL4121

@attribute molecule_id {CHEMBL10,CHEMBL101253,CHEMBL103667,CHEMBL105442,CHEMBL1084546,CHEMBL1090356,CHEMBL1090360,CHEMBL116070,CHEMBL1173655,CHEMBL117697,CHEMBL1190711,CHEMBL119385,CHEMBL1230020,CHEMBL1230122,CHEMBL1236107,CHEMBL1240703,CHEMBL1241674,CHEMBL1242373,CHEMBL124660,CHEMBL127898,CHEMBL1287853,CHEMBL1289926,CHEMBL1336,CHEMBL1375418,CHEMBL1375640,CHEMBL1419458,CHEMBL1421,CHEMBL1461728,CHEMBL14762,CHEMBL1516890,CHEMBL1614701,CHEMBL1614705,CHEMBL162,CHEMBL1624529,CHEMBL1682540,CHEMBL1682545,CHEMBL1682546,CHEMBL1682552,CHEMBL1682553,CHEMBL1682558,CHEMBL1721885,CHEMBL1727312,CHEMBL17370,CHEMBL178737,CHEMBL1789941,CHEMBL180022,CHEMBL1825138,CHEMBL1834657,CHEMBL183844,CHEMBL184847,CHEMBL185569,CHEMBL1908391,CHEMBL1908392,CHEMBL1908393,CHEMBL1908394,CHEMBL1908395,CHEMBL1908396,CHEMBL1908397,CHEMBL191003,CHEMBL1929238,CHEMBL1945559,CHEMBL1958401,CHEMBL196363,CHEMBL1964290,CHEMBL1964444,CHEMBL1964644,CHEMBL1964687,CHEMBL1964692,CHEMBL1964777,CHEMBL1964804,CHEMBL1964937,CHEMBL1965131,CHEMBL1965351,CHEMBL1965423,CHEMBL1965507,CHEMBL1965570,CHEMBL1965589,CHEMBL1965660,CHEMBL1965836,CHEMBL1965845,CHEMBL1965988,CHEMBL1966035,CHEMBL1966087,CHEMBL1966279,CHEMBL1966343,CHEMBL1966425,CHEMBL1966514,CHEMBL1966628,CHEMBL1966703,CHEMBL1966722,CHEMBL1966808,CHEMBL1966816,CHEMBL1967094,CHEMBL1967116,CHEMBL1967302,CHEMBL1967531,CHEMBL1967544,CHEMBL1967560,CHEMBL1967564,CHEMBL1967720,CHEMBL1967878,CHEMBL1967887,CHEMBL1968127,CHEMBL1968151,CHEMBL1968380,CHEMBL1968406,CHEMBL1968590,CHEMBL1968705,CHEMBL1968791,CHEMBL1968926,CHEMBL1969042,CHEMBL1969049,CHEMBL1969126,CHEMBL1969190,CHEMBL1969301,CHEMBL1969372,CHEMBL1969502,CHEMBL1969506,CHEMBL1969537,CHEMBL1969561,CHEMBL1969588,CHEMBL1969664,CHEMBL1969735,CHEMBL1969755,CHEMBL1969843,CHEMBL1969879,CHEMBL1970074,CHEMBL1970104,CHEMBL1970142,CHEMBL1970189,CHEMBL1970203,CHEMBL1970217,CHEMBL1970314,CHEMBL1970340,CHEMBL1970369,CHEMBL1970522,CHEMBL1970709,CHEMBL1970735,CHEMBL1970806,CHEMBL1970903,CHEMBL1970913,CHEMBL1971021,CHEMBL1971141,CHEMBL1971149,CHEMBL1971186,CHEMBL1971245,CHEMBL1971430,CHEMBL1971649,CHEMBL1971694,CHEMBL1971943,CHEMBL1972119,CHEMBL1972125,CHEMBL1972142,CHEMBL1972152,CHEMBL1972158,CHEMBL1972183,CHEMBL1972221,CHEMBL1972258,CHEMBL1972276,CHEMBL1972489,CHEMBL1972568,CHEMBL1972576,CHEMBL1972584,CHEMBL1972659,CHEMBL1972820,CHEMBL1972849,CHEMBL1972937,CHEMBL1973098,CHEMBL1973142,CHEMBL1973145,CHEMBL1973211,CHEMBL1973348,CHEMBL1973483,CHEMBL1973540,CHEMBL1973808,CHEMBL1973860,CHEMBL1973893,CHEMBL1973937,CHEMBL1974157,CHEMBL1974254,CHEMBL1974288,CHEMBL1974310,CHEMBL1974328,CHEMBL1974416,CHEMBL1974664,CHEMBL1974702,CHEMBL1974803,CHEMBL1974870,CHEMBL1974935,CHEMBL1975121,CHEMBL1975128,CHEMBL1975138,CHEMBL1975208,CHEMBL1975233,CHEMBL1975256,CHEMBL1975357,CHEMBL1975490,CHEMBL1975500,CHEMBL1975534,CHEMBL1975647,CHEMBL1975900,CHEMBL1976090,CHEMBL1976093,CHEMBL1976134,CHEMBL1976220,CHEMBL1976240,CHEMBL1976396,CHEMBL1976420,CHEMBL1976455,CHEMBL1976732,CHEMBL1977135,CHEMBL1977148,CHEMBL1977346,CHEMBL1977374,CHEMBL1977604,CHEMBL1977681,CHEMBL1977713,CHEMBL1978014,CHEMBL1978099,CHEMBL1978200,CHEMBL1978448,CHEMBL1978645,CHEMBL1979057,CHEMBL1979093,CHEMBL1979176,CHEMBL1979252,CHEMBL1979318,CHEMBL1979357,CHEMBL1979516,CHEMBL1979577,CHEMBL1979855,CHEMBL1979883,CHEMBL1979970,CHEMBL1980142,CHEMBL1980144,CHEMBL1980163,CHEMBL1980297,CHEMBL1980391,CHEMBL1980489,CHEMBL1980540,CHEMBL1980704,CHEMBL1980896,CHEMBL1981047,CHEMBL1981079,CHEMBL1981410,CHEMBL1981720,CHEMBL1981725,CHEMBL1981782,CHEMBL1981947,CHEMBL1982122,CHEMBL1982135,CHEMBL1982361,CHEMBL1982383,CHEMBL1982465,CHEMBL1982466,CHEMBL1982506,CHEMBL1982563,CHEMBL1982610,CHEMBL1982660,CHEMBL1982711,CHEMBL1982866,CHEMBL1982874,CHEMBL1982924,CHEMBL1982957,CHEMBL1982980,CHEMBL1982992,CHEMBL1983025,CHEMBL1983111,CHEMBL1983195,CHEMBL1983255,CHEMBL1983309,CHEMBL1983449,CHEMBL1983534,CHEMBL1983923,CHEMBL1983932,CHEMBL1983945,CHEMBL1983963,CHEMBL1984038,CHEMBL1984039,CHEMBL1984044,CHEMBL1984162,CHEMBL1984191,CHEMBL1984274,CHEMBL1984363,CHEMBL1984367,CHEMBL1984586,CHEMBL1984633,CHEMBL1984700,CHEMBL1984711,CHEMBL1984788,CHEMBL1985074,CHEMBL1985092,CHEMBL1985095,CHEMBL1985406,CHEMBL1985690,CHEMBL1986139,CHEMBL1986186,CHEMBL1986263,CHEMBL1986328,CHEMBL1986499,CHEMBL1986530,CHEMBL1986597,CHEMBL1986603,CHEMBL1986781,CHEMBL1986869,CHEMBL1986943,CHEMBL1986970,CHEMBL1987007,CHEMBL1987009,CHEMBL1987034,CHEMBL1987359,CHEMBL1987533,CHEMBL1987679,CHEMBL1987793,CHEMBL1987910,CHEMBL1987982,CHEMBL1988075,CHEMBL1988153,CHEMBL1988163,CHEMBL1988173,CHEMBL1988300,CHEMBL1988387,CHEMBL1988437,CHEMBL1988537,CHEMBL1988594,CHEMBL1988608,CHEMBL1988717,CHEMBL1988838,CHEMBL1988995,CHEMBL1989029,CHEMBL1989265,CHEMBL1989474,CHEMBL1989518,CHEMBL1989646,CHEMBL1989708,CHEMBL1989805,CHEMBL1989957,CHEMBL1990254,CHEMBL1990288,CHEMBL1990415,CHEMBL1990482,CHEMBL1990496,CHEMBL1990635,CHEMBL1990821,CHEMBL1990884,CHEMBL1990885,CHEMBL1990904,CHEMBL1990912,CHEMBL1991063,CHEMBL1991078,CHEMBL1991138,CHEMBL1991143,CHEMBL1991188,CHEMBL1991285,CHEMBL1991356,CHEMBL1991395,CHEMBL1991429,CHEMBL1991434,CHEMBL1991674,CHEMBL1991678,CHEMBL1991725,CHEMBL1992242,CHEMBL1992306,CHEMBL1992323,CHEMBL1992342,CHEMBL1992536,CHEMBL1992555,CHEMBL1992634,CHEMBL1992922,CHEMBL1992937,CHEMBL1993243,CHEMBL1993424,CHEMBL1993548,CHEMBL1993584,CHEMBL1993661,CHEMBL1993722,CHEMBL1993781,CHEMBL1993941,CHEMBL1994040,CHEMBL1994074,CHEMBL1994214,CHEMBL1994321,CHEMBL1994526,CHEMBL1994538,CHEMBL1994693,CHEMBL1994830,CHEMBL1994864,CHEMBL1994938,CHEMBL1995172,CHEMBL1995736,CHEMBL1995740,CHEMBL1995813,CHEMBL1995832,CHEMBL1995927,CHEMBL1996066,CHEMBL1996111,CHEMBL1996208,CHEMBL1996234,CHEMBL1996500,CHEMBL1996587,CHEMBL1996791,CHEMBL1996817,CHEMBL1996831,CHEMBL1996923,CHEMBL1996931,CHEMBL1996979,CHEMBL1997023,CHEMBL1997025,CHEMBL1997340,CHEMBL1997349,CHEMBL1997503,CHEMBL1997534,CHEMBL1997597,CHEMBL1997617,CHEMBL1997764,CHEMBL1997822,CHEMBL1997839,CHEMBL1997846,CHEMBL1997872,CHEMBL1998112,CHEMBL1998121,CHEMBL1998159,CHEMBL1998165,CHEMBL1998193,CHEMBL1998414,CHEMBL1998435,CHEMBL1998545,CHEMBL1998551,CHEMBL1998585,CHEMBL1998611,CHEMBL1998829,CHEMBL1999112,CHEMBL1999126,CHEMBL1999321,CHEMBL1999428,CHEMBL1999496,CHEMBL1999590,CHEMBL1999714,CHEMBL1999718,CHEMBL1999811,CHEMBL1999931,CHEMBL2000071,CHEMBL2000114,CHEMBL2000335,CHEMBL2000354,CHEMBL2000393,CHEMBL2000408,CHEMBL2000429,CHEMBL2000481,CHEMBL2000508,CHEMBL2000568,CHEMBL2000801,CHEMBL2000832,CHEMBL2000894,CHEMBL2001224,CHEMBL2001239,CHEMBL2001257,CHEMBL2001288,CHEMBL2001485,CHEMBL2001547,CHEMBL2001646,CHEMBL2001668,CHEMBL2001751,CHEMBL2001920,CHEMBL2001957,CHEMBL2002165,CHEMBL2002240,CHEMBL2002373,CHEMBL2002446,CHEMBL2002470,CHEMBL2002479,CHEMBL2002649,CHEMBL2002682,CHEMBL2002702,CHEMBL2002726,CHEMBL2002992,CHEMBL2003271,CHEMBL2003286,CHEMBL2003341,CHEMBL2003405,CHEMBL2003420,CHEMBL2003456,CHEMBL2003482,CHEMBL2003638,CHEMBL2003768,CHEMBL2003817,CHEMBL2004290,CHEMBL2004311,CHEMBL2004365,CHEMBL2004419,CHEMBL2004447,CHEMBL2004513,CHEMBL2004544,CHEMBL2004615,CHEMBL2004647,CHEMBL2004692,CHEMBL2004716,CHEMBL2004771,CHEMBL2004871,CHEMBL2004872,CHEMBL2004892,CHEMBL2004934,CHEMBL2005112,CHEMBL2005186,CHEMBL2005375,CHEMBL2005475,CHEMBL2005528,CHEMBL2005631,CHEMBL2005828,CHEMBL2005886,CHEMBL2005899,CHEMBL2005936,CHEMBL2006010,CHEMBL2006156,CHEMBL2006188,CHEMBL2006237,CHEMBL2006263,CHEMBL2006276,CHEMBL2006439,CHEMBL2006481,CHEMBL2006493,CHEMBL2006580,CHEMBL2006631,CHEMBL2006715,CHEMBL2006778,CHEMBL2006785,CHEMBL2006836,CHEMBL2007002,CHEMBL2007064,CHEMBL2007296,CHEMBL2007372,CHEMBL2007592,CHEMBL205526,CHEMBL2063416,CHEMBL207253,CHEMBL207400,CHEMBL208637,CHEMBL210032,CHEMBL210618,CHEMBL210887,CHEMBL210928,CHEMBL210963,CHEMBL211378,CHEMBL213505,CHEMBL215152,CHEMBL220057,CHEMBL220241,CHEMBL221959,CHEMBL223360,CHEMBL225519,CHEMBL226403,CHEMBL226471,CHEMBL230011,CHEMBL2309006,CHEMBL2309609,CHEMBL231209,CHEMBL234085,CHEMBL243088,CHEMBL244378,CHEMBL246970,CHEMBL24828,CHEMBL249697,CHEMBL253969,CHEMBL255863,CHEMBL256835,CHEMBL259084,CHEMBL259922,CHEMBL260135,CHEMBL261849,CHEMBL262433,CHEMBL271381,CHEMBL272453,CHEMBL278041,CHEMBL288441,CHEMBL296468,CHEMBL300138,CHEMBL306380,CHEMBL316264,CHEMBL31965,CHEMBL340384,CHEMBL340921,CHEMBL362558,CHEMBL363648,CHEMBL371206,CHEMBL377300,CHEMBL377383,CHEMBL378627,CHEMBL379218,CHEMBL379835,CHEMBL384304,CHEMBL386051,CHEMBL387971,CHEMBL392642,CHEMBL394619,CHEMBL394790,CHEMBL396523,CHEMBL398951,CHEMBL402846,CHEMBL404367,CHEMBL411903,CHEMBL412142,CHEMBL41783,CHEMBL422897,CHEMBL424872,CHEMBL428690,CHEMBL440084,CHEMBL443962,CHEMBL445813,CHEMBL450786,CHEMBL458997,CHEMBL462120,CHEMBL464552,CHEMBL468280,CHEMBL474432,CHEMBL475251,CHEMBL477772,CHEMBL481491,CHEMBL482767,CHEMBL482967,CHEMBL483158,CHEMBL483321,CHEMBL484390,CHEMBL491473,CHEMBL491758,CHEMBL494089,CHEMBL497151,CHEMBL50,CHEMBL508928,CHEMBL50894,CHEMBL509032,CHEMBL513846,CHEMBL513909,CHEMBL514499,CHEMBL519697,CHEMBL521851,CHEMBL522892,CHEMBL52387,CHEMBL525191,CHEMBL526133,CHEMBL535,CHEMBL535331,CHEMBL539474,CHEMBL553,CHEMBL554,CHEMBL558752,CHEMBL560813,CHEMBL565612,CHEMBL572878,CHEMBL572881,CHEMBL573339,CHEMBL574738,CHEMBL576982,CHEMBL583144,CHEMBL592030,CHEMBL601719,CHEMBL607707,CHEMBL608154,CHEMBL7064,CHEMBL91829,CHEMBL939,CHEMBL941,CHEMBL95692}
@attribute nPyrroles numeric
@attribute Chi0_EA.dm. numeric
@attribute ATSC3m numeric
@attribute MATS1v numeric
@attribute Chi1_EA.dm. numeric
@attribute PHI numeric
@attribute P_VSA_i_3 numeric
@attribute ATSC4p numeric
@attribute P_VSA_e_3 numeric
@attribute nPyrazines numeric
@attribute Eig03_AEA.ed. 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 pXC50 numeric

@data
{2 4.368,3 18.974,4 0.039,5 2.498,6 4.763,7 198.723,8 7.928,9 50.357,11 5.879,12 1.682,13 10.037,14 3.884,15 15.085,16 105.742,17 8.778,18 0.767,19 3.876,20 3.969,21 3.685,22 3.557,23 5.067,24 3.514,25 4.342,26 4.468,27 3.966,28 3.915,29 5.557,30 3.863,31 4.56,32 4.722,33 3.994,34 3.994,35 5.781,36 3.931,37 4.58,38 4.762,39 3.908,40 3.95,41 5.751,42 3.886,43 4.601,44 4.819,45 3.857,46 3.946,47 5.646,48 3.871,49 4.499,50 4.692,51 3.898,52 3.935,53 5.602,54 3.856,55 4.493,56 4.659,57 3.897,58 3.953,59 5.719,60 3.858,61 4.594,62 4.821,63 3.718,64 3.862,65 5.71,66 3.742,67 0.057,68 0.666,69 7.483,70 5.05}
{0 CHEMBL101253,2 18.364,3 18.583,4 0.028,5 28.435,6 4.384,7 203.944,8 7.228,9 68.122,11 5.423,12 1.496,13 10.4,14 4.705,15 22.138,16 100.976,17 8.671,18 0.821,19 3.803,20 3.913,21 3.514,22 3.464,23 4.975,24 3.437,25 4.262,26 4.398,27 3.86,28 3.837,29 5.382,30 3.788,31 4.511,32 4.697,33 3.901,34 3.938,35 5.564,36 3.861,37 4.515,38 4.732,39 3.756,40 3.84,41 5.52,42 3.754,43 4.451,44 4.676,45 3.759,46 3.782,47 5.493,48 3.723,49 4.382,50 4.579,51 3.717,52 3.806,53 5.456,54 3.734,55 4.37,56 4.573,57 3.668,58 3.781,59 5.403,60 3.675,61 4.285,62 4.512,63 3.486,64 3.609,65 5.255,66 3.465,67 0.036,68 0.569,69 5.871,70 5.05}
{0 CHEMBL103667,2 36.989,3 41.95,4 -0.005,5 47.755,6 8.336,7 459.133,8 16.419,9 57.585,11 6.493,12 1.476,13 15.333,14 5.907,15 34.897,16 153.448,17 6.944,18 0.512,19 4.416,20 4.543,21 3.928,22 3.926,23 5.446,24 3.899,25 4.975,26 5.161,27 4.296,28 4.324,29 5.966,30 4.279,31 5.224,32 5.428,33 4.344,34 4.489,35 6.191,36 4.408,37 5.354,38 5.615,39 4.314,40 4.494,41 6.25,42 4.385,43 5.289,44 5.537,45 4.298,46 4.402,47 6.266,48 4.322,49 5.161,50 5.377,51 4.272,52 4.38,53 6.186,54 4.313,55 5.213,56 5.426,57 4.329,58 4.471,59 6.285,60 4.385,61 5.328,62 5.566,63 4.237,64 4.518,65 6.285,66 4.402,67 0.071,68 1.114,69 17.099,70 4.398}
{0 CHEMBL105442,2 16.843,3 33.685,4 0.043,5 19.271,6 6.015,7 216.766,8 9.47,9 38.636,11 5.862,12 1.983,13 9.88,14 4.908,15 24.087,16 99.228,17 12.274,18 0.444,19 3.792,20 3.884,21 3.775,22 3.435,23 5.022,24 3.394,25 4.273,26 4.4,27 4.197,28 3.786,29 5.534,30 3.708,31 4.519,32 4.69,33 4.354,34 3.863,35 6.008,36 3.773,37 4.473,38 4.655,39 4.497,40 3.765,41 5.852,42 3.678,43 4.37,44 4.525,45 4.097,46 3.624,47 5.907,48 3.633,49 4.392,50 4.524,51 4.225,52 3.733,53 6.046,54 3.707,55 4.409,56 4.554,57 4.266,58 3.714,59 5.974,60 3.646,61 4.31,62 4.504,63 4.362,64 3.646,65 5.56,66 3.482,67 0.19,68 0.668,69 0.871,70 5}
{0 CHEMBL1084546,2 36.58,3 24.984,4 0.003,5 61.621,6 6.694,7 269.567,8 9.548,9 105.907,11 6.259,12 2.002,13 12.6,14 3.111,15 9.678,16 125.221,17 9.228,18 0.474,19 4.149,20 4.255,21 3.99,22 3.651,23 5.359,24 3.667,25 4.704,26 4.855,27 4.362,28 4.024,29 6.412,30 4.039,31 4.88,32 5.041,33 4.333,34 4.128,35 6.214,36 4.132,37 4.996,38 5.202,39 4.37,40 4.122,41 6.476,42 4.104,43 4.942,44 5.154,45 4.237,46 4.101,47 6.192,48 4.067,49 4.961,50 5.186,51 4.17,52 4.037,53 6.312,54 4.009,55 4.841,56 5.061,57 4.216,58 3.971,59 6.151,60 3.981,61 4.804,62 4.988,63 4.381,64 3.967,65 6.417,66 4.004,67 0.3,68 1.116,69 9.7,70 5.1}
{0 CHEMBL1090356,2 30.357,3 35.72,4 0.01,5 47.09,6 8.038,7 353.965,8 14.089,9 90.789,11 6.027,12 1.601,13 17.093,14 6.24,15 38.943,16 169.241,17 8.163,18 0.673,19 4.398,20 4.509,21 4.085,22 3.997,23 5.506,24 3.973,25 4.916,26 5.065,27 4.454,28 4.381,29 6.004,30 4.342,31 5.142,32 5.34,33 4.431,34 4.491,35 6.154,36 4.42,37 5.153,38 5.367,39 4.421,40 4.484,41 6.17,42 4.405,43 5.193,44 5.404,45 4.516,46 4.521,47 6.267,48 4.446,49 5.178,50 5.387,51 4.48,52 4.509,53 6.228,54 4.421,55 5.087,56 5.289,57 4.409,58 4.428,59 6.127,60 4.34,61 5.045,62 5.26,63 4.321,64 4.38,65 6.056,66 4.295,67 0.031,68 1.102,69 13,70 5.1}
{0 CHEMBL1090360,2 30.357,3 35.72,4 0.01,5 49.59,6 8.038,7 353.965,8 14.149,9 90.789,11 6.027,12 1.601,13 16.395,14 6.24,15 38.943,16 169.241,17 8.163,18 0.673,19 4.398,20 4.509,21 4.085,22 3.997,23 5.506,24 3.973,25 4.916,26 5.065,27 4.454,28 4.381,29 6.004,30 4.342,31 5.142,32 5.34,33 4.431,34 4.491,35 6.152,36 4.42,37 5.153,38 5.367,39 4.435,40 4.485,41 6.171,42 4.408,43 5.198,44 5.405,45 4.539,46 4.53,47 6.274,48 4.462,49 5.205,50 5.409,51 4.524,52 4.543,53 6.263,54 4.459,55 5.157,56 5.365,57 4.456,58 4.48,59 6.189,60 4.391,61 5.111,62 5.332,63 4.352,64 4.421,65 6.116,66 4.338,67 0.031,68 1.102,69 13,70 5.1}
{0 CHEMBL116070,2 10.938,3 17.876,4 0.074,5 11.167,6 3.721,7 118.543,8 5.641,9 95.637,11 5.465,12 1.898,13 8.55,14 3.143,15 9.881,16 81.507,17 12.042,18 0.727,19 3.513,20 3.582,21 3.534,22 3.235,23 4.777,24 3.191,25 3.943,26 4.021,27 3.991,28 3.623,29 5.265,30 3.552,31 4.129,32 4.222,33 4.023,34 3.636,35 5.398,36 3.553,37 4.028,38 4.15,39 3.71,40 3.452,41 5.234,42 3.38,43 3.876,44 4.03,45 3.586,46 3.316,47 5.069,48 3.262,49 3.903,50 4.043,51 3.611,52 3.352,53 5.342,54 3.277,55 3.868,56 4.06,57 3.523,58 3.296,59 4.921,60 3.124,61 3.513,62 3.686,63 3.575,64 3.012,65 4.712,66 2.831,67 0.082,68 0.371,69 0.346,70 5.1}
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{0 CHEMBL1516890,1 1,2 10.682,3 13.463,4 0.021,5 13.192,6 2.61,7 166.398,8 6.197,9 36.695,11 5.557,12 1.489,13 7.905,14 2.508,15 6.292,16 81.405,17 8.098,18 0.667,19 3.659,20 3.768,21 3.318,22 3.282,23 4.818,24 3.273,25 4.149,26 4.294,27 3.699,28 3.685,29 5.289,30 3.664,31 4.328,32 4.494,33 3.707,34 3.765,35 5.461,36 3.716,37 4.359,38 4.561,39 3.547,40 3.707,41 5.449,42 3.625,43 4.245,44 4.444,45 3.417,46 3.558,47 5.358,48 3.475,49 4.199,50 4.428,51 3.405,52 3.435,53 5.306,54 3.376,55 4.005,56 4.193,57 3.316,58 3.336,59 5.192,60 3.294,61 4.002,62 4.225,63 2.901,64 3.166,65 5.129,66 3.07,67 0.013,68 0.494,69 5.632,70 5.1}
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{0 CHEMBL162,1 2,2 28.268,3 35.68,4 0.039,5 43.083,6 3.859,7 329.651,8 17.103,9 39.82,11 6.984,12 1.512,13 8.057,14 3.82,15 14.59,16 131.874,17 7.649,18 0.571,19 4.263,20 4.37,21 3.882,22 3.832,23 5.286,24 3.826,25 4.873,26 5.021,27 4.374,28 4.318,29 5.859,30 4.309,31 5.178,32 5.337,33 4.61,34 4.573,35 6.149,36 4.556,37 5.369,38 5.531,39 4.757,40 4.756,41 6.333,42 4.727,43 5.532,44 5.717,45 4.778,46 4.847,47 6.495,48 4.794,49 5.585,50 5.797,51 4.686,52 4.848,53 6.518,54 4.761,55 5.533,56 5.767,57 4.425,58 4.709,59 6.463,60 4.58,61 5.314,62 5.575,63 3.935,64 4.389,65 6.201,66 4.21,67 0.027,68 0.917,69 12.149,70 8.705}
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{0 CHEMBL1682558,2 13.2,3 26.741,4 -0.007,5 13.238,6 5.046,7 258.193,8 10.448,9 55.135,11 5.854,12 1.597,13 10.034,14 3.356,15 11.259,16 111.013,17 7.676,18 0.636,19 4.059,20 4.181,21 3.667,22 3.586,23 5.143,24 3.582,25 4.613,26 4.788,27 4.014,28 3.992,29 5.652,30 3.972,31 4.827,32 5.039,33 4.001,34 4.12,35 5.805,36 4.048,37 4.876,38 5.118,39 3.942,40 4.118,41 5.774,42 4.02,43 4.869,44 5.126,45 3.944,46 4.089,47 5.726,48 4.001,49 4.808,50 5.022,51 4.019,52 4.13,53 5.785,54 4.051,55 4.896,56 5.123,57 4.032,58 4.156,59 5.875,60 4.066,61 4.878,62 5.121,63 3.891,64 4.059,65 5.842,66 3.96,67 0.058,68 0.866,69 9.994,70 5.1}
{0 CHEMBL1721885,1 1,2 27.43,3 32.893,4 0.031,5 32.432,6 6.767,7 374.708,8 12.412,9 55.931,11 5.706,12 1.672,13 13.219,14 1.477,15 2.182,16 119.219,17 7.501,18 0.314,19 4.185,20 4.306,21 3.74,22 3.66,23 5.304,24 3.661,25 4.749,26 4.924,27 4.121,28 4.065,29 5.87,30 4.049,31 4.994,32 5.19,33 4.166,34 4.207,35 6.128,36 4.159,37 5.082,38 5.314,39 4.121,40 4.214,41 6.167,42 4.135,43 5.078,44 5.306,45 4.098,46 4.128,47 6.304,48 4.069,49 5.032,50 5.27,51 4.038,52 4.095,53 6.228,54 4.026,55 4.95,56 5.189,57 4.002,58 4.053,59 6.049,60 3.982,61 4.921,62 5.134,63 3.934,64 3.971,65 6.219,66 3.912,67 0.129,68 0.935,69 12.267,70 5.638}
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{0 CHEMBL17370,2 3.956,3 17.923,4 0.039,5 2.018,6 4.659,7 176.567,8 7.564,9 50.357,11 5.772,12 1.559,13 9.923,14 4.996,15 24.957,16 104.37,17 8.606,18 0.793,19 3.846,20 3.947,21 3.591,22 3.535,23 5.026,24 3.488,25 4.306,26 4.44,27 3.914,28 3.897,29 5.471,30 3.832,31 4.491,32 4.659,33 3.937,34 3.967,35 5.63,36 3.891,37 4.526,38 4.716,39 3.848,40 3.926,41 5.616,42 3.848,43 4.561,44 4.785,45 3.823,46 3.931,47 5.555,48 3.848,49 4.484,50 4.68,51 3.87,52 3.926,53 5.571,54 3.841,55 4.458,56 4.629,57 3.832,58 3.942,59 5.593,60 3.834,61 4.553,62 4.79,63 3.648,64 3.839,65 5.612,66 3.703,67 0.014,68 0.635,69 6.697,70 5.2}
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{0 CHEMBL1964937,1 1,2 14.444,3 25.924,4 0.039,5 17.412,6 5.232,7 291.479,8 9.76,9 54.706,11 5.962,12 1.526,13 11.667,14 1.937,15 3.752,16 104.771,17 7.397,18 0.533,19 3.997,20 4.12,21 3.557,22 3.539,23 5.1,24 3.522,25 4.522,26 4.691,27 3.899,28 3.946,29 5.588,30 3.898,31 4.789,32 5.002,33 3.954,34 4.079,35 5.776,36 4.001,37 4.85,38 5.066,39 3.904,40 4.051,41 5.914,42 3.969,43 4.878,44 5.119,45 3.827,46 3.985,47 5.986,48 3.887,49 4.795,50 5.052,51 3.693,52 3.895,53 5.762,54 3.787,55 4.69,56 4.945,57 3.555,58 3.785,59 5.691,60 3.67,61 4.532,62 4.792,63 3.392,64 3.637,65 5.524,66 3.508,67 0.039,68 0.737,69 10.103,70 5.3}
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{0 CHEMBL1965589,2 15.053,3 21.927,4 0.016,5 17.95,6 4.407,7 231.021,8 7.422,9 86.439,10 1,11 6.36,12 1.735,13 10.067,14 3.218,15 10.356,16 106.995,17 8.509,18 0.647,19 4.02,20 4.134,21 3.694,22 3.547,23 5.231,24 3.569,25 4.518,26 4.679,27 4.076,28 3.898,29 5.763,30 3.915,31 4.738,32 4.927,33 4.126,34 3.988,35 6.006,36 3.995,37 4.759,38 4.976,39 4.128,40 3.99,41 6.089,42 3.992,43 4.696,44 4.883,45 4.145,46 4.035,47 5.914,48 4.025,49 4.753,50 4.939,51 4.197,52 4.076,53 6.058,54 4.073,55 4.818,56 5.011,57 4.113,58 4.056,59 6.105,60 4.028,61 4.808,62 5.053,63 3.862,64 3.872,65 6.039,66 3.8,67 0.148,68 0.923,69 7.543,70 5.1}
{0 CHEMBL1965660,1 1,2 9.189,3 13.259,4 0.128,5 6.774,6 4.259,7 174.069,8 5.376,9 116.151,11 5.903,12 1.844,13 8.435,14 3.299,15 10.88,16 89.973,17 10.241,18 0.68,19 3.67,20 3.781,21 3.483,22 3.274,23 4.975,24 3.279,25 4.096,26 4.215,27 3.905,28 3.66,29 5.485,30 3.643,31 4.311,32 4.453,33 3.968,34 3.769,35 5.602,36 3.728,37 4.329,38 4.477,39 4.072,40 3.745,41 5.679,42 3.702,43 4.357,44 4.54,45 3.855,46 3.718,47 5.598,48 3.657,49 4.321,50 4.506,51 3.894,52 3.59,53 5.772,54 3.555,55 4.203,56 4.39,57 3.713,58 3.469,59 5.548,60 3.404,61 4,62 4.191,63 3.593,64 3.228,65 5.556,66 3.157,67 0.14,68 0.532,69 3.247,70 5.1}
{0 CHEMBL1965836,2 16.206,3 22.586,4 0.04,5 16.1,6 6.356,7 233.88,8 11.027,9 83.009,11 6.117,12 1.746,13 13.625,14 5.332,15 28.431,16 114.669,17 8.349,18 0.629,19 4.095,20 4.205,21 3.739,22 3.607,23 5.3,24 3.624,25 4.632,26 4.773,27 4.182,28 3.982,29 6.281,30 3.986,31 4.789,32 4.968,33 4.06,34 4.106,35 5.9,36 4.056,37 4.905,38 5.13,39 4.032,40 4.084,41 6.01,42 4.022,43 4.859,44 5.076,45 4,46 4.01,47 6.054,48 3.968,49 4.817,50 5.033,51 3.972,52 3.942,53 6.01,54 3.903,55 4.789,56 5.026,57 3.814,58 3.841,59 5.938,60 3.793,61 4.626,62 4.851,63 3.82,64 3.753,65 5.953,66 3.711,67 0.195,68 0.984,69 8.79,70 6.3}
{0 CHEMBL1965845,1 1,2 19.002,3 26.497,4 0.005,5 23.993,6 5.465,7 295.109,8 10.541,9 54.706,11 5.954,12 1.505,13 12.393,14 2.809,15 7.889,16 109.69,17 7.24,18 0.516,19 4.049,20 4.173,21 3.598,22 3.579,23 5.125,24 3.56,25 4.587,26 4.766,27 3.945,28 3.976,29 5.622,30 3.932,31 4.808,32 5.012,33 3.992,34 4.121,35 5.775,36 4.047,37 4.898,38 5.111,39 3.928,40 4.122,41 5.917,42 4.026,43 4.946,44 5.2,45 3.815,46 4.059,47 5.885,48 3.939,49 4.846,50 5.102,51 3.697,52 3.965,53 5.734,54 3.839,55 4.778,56 5.055,57 3.604,58 3.864,59 5.709,60 3.722,61 4.624,62 4.902,63 3.505,64 3.7,65 5.56,66 3.575,67 0.026,68 0.774,69 10.997,70 5.1}
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{0 CHEMBL1966279,2 19.367,3 32.707,4 0.084,5 18.535,6 7.081,7 306.483,8 11.656,9 101.864,11 6.064,12 1.733,13 14.706,14 1.622,15 2.631,16 128.796,17 8.379,18 0.486,19 4.152,20 4.258,21 3.93,22 3.744,23 5.318,24 3.715,25 4.654,26 4.789,27 4.221,28 4.125,29 6.01,30 4.078,31 4.931,32 5.113,33 4.31,34 4.258,35 6.168,36 4.195,37 4.974,38 5.163,39 4.269,40 4.2,41 6.265,42 4.15,43 4.912,44 5.096,45 4.223,46 4.151,47 6.182,48 4.104,49 4.869,50 5.051,51 4.073,52 4.108,53 6.333,54 4.027,55 4.786,56 5.001,57 3.882,58 4.01,59 5.917,60 3.901,61 4.661,62 4.882,63 3.843,64 3.858,65 5.847,66 3.766,67 0.169,68 0.887,69 12.45,70 5.1}
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{0 CHEMBL1966628,1 1,2 12.649,3 25.342,4 0.058,5 20,6 3.878,7 188.338,8 7.626,9 118.05,11 5.54,12 1.439,13 10,14 1.862,15 3.467,16 90.848,17 7.173,18 0.615,19 3.875,20 4.021,21 3.42,22 3.398,23 4.924,24 3.379,25 4.419,26 4.607,27 3.778,28 3.822,29 5.41,30 3.766,31 4.72,32 4.977,33 3.761,34 3.922,35 5.596,36 3.825,37 4.708,38 4.99,39 3.627,40 3.831,41 5.563,42 3.715,43 4.559,44 4.842,45 3.545,46 3.686,47 5.463,48 3.588,49 4.37,50 4.619,51 3.47,52 3.582,53 5.335,54 3.505,55 4.298,56 4.546,57 3.318,58 3.537,59 5.239,60 3.42,61 4.243,62 4.499,63 3.163,64 3.465,65 5.063,66 3.331,67 0.048,68 0.712,69 9.431,70 7.1}
{0 CHEMBL1966703,2 19.011,3 23.447,4 0.068,5 24.686,6 3.347,7 254.563,8 12.134,9 50.112,11 6.3,12 1.553,13 7.083,14 3.471,15 12.049,16 93.552,17 7.396,18 0.407,19 3.893,20 4.014,21 3.455,22 3.463,23 5.005,24 3.437,25 4.446,26 4.618,27 3.896,28 3.916,29 5.483,30 3.876,31 4.742,32 4.913,33 4.009,34 4.119,35 5.802,36 4.052,37 4.995,38 5.254,39 4.062,40 4.147,41 6.023,42 4.068,43 4.826,44 5.023,45 4.045,46 4.074,47 5.995,48 4.036,49 4.815,50 5.007,51 4.063,52 4.032,53 6.162,54 3.976,55 4.844,56 5.111,57 3.403,58 3.836,59 5.889,60 3.684,61 4.507,62 4.838,63 2.753,64 3.434,65 5.269,66 3.18,67 0.06,68 0.718,69 9.099,70 5.1}
{0 CHEMBL1966722,2 18.538,3 25.039,4 0.077,5 21.476,6 6.645,7 271.772,8 9.83,9 53.787,11 5.527,12 1.74,13 11.214,14 4.272,15 18.253,16 114.116,17 8.955,18 0.6,19 3.926,20 4.032,21 3.635,22 3.553,23 5.139,24 3.52,25 4.373,26 4.49,27 4.029,28 3.916,29 5.612,30 3.868,31 4.686,32 4.85,33 4.14,34 4.059,35 6.005,36 3.985,37 4.733,38 4.908,39 4.105,40 4.021,41 6.029,42 3.953,43 4.748,44 4.928,45 4.147,46 4.005,47 6.095,48 3.942,49 4.723,50 4.929,51 4.002,52 3.973,53 5.947,54 3.864,55 4.599,56 4.831,57 3.98,58 3.896,59 5.722,60 3.743,61 4.415,62 4.625,63 3.766,64 3.762,65 5.585,66 3.613,67 0.1,68 0.63,69 6.892,70 5.5}
{0 CHEMBL1966808,2 15.889,3 21.051,4 0.032,5 20.315,6 2.89,7 166.398,8 7.496,9 70.021,11 6.034,12 1.733,13 8.391,14 2.887,15 8.333,16 86.049,17 8.984,18 0.593,19 3.753,20 3.858,21 3.545,22 3.387,23 4.864,24 3.362,25 4.298,26 4.442,27 3.993,28 3.832,29 5.41,30 3.781,31 4.507,32 4.693,33 4.011,34 3.924,35 5.575,36 3.839,37 4.465,38 4.646,39 3.997,40 3.817,41 5.583,42 3.751,43 4.299,44 4.497,45 3.751,46 3.614,47 5.386,48 3.575,49 4.218,50 4.416,51 3.571,52 3.529,53 5.321,54 3.493,55 4.191,56 4.375,57 3.462,58 3.461,59 5.404,60 3.391,61 3.949,62 4.126,63 3.17,64 3.272,65 5.122,66 3.134,67 0.067,68 0.611,69 5.415,70 5.1}
{0 CHEMBL1966816,2 17.805,3 11.258,4 0.029,5 25.064,6 4.452,7 119.314,8 5.658,9 69.593,11 5.7,12 1.894,13 9.76,14 3.674,15 13.498,16 80.387,17 10.009,18 0.63,19 3.717,20 3.818,21 3.492,22 3.229,23 5.086,24 3.291,25 4.217,26 4.337,27 3.96,28 3.565,29 6.115,30 3.631,31 4.402,32 4.574,33 3.944,34 3.631,35 5.963,36 3.688,37 4.38,38 4.556,39 3.866,40 3.524,41 5.931,42 3.597,43 4.343,44 4.527,45 3.759,46 3.394,47 5.963,48 3.469,49 4.226,50 4.427,51 3.514,52 3.231,53 5.749,54 3.296,55 4.028,56 4.195,57 3.599,58 3.149,59 6.07,60 3.211,61 3.884,62 4.064,63 3.302,64 3.174,65 5.281,66 3.189,67 0.304,68 0.859,69 2.913,70 5.1}
{0 CHEMBL1967094,2 9.346,3 19.743,4 0.071,5 10.29,6 4.555,7 205.547,8 7.617,9 51.337,11 5.636,12 1.727,13 11.48,14 4.752,15 22.585,16 102.768,17 9.433,18 0.75,19 3.789,20 3.884,21 3.607,22 3.494,23 4.959,24 3.445,25 4.259,26 4.374,27 4.016,28 3.891,29 5.427,30 3.817,31 4.458,32 4.617,33 4.015,34 3.914,35 5.577,36 3.815,37 4.443,38 4.637,39 3.769,40 3.776,41 5.547,42 3.674,43 4.344,44 4.546,45 3.783,46 3.724,47 5.479,48 3.619,49 4.252,50 4.422,51 3.761,52 3.671,53 5.455,54 3.551,55 4.066,56 4.211,57 3.583,58 3.534,59 5.272,60 3.413,61 3.97,62 4.127,63 3.488,64 3.379,65 5.254,66 3.291,67 0.063,68 0.541,69 5.079,70 5.1}
{0 CHEMBL1967116,2 20.473,3 22.73,4 0.065,5 26.718,6 5.77,7 237.025,8 11.847,9 104.144,11 5.775,12 1.605,13 13.909,14 4.2,15 17.636,16 134.53,17 8.265,18 0.73,19 4.123,20 4.243,21 3.82,22 3.742,23 5.292,24 3.708,25 4.595,26 4.748,27 4.192,28 4.142,29 5.745,30 4.086,31 4.786,32 4.954,33 4.221,34 4.26,35 5.88,36 4.177,37 4.89,38 5.088,39 4.299,40 4.279,41 5.978,42 4.175,43 4.88,44 5.085,45 4.193,46 4.2,47 5.997,48 4.098,49 4.747,50 4.951,51 4.033,52 4.072,53 5.866,54 3.988,55 4.704,56 4.92,57 3.855,58 4.005,59 5.779,60 3.903,61 4.646,62 4.875,63 3.765,64 3.95,65 5.634,66 3.827,67 0.068,68 0.859,69 9.939,70 5.1}
{0 CHEMBL1967302,1 1,2 17.176,3 26.18,4 0.074,5 20.104,6 4.991,7 248.025,8 11.127,9 84.479,11 6.06,12 1.505,13 13.233,14 2.569,15 6.599,16 115.32,17 7.663,18 0.647,19 4.068,20 4.184,21 3.665,22 3.652,23 5.188,24 3.637,25 4.582,26 4.727,27 4.031,28 4.066,29 5.662,30 4.029,31 4.84,32 5.029,33 4.023,34 4.166,35 5.898,36 4.09,37 4.872,38 5.104,39 3.894,40 4.11,41 5.809,42 4.004,43 4.792,44 5.024,45 3.836,46 4.001,47 5.795,48 3.906,49 4.744,50 4.973,51 3.771,52 3.925,53 5.747,54 3.833,55 4.699,56 4.952,57 3.693,58 3.84,59 5.671,60 3.748,61 4.532,62 4.749,63 3.621,64 3.743,65 5.6,66 3.662,67 0.038,68 0.762,69 10.016,70 5.1}
{0 CHEMBL1967531,2 14.885,3 15.807,4 0.089,5 20.83,6 4.607,7 154.627,8 7.659,9 102.49,11 5.561,12 1.676,13 11.731,14 2.976,15 8.858,16 104.575,17 8.816,18 0.759,19 3.843,20 3.955,21 3.597,22 3.482,23 5.064,24 3.453,25 4.28,26 4.407,27 3.958,28 3.855,29 5.522,30 3.801,31 4.487,32 4.662,33 3.945,34 3.922,35 5.623,36 3.854,37 4.515,38 4.707,39 3.95,40 3.88,41 5.695,42 3.794,43 4.491,44 4.694,45 3.74,46 3.769,47 5.68,48 3.672,49 4.317,50 4.529,51 3.545,52 3.589,53 5.486,54 3.513,55 4.162,56 4.379,57 3.382,58 3.485,59 5.218,60 3.395,61 4.097,62 4.319,63 3.308,64 3.422,65 5.146,66 3.3,67 0.062,68 0.643,69 6.452,70 5.2}
{0 CHEMBL1967544,2 16.804,3 34.128,4 0.024,5 24.466,6 6.526,7 338.591,8 16.45,9 71.111,11 6.308,12 1.587,13 12.333,14 3.511,15 12.326,16 145.007,17 7.9,18 0.7,19 4.242,20 4.351,21 3.986,22 3.859,23 5.336,24 3.814,25 4.762,26 4.923,27 4.307,28 4.262,29 5.961,30 4.204,31 5,32 5.165,33 4.48,34 4.481,35 6.087,36 4.389,37 5.17,38 5.349,39 4.538,40 4.531,41 6.328,42 4.437,43 5.242,44 5.432,45 4.495,46 4.521,47 6.497,48 4.433,49 5.201,50 5.41,51 4.384,52 4.487,53 6.314,54 4.373,55 5.169,56 5.386,57 4.315,58 4.441,59 6.257,60 4.322,61 5.165,62 5.397,63 4.191,64 4.34,65 6.277,66 4.238,67 0.083,68 0.952,69 14.706,70 5.2}
{0 CHEMBL1967560,2 45.066,3 46.445,4 -0.045,5 77.376,6 8.264,7 485.049,8 13.899,9 81.845,11 6.218,12 1.556,13 14.237,14 3.201,15 10.244,16 147.504,17 6.878,18 0.286,19 4.426,20 4.568,21 3.93,22 3.864,23 5.433,24 3.849,25 5.026,26 5.239,27 4.312,28 4.283,29 5.981,30 4.244,31 5.3,32 5.536,33 4.439,34 4.468,35 6.248,36 4.407,37 5.401,38 5.648,39 4.448,40 4.502,41 6.397,42 4.44,43 5.403,44 5.64,45 4.458,46 4.532,47 6.474,48 4.462,49 5.377,50 5.609,51 4.349,52 4.528,53 6.366,54 4.428,55 5.404,56 5.679,57 4.187,58 4.437,59 6.3,60 4.31,61 5.256,62 5.535,63 4.114,64 4.302,65 6.143,66 4.186,67 0.048,68 1.18,69 17.784,70 5.1}
{0 CHEMBL1967564,2 8.052,3 16.238,4 0.037,5 10.484,6 3.077,7 166.398,8 4.696,9 68.122,11 5.271,12 1.571,13 8.316,14 2.361,15 5.573,16 69.818,17 7.707,18 0.714,19 3.614,20 3.743,21 3.215,22 3.163,23 4.754,24 3.153,25 4.113,26 4.284,27 3.563,28 3.534,29 5.236,30 3.499,31 4.324,32 4.544,33 3.56,34 3.564,35 5.418,36 3.518,37 4.261,38 4.493,39 3.436,40 3.443,41 5.39,42 3.396,43 4.104,44 4.313,45 3.312,46 3.292,47 5.324,48 3.262,49 3.997,50 4.224,51 3.129,52 3.185,53 5.106,54 3.124,55 3.901,56 4.155,57 2.823,58 3.05,59 4.899,60 2.948,61 3.752,62 4.011,63 2.567,64 2.885,65 4.764,66 2.752,67 0.053,68 0.526,69 6.303,70 5.1}
{0 CHEMBL1967720,2 24.903,3 26.883,4 0.087,5 35.532,6 6.905,7 262.17,8 13.462,9 137.041,11 6.345,12 1.759,13 15.474,14 3.569,15 12.735,16 146.818,17 8.543,18 0.643,19 4.247,20 4.366,21 3.949,22 3.83,23 5.483,24 3.813,25 4.725,26 4.869,27 4.357,28 4.236,29 5.985,30 4.203,31 4.986,32 5.153,33 4.439,34 4.377,35 6.227,36 4.329,37 5.132,38 5.335,39 4.483,40 4.422,41 6.385,42 4.345,43 5.095,44 5.316,45 4.331,46 4.341,47 6.241,48 4.242,49 4.866,50 5.064,51 4.2,52 4.191,53 6.126,54 4.122,55 4.828,56 5.019,57 4.204,58 4.208,59 5.978,60 4.124,61 4.926,62 5.137,63 4.211,64 4.225,65 6.087,66 4.122,67 0.15,68 1.051,69 10.45,70 5.1}
{0 CHEMBL1967878,2 36.662,3 38.369,4 0.024,5 58.849,6 6.084,7 331.194,8 13.441,9 108.738,11 6.094,12 1.582,13 13.424,14 3.131,15 9.8,16 130.054,17 7.168,18 0.324,19 4.249,20 4.391,21 3.784,22 3.738,23 5.304,24 3.723,25 4.834,26 5.032,27 4.187,28 4.188,29 5.857,30 4.147,31 5.133,32 5.361,33 4.224,34 4.341,35 6.144,36 4.254,37 5.206,38 5.471,39 4.167,40 4.324,41 6.162,42 4.218,43 5.169,44 5.435,45 4.105,46 4.277,47 6.162,48 4.174,49 5.079,50 5.346,51 4.106,52 4.179,53 6.123,54 4.096,55 4.95,56 5.209,57 4.024,58 4.013,59 6.192,60 3.96,61 4.791,62 5.037,63 3.791,64 3.899,65 5.916,66 3.813,67 0.05,68 1.072,69 13.931,70 5.3}
{0 CHEMBL1967887,2 7.63,3 16.601,4 0.05,5 7.082,6 3.566,7 164.024,8 6.077,9 83.009,11 5.307,12 1.542,13 8.65,14 1.279,15 1.635,16 78.057,17 7.454,18 0.727,19 3.697,20 3.827,21 3.267,22 3.222,23 4.835,24 3.212,25 4.183,26 4.355,27 3.582,28 3.584,29 5.24,30 3.556,31 4.35,32 4.546,33 3.583,34 3.666,35 5.408,36 3.605,37 4.356,38 4.58,39 3.421,40 3.619,41 5.304,42 3.523,43 4.266,44 4.501,45 3.331,46 3.518,47 5.208,48 3.419,49 4.195,50 4.422,51 3.271,52 3.412,53 5.204,54 3.323,55 4.114,56 4.363,57 3.099,58 3.255,59 5.08,60 3.151,61 3.981,62 4.256,63 2.86,64 3.039,65 4.919,66 2.912,67 0.056,68 0.557,69 7.412,70 6.2}
{0 CHEMBL1968127,2 14.469,3 26.514,4 -0.047,5 21.18,6 5.589,7 292.014,8 10.802,9 72.778,11 5.998,12 1.605,13 11.5,14 4.53,15 20.519,16 115.058,17 7.428,18 0.636,19 4.112,20 4.242,21 3.681,22 3.593,23 5.226,24 3.589,25 4.65,26 4.85,27 4.064,28 3.99,29 5.727,30 3.972,31 4.845,32 5.038,33 4.059,34 4.138,35 5.89,36 4.069,37 5.076,38 5.381,39 4.041,40 4.147,41 5.946,42 4.062,43 4.888,44 5.092,45 4.099,46 4.164,47 5.918,48 4.095,49 5.077,50 5.368,51 4.058,52 4.129,53 6.048,54 4.051,55 4.772,56 4.986,57 3.94,58 3.993,59 5.839,60 3.924,61 4.747,62 4.997,63 3.758,64 3.873,65 5.832,66 3.784,67 0.035,68 0.922,69 11.355,70 5.1}
{0 CHEMBL1968151,2 10.18,3 8.759,4 0.016,5 14.401,6 2.259,7 95.772,8 3.25,9 70.021,11 5.879,12 1.843,13 7.158,14 1.504,15 2.261,16 68.741,17 10.358,18 0.727,19 3.466,20 3.559,21 3.372,22 3.104,23 4.72,24 3.103,25 3.925,26 4.035,27 3.776,28 3.484,29 5.224,30 3.474,31 4.035,32 4.179,33 3.699,34 3.459,35 5.335,36 3.445,37 3.978,38 4.137,39 3.691,40 3.301,41 5.336,42 3.327,43 3.779,44 3.968,45 3.356,46 3.116,47 5.049,48 3.103,49 3.491,50 3.62,51 3.067,52 2.961,53 4.791,54 2.934,55 3.508,56 3.642,57 3.053,58 2.969,59 4.801,60 2.892,61 3.463,62 3.67,63 2.741,64 2.737,65 4.662,66 2.553,67 0.101,68 0.472,69 2.08,70 5.1}
{0 CHEMBL1968380,2 41.796,3 47.751,4 -0.029,5 69.22,6 8.292,7 496.821,8 15.746,9 78.966,11 6.218,12 1.525,13 14.237,14 3.655,15 13.36,16 148.213,17 6.776,18 0.286,19 4.432,20 4.57,21 3.921,22 3.892,23 5.424,24 3.869,25 5.038,26 5.248,27 4.303,28 4.321,29 5.967,30 4.272,31 5.327,32 5.562,33 4.434,34 4.515,35 6.261,36 4.439,37 5.431,38 5.678,39 4.445,40 4.554,41 6.405,42 4.474,43 5.442,44 5.683,45 4.457,46 4.572,47 6.485,48 4.487,49 5.406,50 5.644,51 4.35,52 4.546,53 6.381,54 4.44,55 5.411,56 5.686,57 4.183,58 4.452,59 6.3,60 4.321,61 5.263,62 5.539,63 4.107,64 4.326,65 6.139,66 4.205,67 0.032,68 1.179,69 18.11,70 5.7}
{0 CHEMBL1968406,2 24.231,3 26.66,4 0.084,5 29.077,6 4.973,7 225.254,8 11.534,9 102.49,11 5.679,12 1.596,13 12.467,14 4.39,15 19.268,16 122.323,17 8.148,18 0.647,19 4.048,20 4.166,21 3.738,22 3.684,23 5.172,24 3.643,25 4.555,26 4.707,27 4.154,28 4.109,29 5.666,30 4.037,31 4.792,32 4.974,33 4.202,34 4.249,35 5.815,36 4.153,37 4.843,38 5.034,39 4.197,40 4.231,41 5.902,42 4.124,43 4.849,44 5.066,45 4.02,46 4.109,47 5.91,48 4.008,49 4.739,50 4.972,51 3.85,52 3.953,53 5.801,54 3.858,55 4.634,56 4.882,57 3.648,58 3.791,59 5.687,60 3.692,61 4.453,62 4.692,63 3.542,64 3.694,65 5.474,66 3.58,67 0.038,68 0.782,69 9.587,70 5.1}
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{0 CHEMBL1968705,2 29.259,3 40.059,4 0.019,5 41.877,6 8.007,7 389.278,8 13.328,9 106.043,11 6.117,12 1.509,13 14.2,14 5.568,15 31.003,16 154.244,17 7.338,18 0.6,19 4.394,20 4.522,21 3.958,22 3.932,23 5.454,24 3.914,25 4.938,26 5.116,27 4.308,28 4.328,29 5.961,30 4.286,31 5.19,32 5.416,33 4.311,34 4.426,35 6.156,36 4.351,37 5.178,38 5.421,39 4.281,40 4.373,41 6.152,42 4.298,43 5.124,44 5.346,45 4.292,46 4.357,47 6.161,48 4.294,49 5.087,50 5.296,51 4.314,52 4.422,53 6.074,54 4.358,55 5.138,56 5.334,57 4.384,58 4.506,59 6.179,60 4.429,61 5.234,62 5.457,63 4.355,64 4.514,65 6.183,66 4.425,67 0.063,68 1.129,69 15.222,70 5.5}
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{0 CHEMBL1969049,2 15.446,3 21.85,4 0.012,5 19.526,6 5.573,7 283.338,8 10.324,9 34.796,11 5.935,12 1.414,13 11.538,14 3.837,15 14.72,16 103.05,17 7.218,18 0.643,19 3.941,20 4.055,21 3.482,22 3.529,23 5.067,24 3.494,25 4.438,26 4.606,27 3.798,28 3.886,29 5.51,30 3.832,31 4.644,32 4.823,33 3.876,34 4.042,35 5.696,36 3.964,37 4.763,38 4.966,39 3.823,40 4.06,41 5.809,42 3.954,43 4.823,44 5.056,45 3.761,46 4.026,47 5.847,48 3.902,49 4.754,50 4.999,51 3.583,52 3.894,53 5.745,54 3.762,55 4.586,56 4.853,57 3.486,58 3.729,59 5.599,60 3.604,61 4.415,62 4.657,63 3.389,64 3.608,65 5.443,66 3.497,67 0.027,68 0.635,69 9.745,70 5.1}
{0 CHEMBL1969126,2 9.58,3 18.055,4 -0.022,5 6.987,6 3.813,7 186.074,8 7.308,9 53.052,11 6.284,12 1.737,13 9.25,14 5.24,15 27.458,16 100.768,17 8.823,18 0.781,19 3.925,20 4.03,21 3.641,22 3.467,23 5.161,24 3.493,25 4.438,26 4.583,27 4.061,28 3.865,29 5.673,30 3.891,31 4.629,32 4.813,33 4.079,34 3.949,35 5.859,36 3.96,37 4.681,38 4.883,39 4.082,40 3.962,41 6.029,42 3.96,43 4.621,44 4.793,45 4.027,46 3.979,47 5.796,48 3.962,49 4.661,50 4.834,51 4.062,52 3.958,53 5.925,54 3.942,55 4.655,56 4.856,57 3.969,58 3.85,59 5.887,60 3.836,61 4.522,62 4.747,63 3.805,64 3.649,65 5.803,66 3.64,67 0.151,68 0.829,69 5.913,70 5.1}
{0 CHEMBL1969190,2 22.454,3 17.169,4 0.07,5 30.042,6 5.464,7 187.132,8 8.37,9 88.515,11 5.72,12 1.806,13 12.6,14 3.882,15 15.072,16 107.307,17 8.922,18 0.667,19 3.978,20 4.077,21 3.675,22 3.497,23 5.297,24 3.532,25 4.434,26 4.553,27 4.049,28 3.861,29 5.798,30 3.889,31 4.65,32 4.798,33 4.103,34 3.961,35 5.979,36 3.979,37 4.705,38 4.87,39 4.127,40 3.948,41 6.153,42 3.954,43 4.715,44 4.902,45 3.935,46 3.887,47 6.015,48 3.873,49 4.64,50 4.846,51 3.849,52 3.762,53 6.096,54 3.733,55 4.423,56 4.632,57 3.568,58 3.606,59 5.589,60 3.564,61 4.339,62 4.556,63 3.58,64 3.53,65 5.567,66 3.489,67 0.242,68 0.816,69 6.412,70 5.1}
{0 CHEMBL1969301,2 23.435,3 37.685,4 -0.004,5 26.047,6 7.652,7 403.423,8 12.769,9 70.879,11 6.08,12 1.475,13 12.941,14 5.538,15 30.671,16 131.385,17 7.04,18 0.432,19 4.245,20 4.375,21 3.764,22 3.794,23 5.313,24 3.758,25 4.814,26 5.007,27 4.119,28 4.203,29 5.798,30 4.135,31 5.117,32 5.353,33 4.223,34 4.347,35 6.107,36 4.263,37 5.173,38 5.411,39 4.207,40 4.321,41 6.27,42 4.242,43 5.111,44 5.346,45 4.188,46 4.287,47 6.2,48 4.215,49 5.105,50 5.337,51 4.152,52 4.322,53 6.215,54 4.227,55 5.105,56 5.346,57 4.09,58 4.319,59 6.074,60 4.208,61 5.056,62 5.301,63 4.026,64 4.279,65 6.027,66 4.156,67 0.031,68 0.961,69 13.892,70 5.1}
{0 CHEMBL1969372,2 11,3 18.794,4 -0.043,5 14.194,6 4.946,7 199.338,8 6.596,9 86.439,10 1,11 5.787,12 1.693,13 10.519,14 2.793,15 7.799,16 99.839,17 8.282,18 0.733,19 3.919,20 4.036,21 3.579,22 3.424,23 5.119,24 3.445,25 4.416,26 4.583,27 3.911,28 3.771,29 5.607,30 3.782,31 4.566,32 4.766,33 3.944,34 3.874,35 5.722,36 3.859,37 4.577,38 4.784,39 3.917,40 3.873,41 5.679,42 3.85,43 4.577,44 4.782,45 3.956,46 3.916,47 5.682,48 3.891,49 4.624,50 4.815,51 3.987,52 3.954,53 5.802,54 3.918,55 4.67,56 4.899,57 3.832,58 3.86,59 5.77,60 3.804,61 4.539,62 4.788,63 3.602,64 3.635,65 5.673,66 3.564,67 0.085,68 0.778,69 7.245,70 5.1}
{0 CHEMBL1969502,1 1,2 17.303,3 19.371,4 0.086,5 18.934,6 3.437,7 203.314,8 8.365,9 69.348,11 5.795,12 1.572,13 10.385,14 2.309,15 5.332,16 97.898,17 8.2,18 0.533,19 3.881,20 3.993,21 3.538,22 3.488,23 5.041,24 3.484,25 4.366,26 4.5,27 3.878,28 3.879,29 5.52,30 3.849,31 4.646,32 4.821,33 3.998,34 4.013,35 5.801,36 3.975,37 4.675,38 4.872,39 3.899,40 3.936,41 5.829,42 3.885,43 4.588,44 4.804,45 3.747,46 3.757,47 5.79,48 3.701,49 4.436,50 4.661,51 3.504,52 3.565,53 5.614,54 3.505,55 4.26,56 4.469,57 3.497,58 3.483,59 5.576,60 3.444,61 4.155,62 4.328,63 3.408,64 3.489,65 5.342,66 3.436,67 0.076,68 0.645,69 7.018,70 5.1}
{0 CHEMBL1969506,2 27.998,3 27.982,4 0.046,5 40.052,6 6.383,7 354.399,8 11.94,9 85.753,11 6.713,12 1.803,13 14.743,14 1.885,15 3.553,16 132.181,17 8.579,18 0.421,19 4.183,20 4.28,21 3.972,22 3.723,23 5.371,24 3.715,25 4.694,26 4.829,27 4.287,28 4.072,29 6.134,30 4.069,31 4.931,32 5.078,33 4.284,34 4.193,35 6.299,36 4.156,37 5.039,38 5.266,39 4.21,40 4.144,41 6.276,42 4.098,43 4.899,44 5.091,45 4.088,46 4.024,47 6.209,48 4.013,49 4.758,50 4.926,51 4.1,52 4.054,53 6.015,54 4.028,55 4.809,56 4.967,57 4.056,58 4.063,59 6.149,60 4.005,61 4.829,62 5.057,63 3.937,64 3.941,65 6.042,66 3.86,67 0.22,68 0.907,69 12.126,70 5.1}
{0 CHEMBL1969537,2 8.037,3 12.025,4 -0.071,5 4.228,6 2.279,7 92.263,8 6.54,9 69.225,11 6.417,12 1.867,13 5.95,14 3.276,15 10.734,16 85.857,17 11.445,18 0.75,19 3.563,20 3.648,21 3.556,22 3.264,23 4.718,24 3.206,25 4.086,26 4.205,27 4.079,28 3.703,29 5.202,30 3.656,31 4.231,32 4.382,33 4.133,34 3.828,35 5.292,36 3.71,37 4.195,38 4.323,39 4.22,40 3.765,41 5.359,42 3.666,43 4.033,44 4.171,45 3.997,46 3.623,47 5.235,48 3.524,49 3.938,50 4.116,51 3.826,52 3.478,53 5.042,54 3.258,55 3.744,56 3.964,57 2.757,58 3.032,59 4.733,60 2.698,61 3.02,62 3.323,63 1.112,64 2.063,65 3.78,66 1.6,67 0.103,68 0.554,69 3.762,70 5.1}
{0 CHEMBL1969561,2 16.518,3 23.416,4 -0.007,5 25.201,6 4.971,7 272.338,8 9.423,9 71.43,11 6.085,12 1.527,13 9.214,14 3.618,15 13.093,16 111.315,17 7.49,18 0.677,19 4.017,20 4.15,21 3.6,22 3.551,23 5.146,24 3.533,25 4.53,26 4.718,27 3.954,28 3.935,29 5.57,30 3.905,31 4.73,32 4.93,33 3.995,34 4.059,35 5.778,36 3.998,37 4.886,38 5.117,39 4.022,40 4.047,41 6.015,42 3.985,43 4.824,44 5.066,45 3.995,46 3.98,47 5.908,48 3.947,49 4.738,50 4.932,51 4.048,52 4.03,53 5.896,54 4.007,55 4.855,56 5.076,57 3.96,58 4.099,59 5.933,60 4.02,61 4.85,62 5.084,63 3.808,64 4.108,65 5.851,66 3.972,67 0.086,68 0.802,69 10.034,70 5.1}
{0 CHEMBL1969588,1 1,2 11.313,3 17.524,4 0.038,5 17.755,6 4.095,7 192.173,8 6.861,9 68.367,11 5.413,12 1.508,13 10.042,14 4.205,15 17.682,16 98.906,17 8.585,18 0.815,19 3.784,20 3.898,21 3.483,22 3.423,23 4.923,24 3.4,25 4.255,26 4.399,27 3.851,28 3.802,29 5.39,30 3.758,31 4.468,32 4.663,33 3.823,34 3.882,35 5.473,36 3.798,37 4.455,38 4.668,39 3.78,40 3.814,41 5.449,42 3.718,43 4.431,44 4.655,45 3.725,46 3.76,47 5.412,48 3.653,49 4.341,50 4.553,51 3.78,52 3.685,53 5.423,54 3.596,55 4.21,56 4.414,57 3.66,58 3.592,59 5.314,60 3.492,61 4.101,62 4.309,63 3.426,64 3.484,65 5.116,66 3.357,67 0.021,68 0.569,69 6.04,70 6}
{0 CHEMBL1969664,1 1,2 16.484,3 21.365,4 0.024,5 18.276,6 4.31,7 242.021,8 9.001,9 67.755,11 5.573,12 1.571,13 10.76,14 2.417,15 5.842,16 94.054,17 7.777,18 0.571,19 3.885,20 3.994,21 3.493,22 3.43,23 5.037,24 3.428,25 4.417,26 4.576,27 3.837,28 3.831,29 5.476,30 3.809,31 4.651,32 4.842,33 3.874,34 3.972,35 5.69,36 3.909,37 4.712,38 4.954,39 3.794,40 3.937,41 5.746,42 3.843,43 4.611,44 4.841,45 3.723,46 3.819,47 5.696,48 3.75,49 4.485,50 4.707,51 3.562,52 3.698,53 5.602,54 3.614,55 4.343,56 4.599,57 3.333,58 3.476,59 5.486,60 3.374,61 4.006,62 4.219,63 3.115,64 3.238,65 5.091,66 3.157,67 0.049,68 0.644,69 8.155,70 5.1}
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{0 CHEMBL1969879,1 1,2 16.238,3 24.888,4 -0.035,5 21.865,6 4.317,7 291.479,8 8.679,9 56.605,11 5.956,12 1.602,13 7.955,14 0.854,15 0.73,16 84.36,17 7.056,18 0.417,19 3.867,20 4.005,21 3.383,22 3.298,23 4.937,24 3.293,25 4.441,26 4.649,27 3.746,28 3.718,29 5.431,30 3.685,31 4.699,32 4.922,33 3.846,34 3.904,35 5.735,36 3.834,37 4.854,38 5.104,39 3.792,40 3.973,41 5.772,42 3.871,43 4.915,44 5.19,45 3.686,46 3.964,47 5.799,48 3.83,49 4.83,50 5.108,51 3.618,52 3.867,53 5.743,54 3.737,55 4.683,56 4.947,57 3.469,58 3.681,59 5.728,60 3.56,61 4.484,62 4.783,63 3.083,64 3.343,65 5.51,66 3.206,67 0.051,68 0.668,69 9.793,70 5.1}
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{0 CHEMBL1970709,2 13.592,3 20.35,4 0.059,5 17.987,6 4.223,7 142.856,8 6.494,9 115.302,11 5.38,12 1.714,13 10.238,14 2.922,15 8.538,16 84.964,17 10.154,18 0.696,19 3.651,20 3.771,21 3.481,22 3.252,23 4.828,24 3.233,25 4.111,26 4.255,27 3.879,28 3.635,29 5.309,30 3.582,31 4.324,32 4.51,33 3.833,34 3.695,35 5.408,36 3.593,37 4.322,38 4.558,39 3.55,40 3.495,41 5.394,42 3.388,43 4.116,44 4.361,45 3.43,46 3.253,47 5.261,48 3.186,49 3.964,50 4.157,51 3.445,52 3.183,53 5.219,54 3.132,55 3.889,56 4.093,57 3.347,58 3.159,59 5.148,60 3.079,61 3.743,62 3.935,63 3.491,64 3.144,65 4.84,66 3.046,67 0.078,68 0.526,69 3.619,70 5.1}
{0 CHEMBL1970735,2 15.702,3 14.607,4 -0.011,5 22.096,6 4.739,7 165.627,8 3.953,9 98.753,11 5.065,12 1.685,13 7.059,14 0.866,15 0.751,16 63.784,17 7.558,18 0.353,19 3.514,20 3.646,21 3.055,22 2.945,23 4.781,24 2.954,25 3.988,26 4.178,27 3.348,28 3.227,29 5.199,30 3.213,31 4.168,32 4.375,33 3.405,34 3.282,35 5.422,36 3.289,37 4.133,38 4.347,39 3.438,40 3.246,41 5.586,42 3.237,43 4.036,44 4.228,45 3.192,46 3.21,47 5.303,48 3.186,49 4.04,50 4.257,51 3.134,52 3.19,53 5.394,54 3.116,55 4.048,56 4.3,57 2.759,58 3.053,59 5.267,60 2.931,61 3.867,62 4.174,63 2.271,64 2.731,65 5.14,66 2.537,67 0.074,68 0.45,69 6.178,70 5.1}
{0 CHEMBL1970806,2 15.889,3 20.982,4 0.032,5 20.315,6 2.89,7 166.398,8 7.474,9 70.021,11 6.034,12 1.733,13 8.391,14 2.887,15 8.333,16 86.049,17 8.984,18 0.593,19 3.753,20 3.858,21 3.545,22 3.387,23 4.864,24 3.362,25 4.298,26 4.442,27 3.993,28 3.832,29 5.409,30 3.781,31 4.507,32 4.692,33 4.014,34 3.92,35 5.58,36 3.835,37 4.468,38 4.656,39 4,40 3.807,41 5.599,42 3.742,43 4.269,44 4.458,45 3.747,46 3.603,47 5.351,48 3.568,49 4.22,50 4.419,51 3.571,52 3.521,53 5.33,54 3.489,55 4.199,56 4.389,57 3.475,58 3.444,59 5.447,60 3.377,61 3.901,62 4.074,63 3.163,64 3.243,65 5.019,66 3.117,67 0.067,68 0.611,69 5.415,70 5.1}
{0 CHEMBL1970903,1 1,2 11.017,3 25.659,4 0.07,5 9.41,6 4.991,7 234.651,8 11.001,9 99.794,11 6.117,12 1.47,13 12.733,14 3.506,15 12.29,16 118.181,17 7.5,18 0.765,19 4.084,20 4.209,21 3.668,22 3.66,23 5.193,24 3.641,25 4.588,26 4.746,27 4.023,28 4.064,29 5.621,30 4.026,31 4.818,32 5.012,33 4.032,34 4.171,35 5.83,36 4.093,37 4.904,38 5.142,39 3.899,40 4.137,41 5.807,42 4.026,43 4.807,44 5.047,45 3.828,46 4.036,47 5.733,48 3.926,49 4.781,50 5.017,51 3.797,52 3.965,53 5.756,54 3.866,55 4.723,56 4.979,57 3.697,58 3.872,59 5.66,60 3.768,61 4.578,62 4.823,63 3.616,64 3.777,65 5.528,66 3.676,67 0.074,68 0.805,69 10.661,70 7}
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{0 CHEMBL1977713,2 13.55,3 16.41,4 0.061,5 17.952,6 4.084,7 182.005,8 5.797,9 69.348,11 5.318,12 1.714,13 9.667,14 2.838,15 8.054,16 82.146,17 8.846,18 0.696,19 3.653,20 3.773,21 3.36,22 3.233,23 4.847,24 3.225,25 4.114,26 4.258,27 3.712,28 3.608,29 5.332,30 3.571,31 4.329,32 4.515,33 3.668,34 3.664,35 5.439,36 3.59,37 4.333,38 4.56,39 3.497,40 3.499,41 5.452,42 3.422,43 4.185,44 4.431,45 3.352,46 3.285,47 5.346,48 3.236,49 4.022,50 4.214,51 3.347,52 3.164,53 5.414,54 3.137,55 3.878,56 4.086,57 3.058,58 3.151,59 4.974,60 3.064,61 3.786,62 3.998,63 3.195,64 3.153,65 4.93,66 3.065,67 0.086,68 0.527,69 5.137,70 5.1}
{0 CHEMBL1978014,2 25.777,3 29.855,4 0.013,5 38.364,6 5.305,7 295.88,8 10.858,9 89.441,11 6.099,12 1.525,13 13.484,14 3.596,15 12.929,16 124.203,17 7.421,18 0.6,19 4.14,20 4.277,21 3.719,22 3.666,23 5.232,24 3.65,25 4.683,26 4.869,27 4.086,28 4.087,29 5.69,30 4.05,31 4.94,32 5.155,33 4.115,34 4.223,35 5.947,36 4.146,37 5.05,38 5.306,39 4.063,40 4.17,41 6.046,42 4.089,43 4.909,44 5.161,45 4.017,46 4.053,47 6.003,48 3.995,49 4.767,50 4.981,51 3.952,52 4.021,53 5.859,54 3.957,55 4.765,56 5.005,57 3.82,58 3.965,59 5.781,60 3.871,61 4.687,62 4.949,63 3.65,64 3.881,65 5.628,66 3.762,67 0.096,68 0.917,69 11.616,70 5.1}
{0 CHEMBL1978099,2 30.639,3 24.45,4 0.039,5 45.182,6 7.38,7 268.795,8 9.911,9 118.895,11 5.606,12 1.913,13 14.094,14 2.988,15 8.93,16 117.971,17 8.689,18 0.529,19 4.09,20 4.198,21 3.891,22 3.594,23 5.307,24 3.594,25 4.582,26 4.728,27 4.162,28 3.922,29 6.06,30 3.92,31 4.787,32 4.949,33 4.22,34 4.036,35 6.182,36 4.013,37 4.822,38 5.006,39 4.112,40 4.02,41 6.085,42 3.971,43 4.863,44 5.089,45 4.055,46 3.958,47 6.167,48 3.919,49 4.705,50 4.91,51 4.002,52 3.863,53 5.996,54 3.847,55 4.635,56 4.843,57 3.973,58 3.799,59 6.012,60 3.766,61 4.573,62 4.797,63 3.871,64 3.72,65 5.856,66 3.681,67 0.227,68 0.907,69 11.206,70 5.1}
{0 CHEMBL1978200,2 16.821,3 26.658,4 -0.003,5 21.151,6 5.593,7 278.105,8 9.644,9 86.439,10 1,11 6.36,12 1.695,13 10.839,14 3.517,15 12.37,16 113.817,17 8.009,18 0.647,19 4.086,20 4.208,21 3.703,22 3.59,23 5.285,24 3.598,25 4.605,26 4.783,27 4.113,28 3.966,29 5.828,30 3.971,31 4.86,32 5.053,33 4.156,34 4.096,35 6.086,36 4.08,37 4.944,38 5.192,39 4.165,40 4.097,41 6.184,42 4.061,43 4.835,44 5.06,45 4.127,46 4.097,47 5.944,48 4.066,49 4.825,50 5.02,51 4.243,52 4.125,53 6.123,54 4.107,55 4.904,56 5.117,57 4.156,58 4.103,59 6.18,60 4.079,61 4.869,62 5.107,63 3.911,64 3.976,65 6.095,66 3.895,67 0.118,68 0.969,69 9.554,70 5.1}
{0 CHEMBL1978448,1 1,2 23.193,3 24.573,4 0.015,5 34.46,6 3.288,7 257.796,8 9.514,9 21.428,11 5.964,12 1.747,13 8.13,14 2.09,15 4.37,16 86.96,17 8.286,18 0.423,19 3.824,20 3.921,21 3.659,22 3.412,23 4.849,24 3.375,25 4.378,26 4.528,27 3.912,28 3.771,29 5.677,30 3.725,31 4.599,32 4.779,33 3.965,34 3.915,35 5.73,36 3.846,37 4.671,38 4.841,39 3.941,40 3.958,41 5.86,42 3.88,43 4.711,44 4.941,45 3.705,46 3.875,47 5.819,48 3.745,49 4.501,50 4.73,51 3.548,52 3.678,53 5.548,54 3.546,55 4.358,56 4.612,57 3.494,58 3.475,59 5.313,60 3.34,61 4.159,62 4.371,63 3.531,64 3.386,65 5.358,66 3.3,67 0.097,68 0.644,69 9.976,70 5.8}
{0 CHEMBL1978645,1 1,2 26.75,3 35.509,4 0.045,5 36.362,6 7.603,7 431.961,8 16.594,9 19.91,11 6.505,12 1.356,13 13.293,14 8.869,15 78.661,16 164.25,17 7.407,18 0.717,19 4.378,20 4.483,21 3.949,22 4.003,23 5.487,24 3.969,25 4.886,26 5.032,27 4.316,28 4.399,29 5.988,30 4.347,31 5.146,32 5.327,33 4.429,34 4.559,35 6.143,36 4.487,37 5.257,38 5.448,39 4.459,40 4.607,41 6.27,42 4.525,43 5.317,44 5.512,45 4.473,46 4.645,47 6.333,48 4.561,49 5.387,50 5.588,51 4.523,52 4.667,53 6.452,54 4.588,55 5.427,56 5.641,57 4.458,58 4.656,59 6.505,60 4.559,61 5.376,62 5.597,63 4.404,64 4.633,65 6.385,66 4.527,67 0.056,68 0.922,69 14.384,70 5.2}
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{0 CHEMBL1979093,2 21.901,3 19.317,4 0.061,5 28.768,6 5.507,7 222.445,8 9.514,9 88.515,11 5.958,12 1.705,13 13.2,14 4.163,15 17.331,16 112.132,17 8.295,18 0.667,19 4.021,20 4.128,21 3.667,22 3.551,23 5.277,24 3.565,25 4.487,26 4.623,27 4.034,28 3.921,29 5.739,30 3.923,31 4.687,32 4.837,33 4.113,34 4.037,35 5.957,36 4.029,37 4.797,38 4.98,39 4.056,40 4.031,41 6.025,42 4.004,43 4.772,44 4.974,45 3.933,46 3.957,47 5.986,48 3.91,49 4.703,50 4.928,51 3.776,52 3.824,53 5.852,54 3.772,55 4.497,56 4.707,57 3.626,58 3.663,59 5.793,60 3.611,61 4.397,62 4.627,63 3.515,64 3.614,65 5.468,66 3.532,67 0.168,68 0.783,69 8.236,70 5.1}
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{0 CHEMBL1980142,2 20.633,3 9.79,4 0.029,5 28.555,6 5.077,7 119.314,8 6.648,9 69.593,11 6.47,12 1.926,13 10.571,14 4.411,15 19.455,16 86.145,17 10.534,18 0.567,19 3.808,20 3.904,21 3.612,22 3.292,23 5.196,24 3.373,25 4.352,26 4.468,27 4.152,28 3.637,29 6.492,30 3.729,31 4.483,32 4.642,33 4.082,34 3.731,35 6.052,36 3.804,37 4.564,38 4.735,39 4.117,40 3.666,41 6.246,42 3.773,43 4.525,44 4.696,45 4.029,46 3.545,47 6.224,48 3.669,49 4.44,50 4.641,51 3.784,52 3.36,53 6.098,54 3.465,55 4.214,56 4.392,57 3.705,58 3.248,59 6.123,60 3.342,61 4.07,62 4.228,63 3.648,64 3.254,65 6.008,66 3.317,67 0.469,68 1.081,69 2.325,70 5.1}
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{0 CHEMBL1980391,2 22.242,3 15.259,4 0.034,5 35.694,6 3.981,7 191.402,8 7.008,9 68.122,11 6.189,12 1.789,13 7.72,14 4.496,15 20.214,16 94.81,17 9.149,18 0.607,19 3.81,20 3.915,21 3.549,22 3.389,23 5.029,24 3.396,25 4.297,26 4.436,27 3.953,28 3.77,29 5.497,30 3.773,31 4.511,32 4.657,33 4.147,34 3.932,35 5.814,36 3.927,37 4.577,38 4.746,39 4.082,40 3.947,41 5.787,42 3.918,43 4.591,44 4.77,45 4.086,46 3.968,47 5.82,48 3.933,49 4.613,50 4.784,51 4.158,52 3.967,53 5.842,54 3.927,55 4.578,56 4.765,57 4.037,58 3.794,59 5.907,60 3.738,61 4.435,62 4.692,63 3.323,64 3.39,65 5.608,66 3.267,67 0.118,68 0.654,69 5.182,70 5.1}
{0 CHEMBL1980489,2 17.245,3 15.078,4 0.042,5 26.297,6 4.117,7 207.15,8 5.836,9 52.807,11 5.403,12 1.741,13 10,14 1.362,15 1.856,16 86.478,17 9.228,18 0.5,19 3.65,20 3.75,21 3.39,22 3.265,23 4.891,24 3.262,25 4.084,26 4.214,27 3.709,28 3.573,29 5.336,30 3.555,31 4.302,32 4.475,33 3.722,34 3.63,35 5.66,36 3.57,37 4.274,38 4.484,39 3.476,40 3.517,41 5.421,42 3.431,43 4.186,44 4.389,45 3.491,46 3.45,47 5.388,48 3.412,49 4.107,50 4.249,51 3.568,52 3.409,53 5.526,54 3.405,55 4.067,56 4.213,57 3.44,58 3.3,59 5.55,60 3.291,61 3.94,62 4.129,63 3.258,64 3.162,65 5.294,66 3.107,67 0.08,68 0.487,69 4.255,70 5.1}
{0 CHEMBL1980540,2 17.779,3 12.002,4 0.029,5 25.042,6 4.687,7 158.462,8 5.882,9 69.593,11 5.7,12 1.987,13 9.76,14 4.133,15 17.081,16 84.976,17 10.479,18 0.63,19 3.712,20 3.809,21 3.533,22 3.265,23 5.045,24 3.307,25 4.211,26 4.327,27 4.011,28 3.616,29 6.083,30 3.654,31 4.392,32 4.555,33 4.027,34 3.702,35 5.883,36 3.721,37 4.371,38 4.539,39 3.951,40 3.612,41 5.86,42 3.636,43 4.333,44 4.507,45 3.831,46 3.465,47 5.896,48 3.5,49 4.218,50 4.411,51 3.561,52 3.293,53 5.702,54 3.321,55 4.02,56 4.18,57 3.688,58 3.191,59 5.98,60 3.237,61 3.876,62 4.049,63 3.355,64 3.226,65 5.227,66 3.212,67 0.267,68 0.756,69 2.391,70 5.1}
{0 CHEMBL1980704,2 7.704,3 17.344,4 -0.006,5 5.981,6 3.42,7 176.567,8 7.853,9 52.685,11 6.144,12 1.549,13 9.68,14 4.693,15 22.024,16 101.199,17 8.636,18 0.862,19 3.834,20 3.942,21 3.601,22 3.486,23 4.953,24 3.449,25 4.33,26 4.474,27 4,28 3.88,29 5.393,30 3.832,31 4.49,32 4.665,33 4.042,34 3.988,35 5.5,36 3.904,37 4.54,38 4.744,39 3.955,40 3.956,41 5.497,42 3.842,43 4.441,44 4.652,45 3.805,46 3.831,47 5.419,48 3.687,49 4.336,50 4.568,51 3.635,52 3.668,53 5.269,54 3.506,55 4.08,56 4.295,57 3.365,58 3.44,59 5.017,60 3.338,61 3.971,62 4.162,63 3.369,64 3.367,65 5.027,66 3.334,67 0.026,68 0.637,69 6.491,70 5.1}
{0 CHEMBL1980896,2 16.823,3 12.035,4 0.074,5 19.516,6 5.624,7 193.776,8 8.972,9 130.433,11 5.623,12 1.875,13 11.893,14 4.335,15 18.795,16 118.155,17 11.281,18 0.71,19 3.864,20 3.956,21 3.821,22 3.583,23 5.077,24 3.534,25 4.323,26 4.433,27 4.402,28 3.999,29 5.545,30 3.914,31 4.545,32 4.688,33 4.349,34 4.089,35 5.716,36 3.992,37 4.585,38 4.756,39 4.443,40 4.066,41 5.77,42 3.952,43 4.563,44 4.724,45 4.403,46 4,47 5.797,48 3.862,49 4.397,50 4.576,51 3.934,52 3.759,53 5.65,54 3.644,55 4.215,56 4.422,57 3.692,58 3.575,59 5.284,60 3.475,61 4.125,62 4.321,63 3.687,64 3.565,65 5.204,66 3.428,67 0.079,68 0.581,69 2.024,70 5.4}
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{0 CHEMBL1982506,2 12.785,3 8.24,4 -0.01,5 12.791,6 2.644,7 178.23,8 4.842,9 34.796,11 5.859,12 1.709,13 6.947,14 0.81,15 0.656,16 65.167,17 8.905,18 0.524,19 3.531,20 3.607,21 3.239,22 3.039,23 4.814,24 3.086,25 4.032,26 4.149,27 3.62,28 3.409,29 5.329,30 3.458,31 4.115,32 4.191,33 3.743,34 3.516,35 5.542,36 3.565,37 4.182,38 4.294,39 3.664,40 3.486,41 5.663,42 3.509,43 4.239,44 4.411,45 3.41,46 3.334,47 5.479,48 3.328,49 4.008,50 4.191,51 3.164,52 3.055,53 5.308,54 3.03,55 3.826,56 4.063,57 2.846,58 2.746,59 5.126,60 2.694,61 3.441,62 3.659,63 2.252,64 2.313,65 4.811,66 2.25,67 0.138,68 0.415,69 3.9,70 5.1}
{0 CHEMBL1982563,2 15.194,3 26.399,4 -0.033,5 18.663,6 5.883,7 293.506,8 10.667,9 86.439,10 1,11 6.206,12 1.599,13 11.484,14 3.989,15 15.915,16 118.055,17 7.51,18 0.647,19 4.125,20 4.253,21 3.702,22 3.63,23 5.255,24 3.623,25 4.657,26 4.847,27 4.074,28 4.01,29 5.743,30 3.993,31 4.855,32 5.045,33 4.147,34 4.165,35 5.95,36 4.117,37 5.072,38 5.344,39 4.106,40 4.186,41 6.021,42 4.12,43 4.882,44 5.09,45 4.123,46 4.2,47 5.893,48 4.133,49 5.006,50 5.258,51 4.172,52 4.216,53 6.073,54 4.153,55 4.907,56 5.118,57 4.065,58 4.181,59 5.968,60 4.1,61 4.932,62 5.192,63 3.883,64 4.035,65 5.956,66 3.928,67 0.034,68 0.932,69 11.212,70 5.1}
{0 CHEMBL1982610,2 10.269,3 27.044,4 0.003,5 10.828,6 3.067,7 134.92,8 5.342,9 36.695,11 5.491,12 1.947,13 6.611,14 2.692,15 7.248,16 76.921,17 14.863,18 0.55,19 3.383,20 3.47,21 3.544,22 3.119,23 4.615,24 3.067,25 3.845,26 3.951,27 4.044,28 3.547,29 5.142,30 3.456,31 4.04,32 4.175,33 4.28,34 3.606,35 5.32,36 3.496,37 3.931,38 4.082,39 4.125,40 3.54,41 5.256,42 3.357,43 3.677,44 3.844,45 3.88,46 3.233,47 4.899,48 3.081,49 3.482,50 3.613,51 3.759,52 3.159,53 4.761,54 2.995,55 3.452,56 3.593,57 3.691,58 3.121,59 4.741,60 2.864,61 3.204,62 3.366,63 4.066,64 2.849,65 4.723,66 2.518,67 0.073,68 0.364,69 5.054,70 5.1}
{0 CHEMBL1982660,2 20.491,3 13.157,4 0.002,5 29.053,6 4.962,7 165.627,8 6.469,9 69.593,11 5.55,12 1.892,13 10.962,14 3.452,15 11.917,16 86.634,17 9.291,18 0.607,19 3.81,20 3.912,21 3.532,22 3.295,23 5.119,24 3.348,25 4.317,26 4.449,27 3.976,28 3.626,29 6.119,30 3.68,31 4.452,32 4.615,33 3.946,34 3.72,35 5.893,36 3.755,37 4.483,38 4.659,39 3.884,40 3.672,41 5.909,42 3.695,43 4.496,44 4.704,45 3.8,46 3.562,47 5.941,48 3.587,49 4.369,50 4.577,51 3.617,52 3.396,53 5.793,54 3.432,55 4.17,56 4.334,57 3.612,58 3.325,59 5.979,60 3.351,61 4.098,62 4.298,63 3.414,64 3.337,65 5.422,66 3.317,67 0.258,68 0.806,69 4.617,70 5.1}
{0 CHEMBL1982711,1 1,2 4.426,3 11.299,4 0.099,5 2.992,6 2.913,7 146.691,8 4.806,9 66.468,11 5.785,12 1.71,13 7.842,14 2.217,15 4.916,16 73.462,17 9.37,18 0.762,19 3.504,20 3.609,21 3.258,22 3.144,23 4.76,24 3.137,25 3.945,26 4.062,27 3.651,28 3.539,29 5.25,30 3.511,31 4.157,32 4.304,33 3.723,34 3.634,35 5.394,36 3.581,37 4.15,38 4.305,39 3.7,40 3.563,41 5.44,42 3.496,43 4.105,44 4.322,45 3.306,46 3.388,47 5.201,48 3.27,49 3.854,50 4.088,51 3.137,52 3.146,53 4.907,54 3.033,55 3.526,56 3.713,57 2.891,58 2.846,59 4.746,60 2.77,61 3.353,62 3.544,63 2.779,64 2.525,65 4.765,66 2.502,67 0.067,68 0.422,69 3.578,70 6.5}
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{0 CHEMBL1982924,1 1,2 11.833,3 17.481,4 0.034,5 15.343,6 4.422,7 212.711,8 7.596,9 51.582,11 5.763,12 1.508,13 10.808,14 3.319,15 11.016,16 99.795,17 7.986,18 0.759,19 3.876,20 3.982,21 3.51,22 3.475,23 5.059,24 3.467,25 4.345,26 4.479,27 3.846,28 3.845,29 5.508,30 3.82,31 4.537,32 4.705,33 3.879,34 3.932,35 5.672,36 3.884,37 4.569,38 4.759,39 3.802,40 3.881,41 5.703,42 3.824,43 4.559,44 4.765,45 3.764,46 3.818,47 5.742,48 3.752,49 4.452,50 4.661,51 3.629,52 3.734,53 5.543,54 3.666,55 4.399,56 4.625,57 3.536,58 3.613,59 5.529,60 3.552,61 4.219,62 4.422,63 3.404,64 3.501,65 5.331,66 3.437,67 0.029,68 0.599,69 7.426,70 5.8}
{0 CHEMBL1982957,1 1,2 2.824,3 15.696,4 0.089,5 2.351,6 3.544,7 166.398,8 7.153,9 66.468,11 5.854,12 1.444,13 9.333,14 3.071,15 9.433,16 93.793,17 8.035,18 0.815,19 3.777,20 3.888,21 3.417,22 3.43,23 4.978,24 3.41,25 4.228,26 4.355,27 3.772,28 3.824,29 5.44,30 3.783,31 4.462,32 4.631,33 3.801,34 3.924,35 5.588,36 3.857,37 4.487,38 4.678,39 3.715,40 3.878,41 5.591,42 3.798,43 4.478,44 4.698,45 3.657,46 3.81,47 5.527,48 3.726,49 4.368,50 4.578,51 3.571,52 3.702,53 5.468,54 3.626,55 4.27,56 4.485,57 3.41,58 3.568,59 5.418,60 3.483,61 4.108,62 4.337,63 3.215,64 3.422,65 5.127,66 3.321,67 0.031,68 0.537,69 6.539,70 6.4}
{0 CHEMBL1982980,1 1,2 16.577,3 30.98,4 0.038,5 14.81,6 6.936,7 404.319,8 12.133,9 16.786,11 6.335,12 1.569,13 11.172,14 7.539,15 56.843,16 117.745,17 8.315,18 0.516,19 4.03,20 4.129,21 3.677,22 3.636,23 5.163,24 3.597,25 4.546,26 4.698,27 4.079,28 4.025,29 5.698,30 3.964,31 4.768,32 4.924,33 4.328,34 4.189,35 5.907,36 4.108,37 4.904,38 5.089,39 4.16,40 4.218,41 5.958,42 4.118,43 4.985,44 5.213,45 4.001,46 4.206,47 5.956,48 4.075,49 4.964,50 5.185,51 3.952,52 4.13,53 6.019,54 4.004,55 4.866,56 5.097,57 3.793,58 3.983,59 5.938,60 3.839,61 4.646,62 4.86,63 3.798,64 3.847,65 5.747,66 3.744,67 0.054,68 0.646,69 9.254,70 5.7}
{0 CHEMBL1982992,2 13.245,3 10.908,4 0.078,5 22.275,6 3.055,7 152.459,8 4.327,9 51.582,11 5.156,12 1.94,13 6.722,14 3.459,15 11.963,16 73.29,17 10.683,18 0.8,19 3.424,20 3.503,21 3.344,22 3.111,23 4.686,24 3.077,25 3.841,26 3.937,27 3.738,28 3.475,29 5.12,30 3.424,31 4.011,32 4.147,33 3.825,34 3.493,35 5.242,36 3.418,37 3.966,38 4.148,39 3.653,40 3.291,41 5.231,42 3.236,43 3.801,44 3.981,45 3.283,46 3.217,47 4.935,48 3.12,49 3.665,50 3.818,51 3.368,52 3.194,53 4.906,54 3.095,55 3.635,56 3.779,57 3.252,58 3.092,59 4.868,60 2.958,61 3.336,62 3.485,63 3.031,64 2.589,65 4.827,66 2.464,67 0.095,68 0.385,69 2.09,70 5.1}
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{0 CHEMBL1985690,2 19.507,3 39.602,4 0.047,5 17.455,6 7.986,7 396.675,8 18.483,9 82.873,11 6.884,12 1.63,13 13.333,14 6.412,15 41.119,16 150.358,17 7.717,18 0.564,19 4.298,20 4.407,21 4.037,22 3.91,23 5.338,24 3.837,25 4.844,26 5.009,27 4.362,28 4.306,29 6.013,30 4.218,31 5.088,32 5.272,33 4.479,34 4.475,35 6.13,36 4.366,37 5.249,38 5.455,39 4.531,40 4.538,41 6.372,42 4.402,43 5.271,44 5.502,45 4.415,46 4.503,47 6.291,48 4.349,49 5.139,50 5.33,51 4.358,52 4.39,53 6.285,54 4.277,55 5.164,56 5.357,57 4.229,58 4.318,59 6.319,60 4.219,61 5.095,62 5.308,63 4.19,64 4.34,65 6.13,66 4.185,67 0.096,68 1.005,69 17.511,70 5.4}
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{0 CHEMBL1986263,2 21.932,3 19.194,4 -0.022,5 31.6,6 5.071,7 236.254,8 9.041,9 54.706,11 5.662,12 1.713,13 10.083,14 3.318,15 11.007,16 97.172,17 8.154,18 0.462,19 3.843,20 3.955,21 3.537,22 3.401,23 4.988,24 3.368,25 4.344,26 4.516,27 3.934,28 3.74,29 5.462,30 3.696,31 4.466,32 4.648,33 3.948,34 3.845,35 5.548,36 3.786,37 4.537,38 4.704,39 3.881,40 3.897,41 5.656,42 3.78,43 4.594,44 4.811,45 3.748,46 3.784,47 5.706,48 3.683,49 4.432,50 4.668,51 3.609,52 3.64,53 5.491,54 3.55,55 4.32,56 4.553,57 3.507,58 3.554,59 5.402,60 3.45,61 4.202,62 4.425,63 3.382,64 3.477,65 5.188,66 3.353,67 0.038,68 0.645,69 8.091,70 5.4}
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{0 CHEMBL1987009,2 12.058,3 20.076,4 0.053,5 15.608,6 4.823,7 212.711,8 8.215,9 51.337,11 5.642,12 1.643,13 11.577,14 4.072,15 16.578,16 104.427,17 8.453,18 0.724,19 3.88,20 3.98,21 3.606,22 3.519,23 5.04,24 3.48,25 4.36,26 4.491,27 3.982,28 3.898,29 5.489,30 3.839,31 4.515,32 4.674,33 3.992,34 3.933,35 5.607,36 3.855,37 4.552,38 4.746,39 3.813,40 3.858,41 5.629,42 3.768,43 4.523,44 4.732,45 3.817,46 3.834,47 5.617,48 3.724,49 4.41,50 4.605,51 3.749,52 3.754,53 5.518,54 3.629,55 4.274,56 4.472,57 3.617,58 3.6,59 5.445,60 3.483,61 4.109,62 4.281,63 3.503,64 3.444,65 5.294,66 3.373,67 0.058,68 0.614,69 7.479,70 5.1}
{0 CHEMBL1987034,2 27.039,3 22.42,4 0.046,5 42.574,6 6.677,7 184.795,8 8.118,9 177.897,11 5.554,12 1.961,13 13.103,14 3.716,15 13.807,16 112.596,17 10.804,18 0.581,19 3.916,20 4.006,21 3.913,22 3.514,23 5.158,24 3.497,25 4.38,26 4.491,27 4.217,28 3.848,29 5.897,30 3.821,31 4.591,32 4.743,33 4.338,34 3.93,35 5.922,36 3.887,37 4.58,38 4.762,39 4.132,40 3.885,41 5.811,42 3.815,43 4.562,44 4.769,45 4.207,46 3.866,47 5.839,48 3.797,49 4.481,50 4.664,51 4.168,52 3.826,53 5.728,54 3.743,55 4.369,56 4.559,57 4.134,58 3.707,59 5.751,60 3.625,61 4.257,62 4.434,63 4.093,64 3.619,65 5.505,66 3.545,67 0.18,68 0.711,69 5.012,70 5.6}
{0 CHEMBL1987359,2 19.67,3 29.365,4 0.03,5 25.315,6 6.121,7 351.937,8 10.006,9 39.146,11 5.947,12 1.515,13 11.308,14 1.972,15 3.887,16 102.75,17 6.97,18 0.393,19 4.012,20 4.14,21 3.506,22 3.519,23 5.078,24 3.491,25 4.568,26 4.758,27 3.84,28 3.919,29 5.585,30 3.86,31 4.852,32 5.087,33 4.012,34 4.085,35 5.88,36 4.018,37 4.879,38 5.089,39 4.025,40 4.082,41 6.075,42 4.025,43 4.867,44 5.086,45 3.91,46 4.037,47 5.996,48 3.955,49 4.807,50 5.037,51 3.736,52 3.962,53 5.871,54 3.844,55 4.733,56 4.965,57 3.603,58 3.88,59 5.737,60 3.757,61 4.664,62 4.895,63 3.503,64 3.751,65 5.871,66 3.626,67 0.038,68 0.738,69 11.374,70 5.1}
{0 CHEMBL1987533,2 10.672,3 14.782,4 0.057,5 13.943,6 3.61,7 182.005,8 6.018,9 51.337,11 5.407,12 1.676,13 8.8,14 3.095,15 9.578,16 78.433,17 8.93,18 0.727,19 3.589,20 3.698,21 3.309,22 3.214,23 4.781,24 3.196,25 4.051,26 4.183,27 3.668,28 3.589,29 5.243,30 3.549,31 4.276,32 4.454,33 3.668,34 3.649,35 5.421,36 3.57,37 4.243,38 4.449,39 3.506,40 3.497,41 5.395,42 3.398,43 4.085,44 4.295,45 3.411,46 3.236,47 5.41,48 3.187,49 3.887,50 4.09,51 3.17,52 3.145,53 5.127,54 3.087,55 3.755,56 3.941,57 3.209,58 3.159,59 4.961,60 3.084,61 3.732,62 3.91,63 3.081,64 3.137,65 4.833,66 3.02,67 0.067,68 0.468,69 4.566,70 5.1}
{0 CHEMBL1987679,1 1,2 16.738,3 23.672,4 0.064,5 18.936,6 4.967,7 235.482,8 10.303,9 84.479,11 6.06,12 1.579,13 13.233,14 3.09,15 9.545,16 112,17 8.009,18 0.647,19 4.046,20 4.153,21 3.678,22 3.603,23 5.209,24 3.608,25 4.549,26 4.679,27 4.051,28 4.007,29 5.725,30 3.99,31 4.782,32 4.962,33 4.022,34 4.105,35 5.856,36 4.046,37 4.822,38 5.042,39 3.901,40 4.053,41 5.803,42 3.968,43 4.754,44 4.976,45 3.843,46 3.943,47 5.797,48 3.868,49 4.706,50 4.925,51 3.781,52 3.862,53 5.758,54 3.792,55 4.634,56 4.872,57 3.702,58 3.782,59 5.663,60 3.707,61 4.491,62 4.706,63 3.62,64 3.698,65 5.578,66 3.629,67 0.077,68 0.737,69 8.985,70 5.3}
{0 CHEMBL1987793,1 1,2 14.838,3 28.206,4 0.039,5 14.016,6 5.89,7 361.335,8 12.979,9 1.899,11 6.298,12 1.345,13 11.97,14 6.833,15 46.687,16 130.722,17 7.509,18 0.73,19 4.153,20 4.251,21 3.737,22 3.784,23 5.274,24 3.753,25 4.661,26 4.8,27 4.099,28 4.179,29 5.791,30 4.129,31 4.918,32 5.098,33 4.206,34 4.332,35 5.916,36 4.263,37 5.001,38 5.176,39 4.238,40 4.374,41 6.031,42 4.302,43 5.077,44 5.259,45 4.229,46 4.398,47 6.156,48 4.314,49 5.161,50 5.363,51 4.157,52 4.356,53 6.283,54 4.259,55 5.124,56 5.361,57 3.865,58 4.212,59 6.177,60 4.067,61 4.904,62 5.188,63 3.676,64 4.024,65 5.698,66 3.869,67 0.035,68 0.704,69 11.13,70 5.6}
{0 CHEMBL1987910,2 17.508,3 16.154,4 0.099,5 22.606,6 5.459,7 154.627,8 9.172,9 85.704,11 5.857,12 1.856,13 12.133,14 4.487,15 20.136,16 111.743,17 9.522,18 0.667,19 3.945,20 4.047,21 3.735,22 3.562,23 5.222,24 3.556,25 4.435,26 4.55,27 4.186,28 3.948,29 6.167,30 3.926,31 4.618,32 4.776,33 4.16,34 4.04,35 5.904,36 4.004,37 4.717,38 4.89,39 4.238,40 4.01,41 6.162,42 3.982,43 4.725,44 4.924,45 4.007,46 3.893,47 6.121,48 3.853,49 4.534,50 4.731,51 3.865,52 3.702,53 6.2,54 3.666,55 4.331,56 4.542,57 3.594,58 3.608,59 5.521,60 3.549,61 4.272,62 4.469,63 3.656,64 3.56,65 5.595,66 3.51,67 0.19,68 0.897,69 5.456,70 5.2}
{0 CHEMBL1987982,1 1,2 12.346,3 19.384,4 0.051,5 12.342,6 4.412,7 187.566,8 9.538,9 34.796,11 6.135,12 1.643,13 10.846,14 5.802,15 33.666,16 95.972,17 8.335,18 0.552,19 3.891,20 3.997,21 3.542,22 3.452,23 5.037,24 3.458,25 4.455,26 4.594,27 4.012,28 3.859,29 6.154,30 3.844,31 4.611,32 4.807,33 3.855,34 3.995,35 5.609,36 3.919,37 4.645,38 4.843,39 3.853,40 3.975,41 5.762,42 3.896,43 4.688,44 4.919,45 3.796,46 3.896,47 5.849,48 3.823,49 4.571,50 4.807,51 3.636,52 3.766,53 5.646,54 3.687,55 4.383,56 4.607,57 3.486,58 3.624,59 5.376,60 3.539,61 4.305,62 4.525,63 3.461,64 3.486,65 5.484,66 3.424,67 0.121,68 0.823,69 7.033,70 5.6}
{0 CHEMBL1988075,2 18.938,3 21.742,4 0.08,5 24.25,6 6.056,7 213.483,8 11.24,9 102.49,11 5.76,12 1.676,13 14.529,14 4.401,15 19.368,16 133.556,17 8.696,18 0.737,19 4.108,20 4.216,21 3.839,22 3.755,23 5.33,24 3.727,25 4.568,26 4.7,27 4.217,28 4.144,29 5.811,30 4.096,31 4.8,32 4.966,33 4.277,34 4.258,35 5.984,36 4.195,37 4.859,38 5.042,39 4.324,40 4.264,41 6.052,42 4.175,43 4.867,44 5.067,45 4.2,46 4.203,47 6.034,48 4.105,49 4.708,50 4.891,51 4.082,52 4.082,53 6.005,54 4.007,55 4.65,56 4.848,57 3.937,58 4.031,59 5.762,60 3.941,61 4.684,62 4.907,63 3.858,64 3.999,65 5.76,66 3.882,67 0.073,68 0.861,69 8.439,70 5.1}
{0 CHEMBL1988153,2 13.35,3 12.189,4 -0.006,5 13.764,6 4.159,7 138.218,8 6.624,9 50.112,11 6.097,12 1.997,13 10.808,14 3.895,15 15.171,16 91.257,17 10.483,18 0.724,19 3.767,20 3.834,21 3.645,22 3.359,23 5.074,24 3.381,25 4.277,26 4.372,27 4.135,28 3.726,29 6.074,30 3.748,31 4.346,32 4.449,33 4.055,34 3.718,35 5.736,36 3.734,37 4.386,38 4.531,39 3.978,40 3.639,41 5.811,42 3.661,43 4.194,44 4.346,45 3.742,46 3.548,47 5.52,48 3.545,49 4.167,50 4.283,51 3.8,52 3.566,53 5.626,54 3.528,55 4.149,56 4.325,57 3.611,58 3.507,59 5.325,60 3.442,61 3.955,62 4.105,63 3.499,64 3.257,65 5.332,66 3.252,67 0.272,68 0.753,69 2.443,70 5.5}
{0 CHEMBL1988163,1 1,2 18.723,3 18.803,4 0.048,5 24.777,6 4.11,7 185.566,8 7.058,9 84.772,11 5.779,12 1.766,13 10.269,14 3.086,15 9.523,16 100.21,17 8.913,18 0.759,19 3.854,20 3.953,21 3.731,22 3.468,23 5.017,24 3.446,25 4.333,26 4.453,27 3.998,28 3.833,29 5.811,30 3.805,31 4.548,32 4.721,33 3.967,34 3.9,35 5.769,36 3.851,37 4.549,38 4.747,39 3.892,40 3.825,41 5.75,42 3.773,43 4.476,44 4.684,45 3.797,46 3.755,47 5.7,48 3.7,49 4.386,50 4.584,51 3.697,52 3.678,53 5.53,54 3.615,55 4.305,56 4.527,57 3.664,58 3.583,59 5.588,60 3.511,61 4.149,62 4.339,63 3.522,64 3.504,65 5.317,66 3.427,67 0.119,68 0.679,69 8.513,70 5.7}
{0 CHEMBL1988173,2 19.132,3 26.204,4 0.07,5 21.657,6 6.873,7 295.315,8 10.717,9 53.787,11 5.58,12 1.711,13 11.241,14 4.759,15 22.643,16 119.157,17 8.693,18 0.581,19 3.981,20 4.091,21 3.665,22 3.602,23 5.174,24 3.564,25 4.441,26 4.572,27 4.065,28 3.97,29 5.646,30 3.918,31 4.739,32 4.898,33 4.194,34 4.129,35 6.041,36 4.053,37 4.833,38 5.014,39 4.192,40 4.122,41 6.096,42 4.045,43 4.868,44 5.06,45 4.221,46 4.112,47 6.172,48 4.026,49 4.801,50 5.012,51 4.04,52 4.039,53 6.008,54 3.915,55 4.659,56 4.897,57 4.005,58 3.935,59 5.756,60 3.783,61 4.481,62 4.697,63 3.82,64 3.818,65 5.633,66 3.672,67 0.092,68 0.67,69 7.917,70 5.8}
{0 CHEMBL1988300,2 6.325,3 18.052,4 0.122,5 5,6 4.191,7 141.253,8 9.094,9 116.151,11 6.077,12 1.51,13 11.464,14 4.014,15 16.111,16 117.879,17 8.522,18 0.813,19 3.936,20 4.051,21 3.668,22 3.612,23 5.117,24 3.572,25 4.381,26 4.507,27 4.048,28 4.015,29 5.523,30 3.953,31 4.591,32 4.764,33 4.078,34 4.102,35 5.678,36 4.013,37 4.643,38 4.84,39 4.042,40 4.083,41 5.677,42 3.963,43 4.561,44 4.77,45 3.843,46 3.978,47 5.535,48 3.834,49 4.437,50 4.634,51 3.849,52 3.853,53 5.527,54 3.756,55 4.431,56 4.642,57 3.789,58 3.813,59 5.477,60 3.71,61 4.359,62 4.576,63 3.663,64 3.751,65 5.425,66 3.628,67 0.051,68 0.679,69 7.664,70 5.1}
{0 CHEMBL1988387,2 23.089,3 19.626,4 0.055,5 28.448,6 6.853,7 224.482,8 11.601,9 104.144,11 5.775,12 1.842,13 16.139,14 4.519,15 20.42,16 135.961,17 9.046,18 0.675,19 4.166,20 4.272,21 3.917,22 3.737,23 5.405,24 3.737,25 4.655,26 4.789,27 4.312,28 4.128,29 6.114,30 4.108,31 4.798,32 4.954,33 4.298,34 4.249,35 5.964,36 4.196,37 4.901,38 5.074,39 4.396,40 4.286,41 6.126,42 4.218,43 4.949,44 5.147,45 4.307,46 4.219,47 6.209,48 4.148,49 4.787,50 4.979,51 4.097,52 4.069,53 5.998,54 4.013,55 4.706,56 4.914,57 3.981,58 4.005,59 5.893,60 3.923,61 4.694,62 4.908,63 3.88,64 3.946,65 5.809,66 3.859,67 0.194,68 1.016,69 8.063,70 5.1}
{0 CHEMBL1988437,2 7.851,3 23.017,4 0.052,5 5.913,6 5.448,7 213.483,8 8.717,9 68.122,11 5.473,12 1.585,13 12.286,14 4.493,15 20.186,16 114.788,17 8.402,18 0.71,19 3.933,20 4.041,21 3.653,22 3.596,23 5.11,24 3.55,25 4.385,26 4.525,27 4.009,28 3.968,29 5.533,30 3.895,31 4.58,32 4.752,33 4.064,34 4.071,35 5.68,36 3.961,37 4.574,38 4.747,39 4.008,40 3.986,41 5.713,42 3.882,43 4.522,44 4.712,45 3.866,46 3.941,47 5.584,48 3.83,49 4.549,50 4.75,51 3.804,52 3.926,53 5.609,54 3.818,55 4.533,56 4.753,57 3.746,58 3.841,59 5.597,60 3.752,61 4.411,62 4.634,63 3.583,64 3.705,65 5.489,66 3.601,67 0.044,68 0.663,69 7.861,70 5.1}
{0 CHEMBL1988537,2 16.56,3 19.564,5 18.34,6 4.318,7 228.318,8 7.864,9 19.91,11 6.042,12 1.753,13 8.84,14 4.183,15 17.497,16 99.724,17 9.707,18 0.643,19 3.771,20 3.845,21 3.617,22 3.465,23 4.971,24 3.428,25 4.249,26 4.354,27 4.032,28 3.858,29 5.423,30 3.803,31 4.452,32 4.567,33 4.283,34 4.02,35 5.661,36 3.943,37 4.489,38 4.615,39 4.127,40 3.968,41 5.741,42 3.903,43 4.491,44 4.636,45 4.068,46 3.946,47 5.778,48 3.888,49 4.445,50 4.589,51 4.03,52 3.922,53 5.757,54 3.834,55 4.383,56 4.559,57 3.769,58 3.792,59 5.499,60 3.654,61 4.197,62 4.408,63 3.371,64 3.439,65 5.241,66 3.288,67 0.048,68 0.476,69 4.201,70 6.7}
{0 CHEMBL1988594,2 22.405,3 17.091,4 0.09,5 31.522,6 5.58,7 179.772,8 7.832,9 120.5,11 5.589,12 1.76,13 13.276,14 2.243,15 5.029,16 112.693,17 8.989,18 0.688,19 3.939,20 4.052,21 3.695,22 3.54,23 5.197,24 3.527,25 4.376,26 4.501,27 4.059,28 3.904,29 5.68,30 3.867,31 4.594,32 4.766,33 4.056,34 3.959,35 5.816,36 3.916,37 4.626,38 4.816,39 4.083,40 3.871,41 5.921,42 3.836,43 4.566,44 4.762,45 3.847,46 3.755,47 5.972,48 3.708,49 4.392,50 4.577,51 3.727,52 3.692,53 5.655,54 3.645,55 4.327,56 4.512,57 3.698,58 3.739,59 5.489,60 3.638,61 4.332,62 4.536,63 3.552,64 3.641,65 5.463,66 3.547,67 0.112,68 0.73,69 6.721,70 5.3}
{0 CHEMBL1988608,2 22.035,3 17.202,4 0.078,5 34.011,6 4.778,7 263.536,8 7.205,9 84.908,11 5.632,12 1.663,13 11.75,14 1.259,15 1.586,16 105.617,17 8.343,18 0.516,19 3.942,20 4.049,21 3.589,22 3.482,23 5.203,24 3.496,25 4.37,26 4.513,27 3.917,28 3.806,29 5.623,30 3.81,31 4.56,32 4.726,33 3.903,34 3.863,35 5.887,36 3.837,37 4.584,38 4.801,39 3.79,40 3.817,41 5.739,42 3.766,43 4.491,44 4.682,45 3.759,46 3.759,47 5.716,48 3.726,49 4.497,50 4.685,51 3.778,52 3.748,53 5.737,54 3.726,55 4.483,56 4.651,57 3.761,58 3.691,59 5.804,60 3.679,61 4.471,62 4.688,63 3.681,64 3.595,65 5.746,66 3.568,67 0.148,68 0.696,69 7.509,70 5.1}
{0 CHEMBL1988717,2 22.502,3 18.871,4 0.038,5 29.401,6 6.063,7 201.711,8 9.99,9 121.971,11 6.444,12 1.79,13 15.528,14 3.183,15 10.128,16 128.671,17 8.955,18 0.675,19 4.158,20 4.281,21 3.863,22 3.663,23 5.429,24 3.699,25 4.658,26 4.807,27 4.309,28 4.05,29 6.295,30 4.08,31 4.823,32 4.994,33 4.278,34 4.162,35 6.129,36 4.164,37 4.944,38 5.146,39 4.282,40 4.142,41 6.275,42 4.143,43 4.925,44 5.15,45 4.205,46 4.032,47 6.283,48 4.037,49 4.761,50 4.975,51 4.007,52 3.944,53 6.019,54 3.931,55 4.693,56 4.908,57 3.993,58 3.893,59 6.234,60 3.857,61 4.569,62 4.784,63 3.795,64 3.83,65 5.741,66 3.781,67 0.258,68 1.127,69 7.531,70 5.1}
{0 CHEMBL1988838,2 28.574,3 23.411,4 0.071,5 45.114,6 6.644,7 245.253,8 8.114,9 133.781,11 5.555,12 1.831,13 13.233,14 2.577,15 6.64,16 112.858,17 8.57,18 0.563,19 4.031,20 4.141,21 3.832,22 3.553,23 5.24,24 3.545,25 4.507,26 4.642,27 4.092,28 3.884,29 6.003,30 3.869,31 4.719,32 4.879,33 4.08,34 3.974,35 6.04,36 3.94,37 4.761,38 4.978,39 3.97,40 3.929,41 5.928,42 3.873,43 4.683,44 4.899,45 3.963,46 3.917,47 5.914,48 3.861,49 4.656,50 4.851,51 3.916,52 3.884,53 5.873,54 3.833,55 4.661,56 4.898,57 3.855,58 3.82,59 5.894,60 3.736,61 4.505,62 4.731,63 3.754,64 3.71,65 5.633,66 3.633,67 0.194,68 0.806,69 11.113,70 5.1}
{0 CHEMBL1988995,2 8.106,3 16.756,4 -0.039,5 4.928,6 3.779,7 174.303,8 5.937,9 69.225,11 6.284,12 1.785,13 9.25,14 4.651,15 21.632,16 98.081,17 9.057,18 0.781,19 3.913,20 4.019,21 3.648,22 3.431,23 5.17,24 3.47,25 4.422,26 4.567,27 4.07,28 3.823,29 5.685,30 3.862,31 4.6,32 4.783,33 4.096,34 3.878,35 5.878,36 3.91,37 4.636,38 4.844,39 4.093,40 3.86,41 6.034,42 3.895,43 4.563,44 4.737,45 4.038,46 3.873,47 5.805,48 3.894,49 4.569,50 4.723,51 4.066,52 3.888,53 5.92,54 3.896,55 4.611,56 4.808,57 3.964,58 3.816,59 5.862,60 3.814,61 4.491,62 4.708,63 3.799,64 3.641,65 5.806,66 3.635,67 0.18,68 0.842,69 5.319,70 5.1}
{0 CHEMBL1989029,2 15.478,3 16.187,4 0.035,5 19.632,6 3.324,7 206.708,8 5.59,9 50.112,11 5.152,12 1.588,13 7.9,14 2.985,15 8.913,16 77.838,17 7.695,18 0.5,19 3.678,20 3.788,21 3.271,22 3.203,23 4.853,24 3.201,25 4.16,26 4.313,27 3.63,28 3.563,29 5.307,30 3.549,31 4.327,32 4.506,33 3.574,34 3.584,35 5.471,36 3.546,37 4.305,38 4.523,39 3.458,40 3.547,41 5.358,42 3.479,43 4.202,44 4.395,45 3.464,46 3.477,47 5.294,48 3.439,49 4.284,50 4.481,51 3.466,52 3.419,53 5.506,54 3.385,55 4.212,56 4.451,57 3.146,58 3.266,59 5.293,60 3.192,61 3.996,62 4.236,63 2.849,64 3.107,65 4.993,66 2.99,67 0.073,68 0.518,69 6.862,70 5.2}
{0 CHEMBL1989265,2 24.039,3 26.106,4 0.072,5 35.128,6 4.058,7 269.54,8 11.598,9 39.146,11 6.323,12 1.844,13 8.4,14 1.999,15 3.996,16 95.228,17 8.452,18 0.214,19 3.897,20 4.003,21 3.602,22 3.457,23 5.057,24 3.434,25 4.471,26 4.623,27 4.055,28 3.909,29 5.672,30 3.871,31 4.764,32 4.958,33 4.169,34 4.081,35 5.924,36 4.018,37 4.828,38 5.016,39 4.283,40 4.094,41 6.185,42 4.034,43 4.754,44 4.923,45 4.099,46 3.989,47 6.121,48 3.945,49 4.736,50 4.936,51 3.898,52 3.809,53 6.069,54 3.759,55 4.604,56 4.815,57 3.785,58 3.655,59 6.044,60 3.592,61 4.414,62 4.634,63 3.369,64 3.561,65 5.502,66 3.393,67 0.134,68 0.731,69 7.976,70 5.1}
{0 CHEMBL1989474,2 4.79,3 10.929,4 -0.035,5 3.162,6 2.902,7 129.482,8 4.624,9 52.011,11 5.13,12 1.595,13 7.632,14 2.801,15 7.843,16 71.083,17 8.476,18 0.81,19 3.535,20 3.651,21 3.22,22 3.103,23 4.776,24 3.11,25 3.995,26 4.161,27 3.548,28 3.444,29 5.236,30 3.449,31 4.128,32 4.311,33 3.506,34 3.507,35 5.342,36 3.478,37 4.12,38 4.324,39 3.44,40 3.451,41 5.255,42 3.408,43 4.065,44 4.257,45 3.433,46 3.428,47 5.177,48 3.393,49 4.139,50 4.364,51 3.297,52 3.38,53 5.31,54 3.307,55 4.048,56 4.309,57 2.965,58 3.167,59 5.128,60 3.033,61 3.785,62 4.112,63 2.493,64 2.608,65 4.937,66 2.475,67 0.058,68 0.549,69 4.47,70 5.1}
{0 CHEMBL1989518,2 5.204,3 15.093,4 0.008,5 5.612,6 4.591,7 164.024,8 5.207,9 66.468,11 4.967,12 1.509,13 9.167,14 0.67,15 0.448,16 71.612,17 7.313,18 0.632,19 3.58,20 3.706,21 3.126,22 3.112,23 4.745,24 3.093,25 4.031,26 4.203,27 3.344,28 3.412,29 5.119,30 3.367,31 4.212,32 4.427,33 3.297,34 3.467,35 5.245,36 3.375,37 4.11,38 4.346,39 3.096,40 3.346,41 5.028,42 3.229,43 4.033,44 4.272,45 3.074,46 3.281,47 4.987,48 3.18,49 3.986,50 4.212,51 3.046,52 3.253,53 5.015,54 3.149,55 3.975,56 4.233,57 2.944,58 3.13,59 4.949,60 3.019,61 3.793,62 4.054,63 2.674,64 2.861,65 4.776,66 2.756,67 0.023,68 0.478,69 6.745,70 5.1}
{0 CHEMBL1989646,2 12.138,3 16.24,4 0.065,5 15.495,6 3.356,7 153.024,8 6.174,9 101.203,11 5.733,12 1.465,13 9.391,14 3.125,15 9.764,16 93.752,17 7.805,18 0.808,19 3.796,20 3.934,21 3.417,22 3.353,23 4.964,24 3.343,25 4.266,26 4.435,27 3.77,28 3.74,29 5.346,30 3.714,31 4.443,32 4.638,33 3.756,34 3.814,35 5.497,36 3.758,37 4.557,38 4.8,39 3.626,40 3.765,41 5.55,42 3.683,43 4.429,44 4.686,45 3.55,46 3.644,47 5.388,48 3.569,49 4.324,50 4.556,51 3.5,52 3.589,53 5.357,54 3.511,55 4.289,56 4.548,57 3.366,58 3.481,59 5.294,60 3.38,61 4.123,62 4.385,63 2.948,64 3.318,65 5.028,66 3.181,67 0.106,68 0.658,69 7.422,70 5.3}
{0 CHEMBL1989708,2 22.442,3 29.622,4 0.073,5 27.679,6 6.942,7 315.021,8 13.344,9 104.144,11 5.789,12 1.63,13 15.278,14 4.038,15 16.302,16 145.241,17 8.043,18 0.675,19 4.236,20 4.355,21 3.898,22 3.828,23 5.397,24 3.795,25 4.722,26 4.876,27 4.272,28 4.228,29 5.867,30 4.173,31 4.955,32 5.137,33 4.305,34 4.348,35 6.047,36 4.265,37 5.039,38 5.255,39 4.397,40 4.371,41 6.129,42 4.273,43 5.007,44 5.21,45 4.29,46 4.309,47 6.138,48 4.212,49 4.888,50 5.099,51 4.121,52 4.19,53 5.974,54 4.099,55 4.824,56 5.035,57 4.042,58 4.141,59 5.905,60 4.046,61 4.832,62 5.044,63 4.069,64 4.152,65 5.887,66 4.035,67 0.094,68 0.955,69 11.989,70 5.1}
{0 CHEMBL1989805,2 17.343,3 14.574,4 0.098,5 18.162,6 4.381,7 163.473,8 7.648,9 99.978,11 6.16,12 1.847,13 8.63,14 0.977,15 0.954,16 98.22,17 9.754,18 0.333,19 3.828,20 3.907,21 3.648,22 3.427,23 5.176,24 3.438,25 4.286,26 4.369,27 4.079,28 3.833,29 5.615,30 3.827,31 4.486,32 4.596,33 4.159,34 3.942,35 5.778,36 3.921,37 4.59,38 4.699,39 4.374,40 4.031,41 6.079,42 4.028,43 4.692,44 4.806,45 4.371,46 4.053,47 6.263,48 4.042,49 4.624,50 4.747,51 4.164,52 3.86,53 6.406,54 3.865,55 4.473,56 4.669,57 3.549,58 3.582,59 5.838,60 3.537,61 4.185,62 4.382,63 3.413,64 3.33,65 5.524,66 3.312,67 0.179,68 0.587,69 4.374,70 5.1}
{0 CHEMBL1989957,2 7.215,3 17.347,4 0.059,5 11.409,6 3.727,7 207.479,8 6.677,9 34.796,11 5.256,12 1.406,13 9.1,14 2.915,15 8.495,16 82.287,17 7.343,18 0.773,19 3.676,20 3.791,21 3.234,22 3.284,23 4.798,24 3.251,25 4.149,26 4.303,27 3.529,28 3.653,29 5.217,30 3.591,31 4.394,32 4.608,33 3.552,34 3.761,35 5.386,36 3.665,37 4.349,38 4.574,39 3.397,40 3.673,41 5.293,42 3.556,43 4.281,44 4.519,45 3.317,46 3.577,47 5.248,48 3.457,49 4.165,50 4.392,51 3.185,52 3.465,53 5.11,54 3.342,55 4.071,56 4.306,57 3.048,58 3.318,59 5.023,60 3.191,61 3.938,62 4.191,63 2.824,64 3.086,65 4.899,66 2.959,67 0.04,68 0.488,69 7.251,70 5.1}
{0 CHEMBL1990254,2 8.567,3 20.776,4 0.064,5 11.74,6 5.119,7 213.483,8 8.38,9 67.693,11 5.928,12 1.428,13 10.833,14 2.189,15 4.792,16 94.747,17 7.382,18 0.692,19 3.839,20 3.964,21 3.395,22 3.446,23 4.993,24 3.412,25 4.307,26 4.464,27 3.691,28 3.81,29 5.412,30 3.746,31 4.584,32 4.795,33 3.752,34 3.932,35 5.622,36 3.841,37 4.622,38 4.84,39 3.68,40 3.882,41 5.71,42 3.784,43 4.637,44 4.877,45 3.623,46 3.836,47 5.766,48 3.726,49 4.54,50 4.789,51 3.472,52 3.724,53 5.599,54 3.605,55 4.344,56 4.585,57 3.342,58 3.564,59 5.437,60 3.455,61 4.208,62 4.448,63 3.158,64 3.42,65 5.268,66 3.302,67 0.04,68 0.603,69 8.459,70 5.1}
{0 CHEMBL1990288,2 12.302,3 20.898,4 -0.008,5 18.958,6 4.777,7 209.616,8 7.954,9 69.654,11 5.998,12 1.612,13 11.433,14 5.438,15 29.571,16 112.445,17 8.322,18 0.794,19 4.007,20 4.115,21 3.679,22 3.578,23 5.197,24 3.586,25 4.497,26 4.642,27 4.055,28 3.955,29 5.697,30 3.949,31 4.698,32 4.894,33 4.045,34 4.038,35 5.81,36 4.005,37 4.708,38 4.912,39 4.014,40 4.015,41 5.797,42 3.977,43 4.753,44 4.963,45 4.074,46 4.055,47 5.837,48 4.021,49 4.759,50 4.959,51 4.055,52 4.04,53 5.901,54 4.004,55 4.698,56 4.91,57 3.917,58 3.942,59 5.801,60 3.887,61 4.583,62 4.809,63 3.762,64 3.819,65 5.734,66 3.752,67 0.056,68 0.798,69 7.618,70 5.2}
{0 CHEMBL1990415,2 7.52,3 11.812,4 0.045,5 10.692,6 2.972,7 131.085,8 4.775,9 84.908,11 5.987,12 1.6,13 9.227,14 1.751,15 3.067,16 78.606,17 8.767,18 0.84,19 3.654,20 3.766,21 3.367,22 3.248,23 4.896,24 3.263,25 4.102,26 4.233,27 3.722,28 3.62,29 5.356,30 3.62,31 4.297,32 4.471,33 3.729,34 3.66,35 5.513,36 3.645,37 4.278,38 4.476,39 3.579,40 3.523,41 5.512,42 3.502,43 4.142,44 4.34,45 3.498,46 3.375,47 5.459,48 3.37,49 3.978,50 4.165,51 3.364,52 3.29,53 5.212,54 3.279,55 3.938,56 4.151,57 3.19,58 3.219,59 5.083,60 3.174,61 3.803,62 4.029,63 3.018,64 3.051,65 4.987,66 3.003,67 0.077,68 0.543,69 4.523,70 5.4}
{0 CHEMBL1990482,2 2.824,3 10.192,4 0.084,5 2.351,6 2.485,7 107.543,8 3.81,9 83.254,11 5.532,12 1.617,13 7.111,14 1.122,15 1.259,16 66.006,17 8.51,18 0.8,19 3.476,20 3.594,21 3.152,22 3.054,23 4.742,24 3.066,25 3.908,26 4.042,27 3.505,28 3.417,29 5.218,30 3.412,31 4.091,32 4.263,33 3.496,34 3.463,35 5.309,36 3.442,37 4.087,38 4.28,39 3.426,40 3.358,41 5.384,42 3.339,43 4.006,44 4.228,45 3.22,46 3.22,47 5.255,48 3.174,49 3.768,50 3.978,51 2.886,52 3.076,53 4.87,54 2.992,55 3.599,56 3.808,57 2.765,58 2.898,59 4.776,60 2.811,61 3.519,62 3.764,63 2.419,64 2.509,65 4.79,66 2.425,67 0.059,68 0.452,69 4.267,70 5.2}
{0 CHEMBL1990496,2 16.529,3 30.417,4 0.042,5 19.072,6 6.603,7 307.651,8 12.651,9 87.603,11 6.136,12 1.424,13 12.886,14 3.739,15 13.976,16 139.236,17 7.445,18 0.59,19 4.217,20 4.341,21 3.791,22 3.819,23 5.338,24 3.789,25 4.717,26 4.883,27 4.138,28 4.215,29 5.779,30 4.161,31 4.992,32 5.193,33 4.24,34 4.369,35 6.029,36 4.293,37 5.09,38 5.319,39 4.217,40 4.352,41 6.154,42 4.27,43 5.066,44 5.281,45 4.264,46 4.362,47 6.144,48 4.29,49 5.123,50 5.34,51 4.275,52 4.386,53 6.204,54 4.316,55 5.16,56 5.388,57 4.228,58 4.397,59 6.248,60 4.299,61 5.144,62 5.399,63 4.092,64 4.345,65 6.105,66 4.227,67 0.05,68 0.9,69 12.159,70 5.4}
{0 CHEMBL1990635,1 1,2 16.674,3 27.434,4 0.019,5 19.482,6 5.287,7 269.964,8 12.316,9 19.91,11 6.053,12 1.576,13 12.464,14 7,15 49.001,16 104.783,17 7.617,18 0.516,19 4.037,20 4.153,21 3.616,22 3.572,23 5.099,24 3.56,25 4.638,26 4.805,27 4.089,28 3.986,29 6.199,30 3.95,31 4.837,32 5.065,33 3.894,34 4.119,35 5.731,36 4.016,37 4.901,38 5.148,39 3.846,40 4.101,41 5.865,42 3.971,43 4.893,44 5.177,45 3.783,46 3.975,47 5.906,48 3.858,49 4.668,50 4.918,51 3.694,52 3.84,53 5.683,54 3.751,55 4.556,56 4.79,57 3.6,58 3.778,59 5.487,60 3.685,61 4.508,62 4.742,63 3.592,64 3.706,65 5.578,66 3.618,67 0.07,68 0.932,69 10.053,70 5.4}
{0 CHEMBL1990821,1 1,2 17.956,3 29.461,4 0.05,5 17.777,6 6.384,7 396.648,8 14.607,9 16.786,11 6.369,12 1.337,13 11.875,14 7.827,15 61.262,16 129.513,17 7.01,18 0.629,19 4.181,20 4.291,21 3.692,22 3.779,23 5.266,24 3.735,25 4.704,26 4.871,27 4.061,28 4.172,29 5.78,30 4.109,31 4.923,32 5.094,33 4.172,34 4.337,35 5.938,36 4.255,37 5.095,38 5.294,39 4.161,40 4.392,41 6.068,42 4.29,43 5.159,44 5.384,45 4.079,46 4.38,47 6.097,48 4.255,49 5.15,50 5.39,51 4.021,52 4.314,53 6.123,54 4.182,55 5.09,56 5.356,57 3.845,58 4.179,59 6.043,60 4.026,61 4.847,62 5.089,63 3.823,64 4.037,65 5.842,66 3.926,67 0.054,68 0.773,69 13.04,70 5.2}
{0 CHEMBL1990884,2 20.28,3 19.018,4 0.095,5 25.585,6 4.826,7 199.448,8 9.608,9 100.591,11 6.132,12 1.651,13 11.759,14 4.399,15 19.354,16 109.399,17 8.134,18 0.688,19 3.99,20 4.105,21 3.618,22 3.554,23 5.233,24 3.556,25 4.459,26 4.601,27 4.021,28 3.94,29 5.727,30 3.929,31 4.675,32 4.823,33 4.104,34 4.058,35 5.949,36 4.039,37 4.816,38 5.009,39 4.06,40 4.048,41 6.086,42 4.012,43 4.787,44 4.999,45 3.921,46 3.946,47 6.066,48 3.893,49 4.686,50 4.933,51 3.774,52 3.793,53 5.886,54 3.738,55 4.411,56 4.618,57 3.663,58 3.632,59 5.705,60 3.605,61 4.365,62 4.567,63 3.637,64 3.559,65 5.828,66 3.532,67 0.1,68 0.772,69 8.295,70 5.3}
{0 CHEMBL1990885,1 1,2 25.99,3 29.378,4 0.012,5 30.71,6 6.557,7 332.796,8 11.644,9 55.931,11 5.705,12 1.584,13 11.655,14 2.998,15 8.987,16 113.678,17 7.117,18 0.355,19 4.101,20 4.238,21 3.612,22 3.603,23 5.199,24 3.578,25 4.649,26 4.852,27 3.983,28 3.985,29 5.735,30 3.943,31 4.864,32 5.08,33 4.051,34 4.122,35 5.954,36 4.066,37 4.978,38 5.196,39 4.03,40 4.168,41 6.076,42 4.077,43 5.06,44 5.324,45 3.954,46 4.095,47 6.164,48 3.994,49 4.949,50 5.221,51 3.905,52 4.029,53 6.047,54 3.935,55 4.824,56 5.053,57 3.867,58 3.978,59 5.943,60 3.895,61 4.825,62 5.057,63 3.837,64 3.927,65 6.073,66 3.851,67 0.042,68 0.89,69 12.112,70 5.9}
{0 CHEMBL1990904,2 9.533,3 20.538,4 -0.005,5 13.162,6 3.972,7 188.338,8 6.484,9 86.439,10 1,11 5.789,12 1.563,13 9.889,14 3.744,15 14.015,16 100.737,17 8.192,18 0.71,19 3.926,20 4.047,21 3.589,22 3.49,23 5.071,24 3.494,25 4.418,26 4.588,27 3.908,28 3.834,29 5.565,30 3.817,31 4.61,32 4.831,33 3.939,34 3.903,35 5.707,36 3.871,37 4.574,38 4.792,39 3.906,40 3.88,41 5.656,42 3.853,43 4.537,44 4.729,45 3.962,46 3.928,47 5.62,48 3.903,49 4.627,50 4.823,51 3.974,52 3.98,53 5.795,54 3.94,55 4.653,56 4.876,57 3.816,58 3.909,59 5.711,60 3.831,61 4.556,62 4.817,63 3.586,64 3.669,65 5.638,66 3.581,67 0.045,68 0.796,69 7.338,70 5.1}
{0 CHEMBL1990912,2 7.215,3 16.281,4 0.043,5 11.409,6 3.682,7 195.708,8 6.157,9 51.582,11 5.256,12 1.49,13 9.1,14 1.764,15 3.112,16 80.13,17 7.581,18 0.773,19 3.66,20 3.777,21 3.244,22 3.241,23 4.814,24 3.222,25 4.129,26 4.288,27 3.534,28 3.605,29 5.226,30 3.56,31 4.354,32 4.564,33 3.557,34 3.715,35 5.381,36 3.633,37 4.319,38 4.543,39 3.403,40 3.627,41 5.294,42 3.522,43 4.251,44 4.49,45 3.324,46 3.522,47 5.251,48 3.419,49 4.115,50 4.336,51 3.192,52 3.402,53 5.104,54 3.299,55 4.031,56 4.265,57 3.056,58 3.25,59 5.023,60 3.143,61 3.894,62 4.148,63 2.838,64 3.014,65 4.913,66 2.904,67 0.032,68 0.509,69 6.782,70 5.1}
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{0 CHEMBL1991138,2 23.655,3 36.709,4 0.026,5 23.807,6 5.982,7 352.362,8 13.178,9 70.879,10 1,11 5.889,12 1.41,13 13.5,14 4.881,15 23.819,16 135.731,17 6.979,18 0.564,19 4.275,20 4.404,21 3.81,22 3.835,23 5.267,24 3.802,25 4.836,26 5.018,27 4.148,28 4.243,29 5.755,30 4.181,31 5.096,32 5.33,33 4.157,34 4.351,35 5.94,36 4.247,37 5.132,38 5.393,39 4.146,40 4.324,41 5.978,42 4.224,43 5.06,44 5.29,45 4.118,46 4.351,47 5.902,48 4.241,49 5.106,50 5.347,51 4.116,52 4.368,53 5.956,54 4.247,55 5.119,56 5.38,57 4.051,58 4.313,59 5.971,60 4.182,61 5.02,62 5.276,63 3.974,64 4.201,65 5.846,66 4.089,67 0.06,68 0.98,69 14.508,70 5.1}
{0 CHEMBL1991143,2 20.52,3 15.996,4 0.033,5 23.739,6 3.407,7 260.124,8 7.159,9 18.44,11 6.145,12 1.692,13 8.833,14 4.382,15 19.2,16 92.879,17 8.942,18 0.63,19 3.779,20 3.875,21 3.504,22 3.388,23 4.991,24 3.378,25 4.265,26 4.4,27 3.937,28 3.791,29 5.438,30 3.78,31 4.497,32 4.636,33 4.074,34 3.91,35 5.753,36 3.902,37 4.615,38 4.783,39 4.07,40 3.885,41 5.947,42 3.878,43 4.534,44 4.706,45 3.973,46 3.799,47 5.919,48 3.779,49 4.418,50 4.579,51 3.789,52 3.739,53 5.698,54 3.683,55 4.375,56 4.593,57 3.554,58 3.624,59 5.488,60 3.501,61 4.146,62 4.383,63 3.06,64 3.373,65 5.126,66 3.204,67 0.128,68 0.547,69 5.435,70 5.1}
{0 CHEMBL1991188,2 18.962,3 21.352,4 -0.005,5 24.013,6 6.274,7 282.567,8 10.137,9 34.796,11 6.062,12 1.592,13 11.571,14 3.54,15 12.529,16 104.688,17 7.764,18 0.6,19 3.983,20 4.085,21 3.575,22 3.525,23 5.184,24 3.518,25 4.48,26 4.634,27 3.899,28 3.869,29 5.651,30 3.853,31 4.668,32 4.829,33 4.023,34 4.021,35 5.881,36 3.991,37 4.782,38 4.957,39 4.01,40 4.045,41 6.027,42 3.993,43 4.874,44 5.091,45 3.918,46 4.022,47 6.023,48 3.951,49 4.784,50 4.993,51 3.824,52 3.923,53 5.938,54 3.855,55 4.687,56 4.907,57 3.753,58 3.843,59 5.825,60 3.767,61 4.658,62 4.897,63 3.651,64 3.754,65 5.905,66 3.665,67 0.056,68 0.72,69 9.046,70 5.1}
{0 CHEMBL1991285,2 25.707,3 27.355,4 0.019,5 31.855,6 7.225,7 343.23,8 10.206,9 100.652,10 1,11 5.708,12 1.794,13 12.9,14 3.094,15 9.575,16 107.55,17 8.598,18 0.375,19 4.022,20 4.126,21 3.685,22 3.534,23 5.263,24 3.542,25 4.544,26 4.693,27 4.06,28 3.926,29 5.808,30 3.903,31 4.837,32 5.026,33 4.127,34 4.049,35 6.018,36 3.996,37 4.887,38 5.101,39 4.03,40 3.931,41 6.101,42 3.882,43 4.709,44 4.904,45 3.956,46 3.808,47 5.986,48 3.783,49 4.617,50 4.792,51 3.995,52 3.86,53 5.909,54 3.82,55 4.713,56 4.923,57 3.956,58 3.959,59 5.822,60 3.885,61 4.754,62 4.958,63 4.052,64 3.962,65 6.009,66 3.893,67 0.163,68 0.738,69 8.045,70 5.1}
{0 CHEMBL1991356,1 1,2 16.113,3 14.857,4 0.018,5 19.091,6 3.015,7 189.169,8 6.804,9 19.91,11 5.888,12 1.493,13 8.5,14 3.454,15 11.932,16 84.165,17 8.065,18 0.68,19 3.716,20 3.814,21 3.368,22 3.321,23 4.878,24 3.316,25 4.206,26 4.333,27 3.74,28 3.71,29 5.352,30 3.695,31 4.404,32 4.56,33 3.796,34 3.829,35 5.531,36 3.789,37 4.444,38 4.622,39 3.709,40 3.798,41 5.566,42 3.74,43 4.415,44 4.633,45 3.518,46 3.688,47 5.455,48 3.602,49 4.215,50 4.408,51 3.379,52 3.497,53 5.33,54 3.424,55 4.069,56 4.269,57 3.2,58 3.34,59 5.168,60 3.265,61 3.983,62 4.202,63 3.08,64 3.17,65 5.113,66 3.09,67 0.021,68 0.49,69 6.097,70 5.1}
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{0 CHEMBL1991429,2 30.162,3 33.891,4 0.019,5 48.926,6 7.606,7 344.567,8 13.003,9 90.789,11 6.027,12 1.608,13 15.907,14 5.972,15 35.667,16 166.611,17 8.368,18 0.673,19 4.371,20 4.48,21 4.077,22 3.993,23 5.51,24 3.969,25 4.879,26 5.023,27 4.463,28 4.384,29 6.008,30 4.344,31 5.119,32 5.314,33 4.432,34 4.468,35 6.192,36 4.405,37 5.103,38 5.303,39 4.444,40 4.439,41 6.226,42 4.384,43 5.13,44 5.314,45 4.537,46 4.498,47 6.287,48 4.445,49 5.166,50 5.365,51 4.521,52 4.523,53 6.279,54 4.442,55 5.123,56 5.326,57 4.437,58 4.463,59 6.189,60 4.376,61 5.079,62 5.296,63 4.366,64 4.407,65 6.154,66 4.328,67 0.039,68 1.065,69 11.75,70 5.1}
{0 CHEMBL1991434,2 14.352,3 17.926,4 -0.016,5 13.516,6 5.023,7 223.159,8 7.336,9 65.354,11 5.681,12 1.659,13 9.917,14 4.289,15 18.396,16 93.83,17 10.217,18 0.462,19 3.762,20 3.83,21 3.599,22 3.357,23 5.002,24 3.352,25 4.231,26 4.34,27 3.988,28 3.707,29 5.455,30 3.692,31 4.337,32 4.446,33 4.052,34 3.812,35 5.593,36 3.767,37 4.422,38 4.567,39 3.873,40 3.775,41 5.569,42 3.724,43 4.475,44 4.638,45 3.835,46 3.734,47 5.653,48 3.697,49 4.426,50 4.599,51 3.888,52 3.645,53 5.632,54 3.595,55 4.265,56 4.449,57 3.965,58 3.494,59 5.505,60 3.442,61 4.035,62 4.18,63 3.761,64 3.352,65 5.342,66 3.295,67 0.121,68 0.457,69 3.479,70 5.1}
{0 CHEMBL1991674,1 1,2 13.245,3 26.349,4 0.045,5 20.57,6 4.293,7 258.399,8 7.92,9 85.153,11 5.548,12 1.674,13 9.958,14 2.716,15 7.379,16 92.956,17 8.187,18 0.593,19 3.866,20 3.988,21 3.512,22 3.411,23 4.951,24 3.399,25 4.411,26 4.575,27 3.916,28 3.829,29 5.492,30 3.788,31 4.714,32 4.947,33 3.899,34 3.926,35 5.679,36 3.845,37 4.676,38 4.933,39 3.857,40 3.827,41 5.66,42 3.736,43 4.512,44 4.76,45 3.769,46 3.743,47 5.51,48 3.651,49 4.391,50 4.592,51 3.858,52 3.72,53 5.46,54 3.64,55 4.371,56 4.574,57 3.718,58 3.666,59 5.473,60 3.555,61 4.246,62 4.452,63 3.43,64 3.525,65 5.247,66 3.404,67 0.068,68 0.664,69 7.815,70 5.6}
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{0 CHEMBL1991725,1 1,2 15.288,3 32.064,4 0.009,5 16.618,6 7.264,7 353.965,8 14.683,9 71.492,11 6.013,12 1.478,13 13.472,14 3.578,15 12.802,16 140.891,17 7.379,18 0.675,19 4.268,20 4.389,21 3.835,22 3.828,23 5.367,24 3.807,25 4.789,26 4.964,27 4.166,28 4.22,29 5.823,30 4.179,31 5.024,32 5.211,33 4.203,34 4.372,35 6.034,36 4.285,37 5.15,38 5.396,39 4.145,40 4.344,41 6.071,42 4.236,43 5.086,44 5.311,45 4.108,46 4.259,47 6.12,48 4.175,49 5.055,50 5.286,51 4.143,52 4.267,53 6.003,54 4.186,55 5.078,56 5.295,57 4.192,58 4.301,59 6.105,60 4.222,61 5.143,62 5.386,63 4.165,64 4.292,65 6.153,66 4.209,67 0.034,68 0.953,69 13.145,70 5.1}
{0 CHEMBL1992242,2 16.574,3 20.836,4 0.047,5 26.577,6 4.909,7 225.254,8 10.191,9 50.998,11 5.715,12 1.533,13 11.37,14 5.226,15 27.309,16 111.923,17 8.12,18 0.733,19 3.925,20 4.033,21 3.626,22 3.589,23 5.058,24 3.54,25 4.397,26 4.544,27 3.975,28 3.981,29 5.516,30 3.903,31 4.606,32 4.773,33 3.94,34 4.077,35 5.66,36 3.974,37 4.703,38 4.925,39 3.913,40 4.028,41 5.732,42 3.916,43 4.629,44 4.832,45 3.772,46 3.921,47 5.742,48 3.808,49 4.596,50 4.859,51 3.661,52 3.79,53 5.594,54 3.652,55 4.3,56 4.509,57 3.4,58 3.573,59 5.39,60 3.465,61 4.157,62 4.38,63 3.402,64 3.503,65 5.154,66 3.406,67 0.042,68 0.638,69 8.779,70 5.1}
{0 CHEMBL1992306,2 27.005,3 18.735,4 0.02,5 35.733,6 6.905,7 226.085,8 8.185,9 70.818,11 5.633,12 1.851,13 14.161,14 3.511,15 12.33,16 105.654,17 8.967,18 0.545,19 3.997,20 4.101,21 3.686,22 3.491,23 5.298,24 3.531,25 4.489,26 4.623,27 4.11,28 3.816,29 6.236,30 3.853,31 4.676,32 4.839,33 4.071,34 3.898,35 6.066,36 3.92,37 4.708,38 4.891,39 4.01,40 3.82,41 6.132,42 3.85,43 4.63,44 4.809,45 3.973,46 3.782,47 6.126,48 3.797,49 4.598,50 4.8,51 3.772,52 3.749,53 5.88,54 3.727,55 4.498,56 4.687,57 3.833,58 3.661,59 6.162,60 3.639,61 4.375,62 4.578,63 3.599,64 3.578,65 5.639,66 3.552,67 0.263,68 0.914,69 6.42,70 5.2}
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{0 CHEMBL1997534,2 17.871,3 26.224,4 0.046,5 20.996,6 5.527,7 283.338,8 12.491,9 51.337,11 6.116,12 1.569,13 11.793,14 5.159,15 26.61,16 118.525,17 7.799,18 0.656,19 4.045,20 4.155,21 3.697,22 3.664,23 5.153,24 3.612,25 4.555,26 4.716,27 4.092,28 4.061,29 5.609,30 3.988,31 4.722,32 4.886,33 4.167,34 4.173,35 5.785,36 4.079,37 4.856,38 5.049,39 4.051,40 4.207,41 5.872,42 4.073,43 4.842,44 5.059,45 4.001,46 4.146,47 5.84,48 4.001,49 4.787,50 4.991,51 4.004,52 4.081,53 5.832,54 3.945,55 4.709,56 4.927,57 3.858,58 3.988,59 5.76,60 3.853,61 4.635,62 4.869,63 3.676,64 3.865,65 5.603,66 3.728,67 0.052,68 0.737,69 10.579,70 5.5}
{0 CHEMBL1997597,2 8.618,3 21.476,4 0.097,5 5.975,6 3.808,7 185.566,8 7.373,9 82.628,11 6.089,12 1.758,13 9.5,14 2.517,15 6.335,16 89.807,17 8.327,18 0.667,19 3.757,20 3.869,21 3.593,22 3.353,23 4.875,24 3.309,25 4.258,26 4.395,27 3.839,28 3.728,29 5.625,30 3.672,31 4.487,32 4.67,33 3.804,34 3.813,35 5.69,36 3.734,37 4.494,38 4.697,39 3.654,40 3.757,41 5.676,42 3.653,43 4.39,44 4.614,45 3.484,46 3.639,47 5.504,48 3.519,49 4.247,50 4.468,51 3.332,52 3.478,53 5.332,54 3.364,55 4.126,56 4.385,57 3.225,58 3.292,59 5.125,60 3.157,61 3.943,62 4.195,63 3.128,64 3.097,65 5.045,66 2.967,67 0.133,68 0.622,69 9.678,70 5.1}
{0 CHEMBL1997617,1 1,2 28.063,3 42.109,4 0.006,5 34.175,6 6.66,7 387.675,8 17.334,9 74.616,11 6.128,12 1.424,13 14.75,14 4.738,15 22.449,16 145.54,17 6.896,18 0.537,19 4.347,20 4.48,21 3.869,22 3.878,23 5.338,24 3.847,25 4.925,26 5.119,27 4.239,28 4.308,29 5.835,30 4.254,31 5.227,32 5.456,33 4.304,34 4.497,35 6.048,36 4.4,37 5.329,38 5.584,39 4.256,40 4.546,41 6.114,42 4.411,43 5.352,44 5.63,45 4.209,46 4.538,47 6.098,48 4.392,49 5.274,50 5.538,51 4.172,52 4.467,53 6.076,54 4.331,55 5.218,56 5.491,57 4.053,58 4.363,59 6.021,60 4.222,61 5.119,62 5.399,63 3.952,64 4.262,65 5.901,66 4.11,67 0.064,68 1.077,69 15.969,70 5.4}
{0 CHEMBL1997764,1 1,2 11.833,3 17.481,4 0.034,5 15.343,6 4.422,7 212.711,8 7.594,9 51.582,11 5.762,12 1.508,13 11.462,14 3.319,15 11.016,16 99.795,17 7.986,18 0.759,19 3.876,20 3.982,21 3.51,22 3.475,23 5.059,24 3.467,25 4.345,26 4.479,27 3.846,28 3.845,29 5.508,30 3.82,31 4.537,32 4.705,33 3.879,34 3.932,35 5.676,36 3.884,37 4.569,38 4.759,39 3.776,40 3.88,41 5.707,42 3.816,43 4.549,44 4.767,45 3.695,46 3.803,47 5.657,48 3.727,49 4.424,50 4.642,51 3.628,52 3.705,53 5.531,54 3.635,55 4.318,56 4.527,57 3.532,58 3.589,59 5.466,60 3.531,61 4.229,62 4.437,63 3.37,64 3.47,65 5.378,66 3.414,67 0.029,68 0.599,69 7.426,70 5.8}
{0 CHEMBL1997822,1 1,2 8.74,3 21.91,4 0.099,5 6.455,6 4.457,7 232.651,8 11.807,9 66.468,11 6.371,12 1.666,13 10.767,14 4.336,15 18.797,16 124.154,17 8.849,18 0.765,19 4.013,20 4.1,21 3.897,22 3.738,23 5.119,24 3.665,25 4.52,26 4.635,27 4.221,28 4.148,29 5.805,30 4.073,31 4.732,32 4.87,33 4.261,34 4.267,35 5.919,36 4.174,37 4.824,38 4.993,39 4.297,40 4.3,41 5.937,42 4.177,43 4.791,44 4.975,45 4.171,46 4.248,47 5.852,48 4.102,49 4.712,50 4.896,51 4.201,52 4.164,53 5.805,54 4.028,55 4.663,56 4.844,57 4.181,58 4.067,59 5.865,60 3.952,61 4.581,62 4.775,63 3.888,64 3.937,65 5.715,66 3.816,67 0.084,68 0.689,69 10.087,70 5.1}
{0 CHEMBL1997839,2 19.644,3 22.775,4 0.029,5 26.508,6 5.429,7 339.395,8 10.44,9 3.124,11 6.183,12 1.431,13 9.8,14 5.062,15 25.625,16 115.671,17 7.833,18 0.545,19 4.029,20 4.12,21 3.636,22 3.636,23 5.219,24 3.619,25 4.52,26 4.651,27 4.007,28 4.013,29 5.713,30 3.985,31 4.765,32 4.92,33 4.146,34 4.166,35 5.947,36 4.134,37 4.854,38 5.013,39 4.166,40 4.196,41 6.177,42 4.152,43 4.87,44 5.038,45 4.122,46 4.241,47 6.02,48 4.177,49 4.914,50 5.099,51 4.153,52 4.234,53 6.072,54 4.177,55 4.912,56 5.081,57 4.107,58 4.177,59 6.166,60 4.13,61 4.857,62 5.031,63 3.902,64 4.078,65 6.075,66 4.003,67 0.037,68 0.629,69 9.082,70 5.3}
{0 CHEMBL1997846,1 1,2 11.088,3 25.604,4 0.024,5 19.407,6 4.085,7 227.486,8 7.553,9 85.153,11 5.528,12 1.549,13 9.217,14 3.953,15 15.629,16 91.288,17 7.996,18 0.615,19 3.831,20 3.961,21 3.471,22 3.403,23 4.864,24 3.377,25 4.385,26 4.563,27 3.861,28 3.816,29 5.405,30 3.758,31 4.668,32 4.919,33 3.834,34 3.902,35 5.539,36 3.801,37 4.606,38 4.872,39 3.817,40 3.793,41 5.538,42 3.694,43 4.452,44 4.698,45 3.729,46 3.718,47 5.415,48 3.624,49 4.357,50 4.561,51 3.826,52 3.709,53 5.39,54 3.618,55 4.337,56 4.546,57 3.648,58 3.65,59 5.352,60 3.522,61 4.2,62 4.419,63 3.335,64 3.501,65 5.105,66 3.354,67 0.02,68 0.652,69 7.805,70 5.5}
{0 CHEMBL1997872,1 1,2 8.912,3 20.14,4 0.004,5 9.739,6 3.757,7 224.482,8 7.724,9 36.695,11 5.99,12 1.539,13 9.348,14 1.652,15 2.73,16 87.525,17 7.684,18 0.615,19 3.812,20 3.923,21 3.421,22 3.37,23 4.903,24 3.363,25 4.353,26 4.51,27 3.765,28 3.767,29 5.412,30 3.74,31 4.566,32 4.763,33 3.772,34 3.872,35 5.603,36 3.807,37 4.553,38 4.763,39 3.637,40 3.803,41 5.633,42 3.722,43 4.458,44 4.67,45 3.565,46 3.717,47 5.56,48 3.632,49 4.359,50 4.568,51 3.491,52 3.665,53 5.361,54 3.572,55 4.372,56 4.606,57 3.37,58 3.553,59 5.367,60 3.452,61 4.164,62 4.394,63 3.188,64 3.356,65 5.104,66 3.253,67 0.021,68 0.591,69 7.646,70 5.1}
{0 CHEMBL1998112,2 19.544,3 18.518,4 0.006,5 28.736,6 5.273,7 235.482,8 7.893,9 85.765,11 6.24,12 1.641,13 10.241,14 2.934,15 8.608,16 106.952,17 8.114,18 0.688,19 4,20 4.11,21 3.637,22 3.506,23 5.222,24 3.525,25 4.473,26 4.62,27 3.988,28 3.864,29 5.69,30 3.872,31 4.623,32 4.777,33 4.069,34 3.983,35 5.816,36 3.981,37 4.717,38 4.885,39 4.067,40 4.009,41 5.932,42 3.988,43 4.813,44 5.025,45 3.972,46 4.009,47 5.914,48 3.964,49 4.74,50 4.955,51 4,52 4.006,53 5.853,54 3.958,55 4.722,56 4.93,57 3.979,58 3.997,59 5.836,60 3.951,61 4.66,62 4.856,63 3.861,64 3.885,65 5.867,66 3.826,67 0.094,68 0.733,69 8.389,70 5.1}
{0 CHEMBL1998121,2 15.022,3 26.06,4 0.085,5 19.461,6 5.286,7 244.695,8 8.264,9 84.234,11 5.883,12 1.735,13 9.417,14 3.026,15 9.154,16 96.248,17 9.082,18 0.615,19 3.799,20 3.919,21 3.521,22 3.4,23 4.976,24 3.375,25 4.288,26 4.433,27 3.91,28 3.806,29 5.431,30 3.751,31 4.567,32 4.757,33 4.084,34 3.934,35 5.703,36 3.843,37 4.595,38 4.809,39 3.85,40 3.84,41 5.725,42 3.752,43 4.556,44 4.766,45 3.808,46 3.767,47 5.794,48 3.684,49 4.522,50 4.729,51 3.868,52 3.772,53 5.742,54 3.679,55 4.45,56 4.655,57 3.83,58 3.742,59 5.688,60 3.619,61 4.338,62 4.559,63 3.602,64 3.638,65 5.402,66 3.493,67 0.101,68 0.592,69 5.96,70 5.6}
{0 CHEMBL1998159,2 15.472,3 21.889,4 0.044,5 15.035,6 5.839,7 211.109,8 10.599,9 99.794,11 6.117,12 1.733,13 12.903,14 3.432,15 11.781,16 110.539,17 8.382,18 0.647,19 4.057,20 4.174,21 3.705,22 3.578,23 5.267,24 3.593,25 4.589,26 4.742,27 4.137,28 3.955,29 6.177,30 3.963,31 4.774,32 4.956,33 4.102,34 4.067,35 6.008,36 4.036,37 4.902,38 5.139,39 4.002,40 4.018,41 6.067,42 3.968,43 4.748,44 4.964,45 3.949,46 3.932,47 5.941,48 3.888,49 4.782,50 5.017,51 3.852,52 3.876,53 5.942,54 3.831,55 4.685,56 4.915,57 3.857,58 3.781,59 6.001,60 3.747,61 4.636,62 4.87,63 3.717,64 3.683,65 5.989,66 3.638,67 0.177,68 0.991,69 8.327,70 7}
{0 CHEMBL1998165,2 19.84,3 30.79,4 0.029,5 23.133,6 7.341,7 177.617,8 9.065,9 56.647,11 5.862,12 1.969,13 10.48,14 3.232,15 10.443,16 95.422,17 11.631,18 0.462,19 3.806,20 3.915,21 3.73,22 3.353,23 5.106,24 3.334,25 4.29,26 4.44,27 4.156,28 3.706,29 5.619,30 3.662,31 4.533,32 4.714,33 4.295,34 3.806,35 6.09,36 3.744,37 4.51,38 4.707,39 4.288,40 3.665,41 5.953,42 3.649,43 4.463,44 4.648,45 4.056,46 3.562,47 5.995,48 3.603,49 4.402,50 4.544,51 4.118,52 3.633,53 6.182,54 3.645,55 4.439,56 4.612,57 4.169,58 3.634,59 6.164,60 3.589,61 4.362,62 4.573,63 4.331,64 3.572,65 5.734,66 3.427,67 0.241,68 0.785,69 1.362,70 5.1}
{0 CHEMBL1998193,2 20.284,3 27.475,4 -0.014,5 26.661,6 9.118,7 285.712,8 6.972,9 105.614,11 4.819,12 1.592,13 15,14 0.965,15 0.931,16 97.856,17 7.13,18 0.444,19 3.985,20 4.132,21 3.489,22 3.433,23 5.108,24 3.421,25 4.491,26 4.691,27 3.733,28 3.765,29 5.624,30 3.7,31 4.757,32 5.023,33 3.666,34 3.832,35 5.725,36 3.728,37 4.715,38 4.991,39 3.581,40 3.709,41 5.727,42 3.614,43 4.635,44 4.893,45 3.554,46 3.632,47 5.783,48 3.555,49 4.563,50 4.823,51 3.413,52 3.613,53 5.567,54 3.509,55 4.544,56 4.817,57 3.28,58 3.598,59 5.464,60 3.463,61 4.478,62 4.751,63 3.223,64 3.551,65 5.362,66 3.408,67 0.056,68 0.761,69 10.849,70 5.1}
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{0 CHEMBL1998551,2 16.133,3 23.84,4 0.006,5 16.328,6 3.973,7 242.792,8 7.401,9 69.838,11 6.293,12 1.746,13 9.345,14 3.55,15 12.6,16 104.045,17 8.435,18 0.636,19 4.003,20 4.12,21 3.674,22 3.519,23 5.202,24 3.538,25 4.547,26 4.709,27 4.126,28 3.934,29 5.761,30 3.956,31 4.802,32 4.995,33 4.163,34 4.017,35 6.067,36 4.022,37 4.817,38 5.049,39 4.166,40 3.985,41 6.166,42 3.993,43 4.673,44 4.858,45 4.075,46 3.996,47 5.856,48 3.99,49 4.724,50 4.899,51 4.102,52 4.053,53 5.948,54 4.024,55 4.856,56 5.082,57 4.033,58 4.021,59 6.017,60 3.969,61 4.752,62 4.998,63 3.909,64 3.854,65 5.932,66 3.817,67 0.168,68 0.914,69 7.637,70 5.1}
{0 CHEMBL1998585,2 19.296,3 11.47,4 0.095,5 24.778,6 5.61,7 131.085,8 9.179,9 102.49,11 6.055,12 1.956,13 12.806,14 4.124,15 17.008,16 110.765,17 10.169,18 0.647,19 3.943,20 4.042,21 3.776,22 3.527,23 5.283,24 3.546,25 4.432,26 4.545,27 4.24,28 3.904,29 6.223,30 3.916,31 4.605,32 4.751,33 4.22,34 3.988,35 6.047,36 3.99,37 4.709,38 4.886,39 4.214,40 3.953,41 6.162,42 3.949,43 4.651,44 4.836,45 4.079,46 3.834,47 6.192,48 3.814,49 4.51,50 4.703,51 3.936,52 3.648,53 6.247,54 3.659,55 4.334,56 4.517,57 3.813,58 3.537,59 6.082,60 3.537,61 4.259,62 4.46,63 3.626,64 3.497,65 5.619,66 3.466,67 0.296,68 1.006,69 3.975,70 5.5}
{0 CHEMBL1998611,2 9.232,3 24.763,4 0.22,5 8.379,6 2.919,7 87.836,8 4.881,9 111.748,11 5.604,12 2.2,13 5.067,14 2.652,15 7.031,16 66.929,17 14.552,18 0.625,19 3.198,20 3.276,21 3.373,22 2.98,23 4.51,24 2.907,25 3.606,26 3.671,27 3.891,28 3.417,29 4.989,30 3.306,31 3.796,32 3.857,33 4.29,34 3.542,35 5.169,36 3.396,37 3.781,38 3.855,39 4.077,40 3.424,41 5.305,42 3.259,43 3.587,44 3.736,45 3.882,46 2.959,47 5.005,48 2.811,49 3.339,50 3.527,51 3.463,52 2.471,53 5.01,54 2.384,55 2.761,56 3.001,57 1.22,58 1.774,59 3.844,60 1.44,61 1.515,62 1.922,63 0.028,64 0.457,65 1.609,66 0.245,67 0.105,68 0.293,69 3.266,70 5.4}
{0 CHEMBL1998829,1 1,2 9.121,3 17.381,4 0.052,5 11.333,6 4.162,7 205.547,8 6.889,9 51.582,11 5.762,12 1.58,13 10.72,14 4,15 15.998,16 98.136,17 8.918,18 0.786,19 3.785,20 3.886,21 3.511,22 3.45,23 4.98,24 3.431,25 4.242,26 4.36,27 3.886,28 3.836,29 5.448,30 3.797,31 4.482,32 4.65,33 3.905,34 3.913,35 5.643,36 3.846,37 4.463,38 4.652,39 3.758,40 3.801,41 5.632,42 3.736,43 4.389,44 4.586,45 3.692,46 3.707,47 5.569,48 3.648,49 4.306,50 4.503,51 3.699,52 3.651,53 5.496,54 3.59,55 4.243,56 4.457,57 3.503,58 3.557,59 5.367,60 3.478,61 4.087,62 4.292,63 3.422,64 3.437,65 5.222,66 3.357,67 0.036,68 0.525,69 5.293,70 5.5}
{0 CHEMBL1999112,2 18.873,3 19.545,4 0.026,5 19.083,6 5.309,7 233.329,8 8.644,9 67.081,11 6.19,12 1.791,13 8.759,14 2.179,15 4.747,16 105.915,17 9.306,18 0.313,19 3.932,20 4.003,21 3.716,22 3.511,23 5.223,24 3.518,25 4.423,26 4.521,27 4.132,28 3.898,29 5.687,30 3.89,31 4.595,32 4.721,33 4.217,34 4.002,35 5.83,36 3.983,37 4.674,38 4.768,39 4.442,40 4.089,41 6.154,42 4.099,43 4.77,44 4.859,45 4.477,46 4.142,47 6.314,48 4.145,49 4.772,50 4.88,51 4.358,52 4.067,53 6.444,54 4.064,55 4.742,56 4.909,57 3.902,58 3.944,59 6.002,60 3.89,61 4.613,62 4.785,63 3.723,64 3.774,65 5.939,66 3.722,67 0.166,68 0.619,69 5.724,70 5.1}
{0 CHEMBL1999126,2 19.468,3 17.643,4 0.018,5 21.615,6 4.357,7 256.166,8 8.458,9 68.184,11 6.414,12 1.561,13 10.806,14 4.642,15 21.552,16 116.302,17 8.489,18 0.6,19 4.003,20 4.102,21 3.688,22 3.616,23 5.255,24 3.617,25 4.482,26 4.617,27 4.096,28 4.008,29 5.668,30 4.003,31 4.7,32 4.851,33 4.228,34 4.134,35 5.968,36 4.135,37 4.814,38 4.98,39 4.225,40 4.167,41 6.141,42 4.155,43 4.808,44 4.978,45 4.158,46 4.133,47 6.149,48 4.121,49 4.774,50 4.928,51 4.142,52 4.12,53 6.223,54 4.084,55 4.794,56 4.998,57 3.905,58 4.034,59 6.003,60 3.964,61 4.697,62 4.941,63 3.851,64 3.897,65 5.933,66 3.818,67 0.076,68 0.706,69 7.079,70 5.1}
{0 CHEMBL1999321,2 22.114,3 22.206,4 0.031,5 30.939,6 5.686,7 261.398,8 8.619,9 52.807,11 5.41,12 1.538,13 14,14 2.579,15 6.652,16 112.669,17 8.03,18 0.563,19 3.979,20 4.081,21 3.61,22 3.57,23 5.169,24 3.563,25 4.433,26 4.57,27 3.9,28 3.88,29 5.61,30 3.859,31 4.679,32 4.87,33 3.908,34 3.94,35 5.898,36 3.886,37 4.635,38 4.843,39 3.742,40 3.883,41 5.697,42 3.799,43 4.601,44 4.807,45 3.766,46 3.886,47 5.701,48 3.816,49 4.599,50 4.789,51 3.759,52 3.854,53 5.788,54 3.797,55 4.533,56 4.731,57 3.66,58 3.754,59 5.754,60 3.686,61 4.395,62 4.598,63 3.487,64 3.619,65 5.57,66 3.54,67 0.046,68 0.662,69 8.16,70 5.1}
{0 CHEMBL1999428,2 8.707,3 19.221,4 0.03,5 12.096,6 4.606,7 225.254,8 8.273,9 34.796,11 5.899,12 1.37,13 10.783,14 3.367,15 11.336,16 91.545,17 7.376,18 0.72,19 3.786,20 3.901,21 3.351,22 3.423,23 4.921,24 3.382,25 4.26,26 4.415,27 3.654,28 3.78,29 5.359,30 3.714,31 4.519,32 4.722,33 3.688,34 3.896,35 5.551,36 3.801,37 4.554,38 4.767,39 3.582,40 3.833,41 5.631,42 3.721,43 4.548,44 4.792,45 3.467,46 3.755,47 5.583,48 3.63,49 4.393,50 4.642,51 3.333,52 3.619,53 5.395,54 3.491,55 4.201,56 4.436,57 3.231,58 3.455,59 5.271,60 3.347,61 4.052,62 4.271,63 3.085,64 3.323,65 5.134,66 3.217,67 0.028,68 0.534,69 7.877,70 5.1}
{0 CHEMBL1999496,2 21.736,3 22.763,4 0.046,5 33.345,6 4.18,7 272.338,8 11.497,9 34.796,11 5.68,12 1.332,13 8.962,14 4.052,15 16.422,16 103.679,17 7.135,18 0.621,19 3.948,20 4.065,21 3.492,22 3.589,23 5.022,24 3.54,25 4.442,26 4.607,27 3.808,28 3.96,29 5.451,30 3.885,31 4.689,32 4.871,33 3.893,34 4.117,35 5.672,36 4.022,37 4.827,38 5.05,39 3.866,40 4.152,41 5.759,42 4.03,43 4.838,44 5.055,45 3.952,46 4.167,47 5.854,48 4.064,49 4.88,50 5.093,51 3.881,52 4.158,53 5.93,54 4.039,55 4.864,56 5.125,57 3.757,58 4.068,59 5.814,60 3.927,61 4.718,62 4.969,63 3.504,64 3.929,65 5.684,66 3.778,67 0.038,68 0.632,69 9.823,70 5.1}
{0 CHEMBL1999590,2 13.843,3 16.425,4 -0.021,5 13.388,6 4.585,7 186.074,8 5.652,9 86.562,11 5.364,12 1.578,13 10.885,14 4.298,15 18.469,16 102.142,17 8.2,18 0.759,19 3.871,20 3.99,21 3.534,22 3.41,23 5.078,24 3.419,25 4.319,26 4.474,27 3.849,28 3.737,29 5.489,30 3.738,31 4.456,32 4.655,33 3.773,34 3.755,35 5.55,36 3.722,37 4.444,38 4.663,39 3.77,40 3.731,41 5.509,42 3.695,43 4.439,44 4.647,45 3.784,46 3.763,47 5.544,48 3.732,49 4.463,50 4.663,51 3.725,52 3.782,53 5.559,54 3.724,55 4.491,56 4.73,57 3.587,58 3.689,59 5.499,60 3.609,61 4.36,62 4.62,63 3.381,64 3.481,65 5.369,66 3.399,67 0.083,68 0.683,69 7.009,70 5.1}
{0 CHEMBL1999714,2 17.388,3 13.335,4 0.068,5 29.596,6 2.286,7 142.856,8 5.789,9 36.022,11 5.186,12 1.468,13 6.294,14 2.821,15 7.958,16 66.782,17 7.734,18 0.632,19 3.483,20 3.599,21 3.093,22 3.102,23 4.625,24 3.081,25 3.959,26 4.103,27 3.461,28 3.483,29 5.098,30 3.444,31 4.25,32 4.42,33 3.606,34 3.645,35 5.381,36 3.598,37 4.315,38 4.537,39 3.441,40 3.536,41 5.46,42 3.464,43 4.149,44 4.38,45 3.149,46 3.357,47 5.253,48 3.265,49 3.817,50 4.05,51 2.709,52 3.044,53 4.88,54 2.914,55 3.582,56 3.844,57 2.083,58 2.698,59 4.5,60 2.495,61 2.93,62 3.21,63 1.397,64 2.115,65 3.62,66 1.873,67 0.021,68 0.411,69 5.343,70 5.1}
{0 CHEMBL1999718,2 19.502,3 9.618,4 0.03,5 24.828,6 4.644,7 119.314,8 6.066,9 100.652,11 5.566,12 1.862,13 11.615,14 2.919,15 8.52,16 86.281,17 9.926,18 0.607,19 3.734,20 3.834,21 3.51,22 3.279,23 5.123,24 3.332,25 4.22,26 4.341,27 3.957,28 3.626,29 6.093,30 3.674,31 4.399,32 4.558,33 3.923,34 3.72,35 5.85,36 3.753,37 4.463,38 4.654,39 3.856,40 3.607,41 5.995,42 3.648,43 4.345,44 4.541,45 3.75,46 3.444,47 5.91,48 3.499,49 4.168,50 4.343,51 3.635,52 3.313,53 5.723,54 3.376,55 4.094,56 4.279,57 3.563,58 3.259,59 5.699,60 3.316,61 4.003,62 4.185,63 3.411,64 3.232,65 5.584,66 3.256,67 0.243,68 0.798,69 3,70 5.1}
{0 CHEMBL1999811,2 13.263,3 10.725,4 0.08,5 15.16,6 4.573,7 192.909,8 5.513,9 82.514,11 5.335,12 1.919,13 10.522,14 2.185,15 4.773,16 86.831,17 9.687,18 0.64,19 3.69,20 3.782,21 3.514,22 3.221,23 5.039,24 3.246,25 4.074,26 4.184,27 3.8,28 3.567,29 5.467,30 3.568,31 4.291,32 4.442,33 3.789,34 3.589,35 5.666,36 3.58,37 4.301,38 4.49,39 3.735,40 3.469,41 5.698,42 3.434,43 4.129,44 4.326,45 3.436,46 3.219,47 5.501,48 3.2,49 3.928,50 4.106,51 3.483,52 3.042,53 5.425,54 3.088,55 3.819,56 3.993,57 3.277,58 3.011,59 5.36,60 3.006,61 3.704,62 3.869,63 3.088,64 3.01,65 4.989,66 2.986,67 0.202,68 0.57,69 4.937,70 5.1}
{0 CHEMBL1999931,2 15.901,3 19.911,4 0.041,5 24.25,6 4.837,7 213.483,8 7.906,9 86.317,11 6.015,12 1.531,13 12.933,14 4.233,15 17.918,16 116.156,17 8.218,18 0.794,19 4.003,20 4.122,21 3.667,22 3.599,23 5.195,24 3.593,25 4.468,26 4.61,27 4.008,28 3.981,29 5.626,30 3.957,31 4.685,32 4.876,33 3.986,34 4.037,35 5.79,36 3.983,37 4.723,38 4.947,39 3.926,40 3.936,41 5.842,42 3.889,43 4.608,44 4.826,45 3.901,46 3.841,47 5.786,48 3.822,49 4.51,50 4.71,51 3.863,52 3.829,53 5.665,54 3.802,55 4.501,56 4.713,57 3.793,58 3.818,59 5.618,60 3.769,61 4.408,62 4.61,63 3.63,64 3.777,65 5.495,66 3.699,67 0.104,68 0.765,69 7.871,70 5.6}
{0 CHEMBL2000071,1 1,2 8.984,3 17.649,4 0.044,5 14.205,6 3.836,7 195.708,8 5.667,9 68.367,11 5.203,12 1.542,13 8.35,14 1.793,15 3.216,16 80.595,17 7.454,18 0.727,19 3.696,20 3.825,21 3.261,22 3.221,23 4.826,24 3.21,25 4.183,26 4.357,27 3.56,28 3.597,29 5.257,30 3.552,31 4.391,32 4.622,33 3.572,34 3.664,35 5.343,36 3.592,37 4.358,38 4.583,39 3.562,40 3.624,41 5.392,42 3.557,43 4.351,44 4.581,45 3.461,46 3.6,47 5.326,48 3.52,49 4.329,50 4.571,51 3.374,52 3.521,53 5.342,54 3.432,55 4.234,56 4.487,57 3.115,58 3.367,59 5.197,60 3.248,61 4.085,62 4.359,63 2.764,64 3.109,65 5.095,66 2.944,67 0.041,68 0.56,69 7.411,70 6}
{0 CHEMBL2000114,1 1,2 11.313,3 16.293,4 0.033,5 16.481,6 3.905,7 172.165,8 4.22,9 68.367,11 5.108,12 1.756,13 7.125,14 0.817,15 0.667,16 68.365,17 7.945,18 0.588,19 3.513,20 3.644,21 3.188,22 3.025,23 4.625,24 2.977,25 4.007,26 4.197,27 3.446,28 3.377,29 5.048,30 3.288,31 4.127,32 4.353,33 3.504,34 3.399,35 5.095,36 3.304,37 4.112,38 4.331,39 3.482,40 3.348,41 5.171,42 3.255,43 4.103,44 4.354,45 3.14,46 3.29,47 5.001,48 3.133,49 4.004,50 4.266,51 2.91,52 3.14,53 4.95,54 2.969,55 3.821,56 4.071,57 2.693,58 2.945,59 4.736,60 2.749,61 3.691,62 3.984,63 2.49,64 2.557,65 4.758,66 2.348,67 0.06,68 0.487,69 6.762,70 5.2}
{0 CHEMBL2000335,2 18.168,3 18.598,4 0.076,5 24.827,6 5.074,7 201.711,8 9.943,9 102.49,11 5.857,12 1.628,13 12.536,14 3.949,15 15.592,16 114.657,17 8.288,18 0.71,19 3.959,20 4.078,21 3.659,22 3.585,23 5.137,24 3.546,25 4.425,26 4.577,27 4.035,28 3.967,29 5.596,30 3.906,31 4.612,32 4.775,33 4.052,34 4.076,35 5.731,36 4,37 4.736,38 4.94,39 4.036,40 4.068,41 5.845,42 3.955,43 4.739,44 4.987,45 3.81,46 3.921,47 5.804,48 3.794,49 4.462,50 4.689,51 3.651,52 3.7,53 5.591,54 3.62,55 4.344,56 4.562,57 3.515,58 3.609,59 5.443,60 3.526,61 4.289,62 4.514,63 3.436,64 3.57,65 5.354,66 3.456,67 0.044,68 0.724,69 8.553,70 5.1}
{0 CHEMBL2000354,2 14.539,3 16.614,4 0.051,5 15.157,6 4.695,7 220.081,8 6.546,9 34.796,11 5.493,12 1.708,13 10.652,14 3.496,15 12.219,16 91.11,17 8.822,18 0.48,19 3.732,20 3.814,21 3.483,22 3.353,23 4.974,24 3.326,25 4.172,26 4.283,27 3.866,28 3.692,29 5.42,30 3.649,31 4.333,32 4.473,33 3.83,34 3.719,35 5.611,36 3.659,37 4.295,38 4.466,39 3.711,40 3.645,41 5.502,42 3.551,43 4.266,44 4.436,45 3.683,46 3.644,47 5.441,48 3.526,49 4.22,50 4.408,51 3.628,52 3.515,53 5.425,54 3.433,55 4.017,56 4.163,57 3.424,58 3.264,59 5.483,60 3.238,61 3.876,62 4.052,63 3.192,64 3.129,65 5.208,66 3.071,67 0.08,68 0.499,69 5.92,70 5.6}
{0 CHEMBL2000393,2 27.218,3 18.703,4 -0.023,5 37.083,6 4.035,7 189.169,8 7.75,9 73.391,11 6.538,12 1.824,13 10.29,14 3.366,15 11.33,16 105.914,17 9.342,18 0.611,19 3.998,20 4.095,21 3.754,22 3.525,23 5.244,24 3.574,25 4.533,26 4.663,27 4.19,28 3.947,29 5.823,30 3.988,31 4.774,32 4.939,33 4.272,34 4.051,35 6.064,36 4.085,37 4.799,38 4.977,39 4.238,40 4.036,41 6.082,42 4.062,43 4.778,44 4.953,45 4.191,46 3.997,47 6.126,48 4.02,49 4.742,50 4.939,51 4.119,52 3.913,53 6.091,54 3.933,55 4.582,56 4.767,57 4.03,58 3.798,59 6.015,60 3.824,61 4.481,62 4.672,63 3.831,64 3.677,65 5.792,66 3.686,67 0.213,68 0.893,69 5.047,70 5.4}
{0 CHEMBL2000408,2 17.09,3 26.637,4 -0.003,5 20.604,6 5.83,7 301.648,8 10.517,9 86.439,10 1,11 6.373,12 1.672,13 10.813,14 4.069,15 16.557,16 118.112,17 7.831,18 0.629,19 4.133,20 4.258,21 3.731,22 3.638,23 5.318,24 3.639,25 4.659,26 4.844,27 4.139,28 4.026,29 5.829,30 4.021,31 4.896,32 5.084,33 4.236,34 4.175,35 6.102,36 4.152,37 5.093,38 5.355,39 4.222,40 4.187,41 6.304,42 4.149,43 4.897,44 5.105,45 4.221,46 4.199,47 6.008,48 4.159,49 4.968,50 5.186,51 4.296,52 4.226,53 6.221,54 4.201,55 4.959,56 5.154,57 4.225,58 4.226,59 6.2,60 4.183,61 5.01,62 5.251,63 4.041,64 4.117,65 6.197,66 4.026,67 0.104,68 1.007,69 10.538,70 5.1}
{0 CHEMBL2000429,2 18.709,3 30.728,4 -0.018,5 24.331,6 6.785,7 336.19,8 10.945,9 86.439,10 1,11 6.39,12 1.711,13 11.029,14 4.753,15 22.589,16 124.872,17 7.809,18 0.595,19 4.203,20 4.324,21 3.797,22 3.681,23 5.386,24 3.689,25 4.735,26 4.915,27 4.196,28 4.06,29 5.912,30 4.062,31 4.983,32 5.173,33 4.284,34 4.205,35 6.171,36 4.186,37 5.131,38 5.388,39 4.297,40 4.204,41 6.347,42 4.179,43 4.947,44 5.154,45 4.321,46 4.221,47 6.092,48 4.213,49 5.031,50 5.227,51 4.39,52 4.296,53 6.311,54 4.286,55 5.068,56 5.265,57 4.314,58 4.288,59 6.297,60 4.246,61 5.031,62 5.254,63 4.182,64 4.177,65 6.223,66 4.118,67 0.132,68 1.047,69 11.47,70 5.1}
{0 CHEMBL2000481,2 17.323,3 29.861,4 0.089,5 16.035,6 6.562,7 282.94,8 10.789,9 101.864,11 6.064,12 1.757,13 14.03,14 1.56,15 2.432,16 123.931,17 8.584,18 0.5,19 4.106,20 4.209,21 3.907,22 3.701,23 5.292,24 3.678,25 4.599,26 4.726,27 4.201,28 4.08,29 5.988,30 4.041,31 4.869,32 5.041,33 4.292,34 4.215,35 6.148,36 4.16,37 4.913,38 5.09,39 4.251,40 4.155,41 6.226,42 4.116,43 4.856,44 5.028,45 4.181,46 4.102,47 6.227,48 4.064,49 4.808,50 4.992,51 3.995,52 4.049,53 6.227,54 3.971,55 4.712,56 4.935,57 3.827,58 3.94,59 5.823,60 3.83,61 4.585,62 4.806,63 3.787,64 3.767,65 5.79,66 3.681,67 0.175,68 0.848,69 11.359,70 5.1}
{0 CHEMBL2000508,2 1.628,3 11.445,4 0.001,5 0.662,6 2.954,7 117.711,8 4.794,9 34.858,11 5.725,12 1.665,13 7.714,14 3.905,15 15.249,16 81.269,17 9.528,18 0.875,19 3.588,20 3.676,21 3.432,22 3.288,23 4.804,24 3.257,25 4.048,26 4.162,27 3.817,28 3.652,29 5.272,30 3.619,31 4.201,32 4.366,33 3.728,34 3.685,35 5.379,36 3.628,37 4.156,38 4.329,39 3.661,40 3.63,41 5.281,42 3.574,43 4.178,44 4.342,45 3.785,46 3.732,47 5.272,48 3.648,49 4.219,50 4.378,51 3.711,52 3.733,53 5.381,54 3.592,55 4.107,56 4.324,57 3.322,58 3.409,59 5.196,60 3.245,61 3.739,62 4.023,63 2.831,64 2.72,65 4.925,66 2.621,67 0.035,68 0.507,69 3.543,70 5.1}
{0 CHEMBL2000568,1 1,2 2.428,3 12.214,4 0.039,5 1.842,6 2.543,7 154.627,8 5.203,9 33.571,11 5.808,12 1.453,13 7.222,14 2.291,15 5.247,16 70.479,17 7.876,18 0.8,19 3.509,20 3.617,21 3.136,22 3.152,23 4.679,24 3.129,25 3.977,26 4.122,27 3.481,28 3.525,29 5.124,30 3.486,31 4.166,32 4.335,33 3.452,34 3.581,35 5.328,36 3.514,37 4.14,38 4.338,39 3.269,40 3.492,41 5.228,42 3.397,43 4.071,44 4.308,45 3.117,46 3.353,47 5.069,48 3.242,49 3.862,50 4.067,51 3.018,52 3.187,53 4.964,54 3.097,55 3.789,56 4.014,57 2.806,58 2.992,59 4.934,60 2.89,61 3.567,62 3.845,63 2.44,64 2.658,65 4.55,66 2.539,67 0.012,68 0.406,69 5.169,70 5.1}
{0 CHEMBL2000801,2 16.455,3 15.102,4 0.052,5 24.048,6 5.442,7 154.627,8 9.333,9 50.998,11 5.783,12 1.866,13 12.267,14 5.401,15 29.173,16 108.031,17 10.033,18 0.667,19 3.908,20 3.996,21 3.747,22 3.532,23 5.215,24 3.54,25 4.405,26 4.51,27 4.191,28 3.918,29 6.18,30 3.913,31 4.598,32 4.748,33 4.136,34 3.996,35 5.957,36 3.976,37 4.689,38 4.865,39 4.178,40 3.926,41 6.39,42 3.92,43 4.59,44 4.78,45 3.974,46 3.812,47 6.036,48 3.78,49 4.48,50 4.684,51 3.764,52 3.685,53 5.785,54 3.634,55 4.272,56 4.45,57 3.768,58 3.504,59 6.115,60 3.47,61 4.131,62 4.321,63 3.539,64 3.403,65 5.453,66 3.388,67 0.236,68 0.925,69 4.182,70 5.5}
{0 CHEMBL2000832,2 29.411,3 24.836,4 0.071,5 42.298,6 6.529,7 315.853,8 12.159,9 54.032,11 6.17,12 1.626,13 14.472,14 4.567,15 20.853,16 133.341,17 8.337,18 0.6,19 4.183,20 4.28,21 3.832,22 3.763,23 5.421,24 3.768,25 4.662,26 4.785,27 4.209,28 4.15,29 5.92,30 4.142,31 4.952,32 5.1,33 4.363,34 4.324,35 6.225,36 4.305,37 5.047,38 5.23,39 4.268,40 4.293,41 6.285,42 4.253,43 5.02,44 5.228,45 4.165,46 4.247,47 6.213,48 4.185,49 4.887,50 5.085,51 4.109,52 4.151,53 6.076,54 4.102,55 4.826,56 4.997,57 4.134,58 4.105,59 6.242,60 4.072,61 4.807,62 5.003,63 4.021,64 4.057,65 6.005,66 4.007,67 0.133,68 0.86,69 9.346,70 5.1}
{0 CHEMBL2000894,2 19.707,3 18.675,4 0.083,5 26.716,6 4.888,7 257.769,8 9.504,9 70.573,11 6.183,12 1.599,13 9.379,14 2.218,15 4.918,16 110.303,17 8.222,18 0.563,19 3.97,20 4.079,21 3.609,22 3.547,23 5.238,24 3.548,25 4.423,26 4.558,27 3.977,28 3.938,29 5.654,30 3.927,31 4.683,32 4.827,33 4.129,34 4.111,35 5.964,36 4.089,37 4.804,38 4.97,39 4.124,40 4.147,41 6.128,42 4.104,43 4.832,44 5.016,45 4.09,46 4.177,47 6.031,48 4.115,49 4.846,50 5.048,51 4.091,52 4.146,53 6.018,54 4.094,55 4.8,56 4.977,57 4.049,58 4.069,59 6.107,60 4.029,61 4.781,62 4.982,63 3.82,64 3.913,65 6.067,66 3.853,67 0.113,68 0.692,69 7.854,70 5.2}
{0 CHEMBL2001224,2 22.43,3 25.341,4 -0.001,5 30.145,6 5.924,7 263.631,8 7.897,9 100.652,10 1,11 5.549,12 1.738,13 11,14 3.605,15 12.992,16 96.578,17 8.451,18 0.429,19 3.891,20 4.004,21 3.555,22 3.427,23 5.074,24 3.423,25 4.418,26 4.579,27 3.922,28 3.801,29 5.571,30 3.769,31 4.685,32 4.89,33 3.964,34 3.877,35 5.826,36 3.817,37 4.604,38 4.822,39 3.859,40 3.756,41 5.791,42 3.699,43 4.465,44 4.635,45 3.878,46 3.721,47 5.758,48 3.693,49 4.533,50 4.725,51 3.885,52 3.81,53 5.696,54 3.75,55 4.645,56 4.871,57 3.838,58 3.854,59 5.723,60 3.751,61 4.635,62 4.871,63 3.787,64 3.719,65 5.87,66 3.613,67 0.081,68 0.664,69 7.287,70 5.1}
{0 CHEMBL2001239,2 23.318,3 15.922,4 0.077,5 34.589,6 6.416,7 212.917,8 8.158,9 119.275,11 5.757,12 2.036,13 9.7,14 3.922,15 15.383,16 106.195,17 9.973,18 0.563,19 3.935,20 4.043,21 3.7,22 3.419,23 5.288,24 3.471,25 4.416,26 4.55,27 4.16,28 3.781,29 6.218,30 3.82,31 4.608,32 4.758,33 4.167,34 3.911,35 6.263,36 3.912,37 4.658,38 4.835,39 3.993,40 3.894,41 5.968,42 3.87,43 4.701,44 4.903,45 4.019,46 3.899,47 6.009,48 3.895,49 4.678,50 4.851,51 4.149,52 3.915,53 6.091,54 3.926,55 4.77,56 4.965,57 4.25,58 3.874,59 6.403,60 3.898,61 4.66,62 4.861,63 4.15,64 3.755,65 6.156,66 3.796,67 0.352,68 0.9,69 4.487,70 5.1}
{0 CHEMBL2001257,2 27.434,3 31.079,4 0.045,5 33.376,6 8.147,7 319.422,8 14.053,9 88.829,11 5.63,12 1.514,13 15.314,14 5.393,15 29.082,16 147.412,17 7.558,18 0.579,19 4.234,20 4.362,21 3.847,22 3.839,23 5.344,24 3.785,25 4.732,26 4.914,27 4.186,28 4.213,29 5.799,30 4.131,31 4.934,32 5.134,33 4.257,34 4.349,35 5.96,36 4.249,37 5.027,38 5.245,39 4.284,40 4.375,41 6.067,42 4.249,43 5.038,44 5.281,45 4.123,46 4.287,47 6.073,48 4.148,49 4.858,50 5.086,51 4.056,52 4.157,53 5.916,54 4.049,55 4.757,56 4.945,57 4.033,58 4.154,59 5.807,60 4.049,61 4.845,62 5.064,63 4.03,64 4.207,65 5.818,66 4.059,67 0.061,68 0.94,69 13.426,70 5.3}
{0 CHEMBL2001288,2 14.107,3 13.882,4 0.078,5 18.574,6 3.713,7 221.448,8 6.529,9 84.908,11 5.963,12 2.005,13 7.15,14 -0.787,15 0.619,16 77.403,17 12.287,18 0.455,19 3.658,20 3.759,21 3.612,22 3.107,23 4.917,24 3.118,25 4.183,26 4.307,27 4.141,28 3.527,29 5.415,30 3.53,31 4.455,32 4.608,33 4.358,34 3.659,35 5.869,36 3.621,37 4.469,38 4.654,39 4.456,40 3.639,41 5.843,42 3.57,43 4.354,44 4.56,45 4.219,46 3.585,47 5.673,48 3.433,49 4.105,50 4.283,51 4.14,52 3.431,53 5.463,54 3.281,55 3.963,56 4.146,57 3.858,58 3.221,59 5.363,60 3.044,61 3.722,62 3.949,63 3.332,64 2.8,65 5.092,66 2.576,67 0.275,68 0.51,69 1.598,70 5.1}
{0 CHEMBL2001485,2 26.913,3 30.92,4 0.035,5 34.714,6 7.687,7 344.567,8 14.883,9 107.268,11 6.319,12 1.625,13 16.692,14 4.056,15 16.452,16 156.799,17 7.937,18 0.628,19 4.319,20 4.444,21 3.971,22 3.896,23 5.475,24 3.863,25 4.818,26 4.991,27 4.349,28 4.294,29 5.935,30 4.243,31 5.027,32 5.199,33 4.43,34 4.439,35 6.17,36 4.368,37 5.188,38 5.393,39 4.486,40 4.482,41 6.339,42 4.389,43 5.161,44 5.383,45 4.377,46 4.417,47 6.25,48 4.311,49 5.043,50 5.276,51 4.208,52 4.306,53 6.087,54 4.212,55 4.945,56 5.159,57 4.188,58 4.279,59 5.996,60 4.173,61 4.964,62 5.181,63 4.194,64 4.251,65 6.052,66 4.146,67 0.074,68 1.065,69 13.235,70 5.1}
{0 CHEMBL2001547,2 16.265,3 26.797,4 -0.003,5 17.95,6 5.593,7 278.105,8 8.848,9 86.439,10 1,11 6.384,12 1.695,13 10.129,14 4.122,15 16.988,16 113.578,17 8.009,18 0.647,19 4.086,20 4.208,21 3.703,22 3.59,23 5.284,24 3.598,25 4.605,26 4.783,27 4.113,28 3.966,29 5.826,30 3.971,31 4.86,32 5.054,33 4.175,34 4.091,35 6.101,36 4.078,37 4.93,38 5.179,39 4.189,40 4.094,41 6.177,42 4.075,43 4.811,44 5.007,45 4.204,46 4.131,47 6.008,48 4.111,49 4.88,50 5.078,51 4.242,52 4.177,53 6.136,54 4.155,55 4.913,56 5.11,57 4.187,58 4.163,59 6.159,60 4.124,61 4.943,62 5.183,63 3.993,64 4.045,65 6.157,66 3.965,67 0.118,68 0.969,69 9.554,70 5.1}
{0 CHEMBL2001646,1 1,2 24.325,3 34.14,4 0.046,5 34.892,6 7.368,7 408.419,8 15.385,9 19.91,11 6.505,12 1.365,13 12.85,14 8.383,15 70.273,16 159.209,17 7.524,18 0.733,19 4.341,20 4.444,21 3.926,22 3.971,23 5.461,24 3.94,25 4.843,26 4.982,27 4.287,28 4.364,29 5.963,30 4.315,31 5.111,32 5.296,33 4.399,34 4.516,35 6.107,36 4.447,37 5.197,38 5.38,39 4.441,40 4.563,41 6.23,42 4.491,43 5.276,44 5.462,45 4.457,46 4.621,47 6.311,48 4.542,49 5.372,50 5.572,51 4.509,52 4.652,53 6.437,54 4.572,55 5.402,56 5.614,57 4.434,58 4.629,59 6.491,60 4.533,61 5.348,62 5.573,63 4.35,64 4.588,65 6.367,66 4.479,67 0.05,68 0.879,69 13.434,70 5.8}
{0 CHEMBL2001668,2 8.668,3 19.347,5 10.187,6 2.662,7 107.543,8 5.522,9 36.695,11 5.491,12 1.773,13 6.529,14 2.028,15 4.112,16 72.116,17 13.485,18 0.579,19 3.372,20 3.471,21 3.458,22 3.081,23 4.579,24 3.027,25 3.831,26 3.953,27 3.938,28 3.496,29 5.078,30 3.402,31 4.017,32 4.179,33 4.19,34 3.539,35 5.238,36 3.431,37 3.912,38 4.085,39 4.024,40 3.479,41 5.188,42 3.29,43 3.651,44 3.848,45 3.737,46 3.163,47 4.762,48 3.001,49 3.45,50 3.618,51 3.596,52 3.083,53 4.639,54 2.907,55 3.432,56 3.596,57 3.537,58 3.042,59 4.689,60 2.765,61 3.143,62 3.374,63 2.888,64 2.556,65 4.26,66 2.202,67 0.039,68 0.376,69 2.313,70 5.1}
{0 CHEMBL2001751,1 1,2 16.112,3 28.069,4 0.065,5 18.632,6 5.994,7 281.074,8 12.562,9 84.479,11 6.157,12 1.512,13 14.833,14 3.876,15 15.02,16 137.858,17 7.943,18 0.659,19 4.219,20 4.324,21 3.848,22 3.811,23 5.373,24 3.805,25 4.717,26 4.846,27 4.214,28 4.217,29 5.84,30 4.193,31 4.955,32 5.133,33 4.204,34 4.311,35 6.029,36 4.247,37 5.004,38 5.214,39 4.141,40 4.29,41 6.006,42 4.209,43 4.98,44 5.187,45 4.178,46 4.239,47 6.085,48 4.176,49 4.97,50 5.171,51 4.13,52 4.211,53 6.065,54 4.149,55 4.932,56 5.159,57 3.998,58 4.14,59 5.953,60 4.057,61 4.8,62 5.016,63 3.94,64 4.045,65 5.86,66 3.969,67 0.054,68 0.846,69 10.735,70 6.6}
{0 CHEMBL2001920,2 14.277,3 25.266,4 0.107,5 15.473,6 2.96,7 85.603,8 3.727,9 81.976,11 5.427,12 2.103,13 6.333,14 2.505,15 6.274,16 78.272,17 14.836,18 0.3,19 3.322,20 3.372,21 3.51,22 3.123,23 4.605,24 3.068,25 3.783,26 3.827,27 4.082,28 3.564,29 5.179,30 3.476,31 3.94,32 4.009,33 4.002,34 3.585,35 5.319,36 3.485,37 3.837,38 3.913,39 3.999,40 3.444,41 5.31,42 3.371,43 3.807,44 3.881,45 4.017,46 3.315,47 5.53,48 3.244,49 3.553,50 3.624,51 4.077,52 3.146,53 5.173,54 2.974,55 3.075,56 3.183,57 3.537,58 2.645,59 4.555,60 2.447,61 2.358,62 2.498,63 3.118,64 2.093,65 3.664,66 1.678,67 0.111,68 0.287,69 3.922,70 6}
{0 CHEMBL2001957,2 17.082,3 26.655,4 -0.018,5 21.72,6 6.932,7 289.105,8 9.98,9 86.439,10 1,11 6.404,12 1.839,13 11.629,14 4.828,15 23.313,16 120.939,17 8.605,18 0.579,19 4.175,20 4.287,21 3.837,22 3.632,23 5.416,24 3.67,25 4.722,26 4.884,27 4.29,28 4.009,29 6.309,30 4.044,31 4.938,32 5.12,33 4.289,34 4.153,35 6.274,36 4.144,37 5.056,38 5.306,39 4.226,40 4.152,41 6.168,42 4.133,43 4.91,44 5.114,45 4.337,46 4.171,47 6.161,48 4.177,49 4.986,50 5.173,51 4.451,52 4.227,53 6.414,54 4.244,55 5.01,56 5.195,57 4.349,58 4.207,59 6.318,60 4.211,61 4.986,62 5.203,63 4.179,64 4.094,65 6.232,66 4.066,67 0.293,68 1.153,69 8.869,70 5.1}
{0 CHEMBL2002165,2 21.644,3 27.619,4 0.079,5 26.24,6 6.897,7 279.708,8 12.247,9 104.144,11 5.789,12 1.751,13 15.278,14 3.757,15 14.114,16 140.416,17 8.519,18 0.675,19 4.201,20 4.315,21 3.905,22 3.787,23 5.415,24 3.769,25 4.681,26 4.822,27 4.284,28 4.184,29 5.911,30 4.146,31 4.927,32 5.108,33 4.315,34 4.293,35 6.098,36 4.229,37 4.975,38 5.178,39 4.407,40 4.312,41 6.163,42 4.235,43 4.956,44 5.149,45 4.291,46 4.261,47 6.15,48 4.18,49 4.834,50 5.03,51 4.139,52 4.148,53 6.085,54 4.07,55 4.774,56 4.982,57 4.042,58 4.106,59 5.87,60 4.018,61 4.795,62 4.999,63 4.084,64 4.104,65 5.931,66 4.005,67 0.145,68 0.985,69 10.126,70 5.1}
{0 CHEMBL2002240,2 11.616,3 14.675,4 0.078,5 15.684,6 3.866,7 154.627,8 6.678,9 98.753,11 5.627,12 1.524,13 8.565,14 2.327,15 5.413,16 88.949,17 8.172,18 0.68,19 3.712,20 3.827,21 3.352,22 3.336,23 4.987,24 3.324,25 4.154,26 4.296,27 3.702,28 3.7,29 5.381,30 3.669,31 4.405,32 4.574,33 3.779,34 3.832,35 5.634,36 3.792,37 4.436,38 4.637,39 3.758,40 3.8,41 5.742,42 3.738,43 4.387,44 4.591,45 3.64,46 3.716,47 5.634,48 3.662,49 4.317,50 4.523,51 3.589,52 3.633,53 5.63,54 3.577,55 4.278,56 4.491,57 3.453,58 3.546,59 5.583,60 3.484,61 4.165,62 4.389,63 3.236,64 3.366,65 5.555,66 3.278,67 0.037,68 0.538,69 5.945,70 5.1}
{0 CHEMBL2002373,2 5.822,3 18.169,4 0.004,5 4.205,6 4.199,7 231.021,8 6.532,9 35.47,11 5.242,12 1.466,13 7.571,14 2.052,15 4.212,16 82.688,17 7.352,18 0.739,19 3.732,20 3.851,21 3.294,22 3.299,23 4.856,24 3.274,25 4.22,26 4.391,27 3.578,28 3.662,29 5.26,30 3.61,31 4.43,32 4.654,33 3.59,34 3.758,35 5.356,36 3.67,37 4.444,38 4.666,39 3.631,40 3.758,41 5.415,42 3.681,43 4.457,44 4.663,45 3.668,46 3.815,47 5.462,48 3.738,49 4.524,50 4.741,51 3.557,52 3.813,53 5.543,54 3.695,55 4.498,56 4.759,57 3.261,58 3.673,59 5.393,60 3.504,61 4.353,62 4.642,63 2.926,64 3.344,65 5.297,66 3.158,67 0.029,68 0.55,69 7.698,70 5.1}
{0 CHEMBL2002446,2 26.301,3 33.54,4 0.029,5 34.315,6 6.003,7 352.362,8 14.808,9 39.575,11 5.672,12 1.476,13 15.606,14 5.374,15 28.882,16 138.702,17 7.281,18 0.421,19 4.246,20 4.367,21 3.855,22 3.847,23 5.189,24 3.791,25 4.822,26 5.012,27 4.173,28 4.25,29 5.685,30 4.165,31 4.989,32 5.201,33 4.137,34 4.341,35 5.815,36 4.216,37 5.107,38 5.373,39 4.089,40 4.328,41 5.863,42 4.175,43 4.977,44 5.23,45 4.079,46 4.261,47 5.758,48 4.108,49 4.868,50 5.108,51 3.969,52 4.19,53 5.67,54 4.033,55 4.73,56 4.948,57 3.932,58 4.125,59 5.556,60 3.981,61 4.768,62 4.99,63 3.949,64 4.131,65 5.578,66 3.968,67 0.08,68 0.939,69 14.408,70 5.6}
{0 CHEMBL2002470,2 18.595,3 25.885,4 0.058,5 25.349,6 3.688,7 229.089,8 9.51,9 34.796,11 5.57,12 1.694,13 7.136,14 4.349,15 18.91,16 90.583,17 8.942,18 0.44,19 3.73,20 3.825,21 3.514,22 3.436,23 4.774,24 3.371,25 4.286,26 4.427,27 3.958,28 3.875,29 5.327,30 3.78,31 4.576,32 4.755,33 4.052,34 4.036,35 5.615,36 3.911,37 4.525,38 4.704,39 4.04,40 3.989,41 5.505,42 3.855,43 4.414,44 4.577,45 3.896,46 3.881,47 5.468,48 3.777,49 4.507,50 4.7,51 3.846,52 3.896,53 5.513,54 3.765,55 4.513,56 4.728,57 3.818,58 3.749,59 5.592,60 3.568,61 4.183,62 4.455,63 3.002,64 3.202,65 5.225,66 2.96,67 0.017,68 0.5,69 5.879,70 5.2}
{0 CHEMBL2002479,2 25.806,3 27.984,4 0.059,5 36.034,6 5.849,7 284.91,8 9.992,9 85.704,11 6.051,12 1.671,13 13.656,14 3.809,15 14.507,16 121.934,17 8.471,18 0.611,19 4.101,20 4.205,21 3.775,22 3.671,23 5.249,24 3.67,25 4.614,26 4.749,27 4.168,28 4.074,29 5.776,30 4.051,31 4.84,32 5.021,33 4.173,34 4.16,35 5.921,36 4.111,37 4.818,38 4.999,39 4.129,40 4.106,41 5.928,42 4.053,43 4.785,44 4.978,45 4.095,46 4.065,47 5.884,48 4.01,49 4.754,50 4.942,51 3.972,52 4.051,53 5.812,54 3.983,55 4.746,56 4.948,57 3.868,58 4.018,59 5.796,60 3.924,61 4.719,62 4.949,63 3.838,64 3.929,65 5.728,66 3.823,67 0.096,68 0.766,69 8.793,70 5.3}
{0 CHEMBL2002649,2 11.833,3 10.486,4 0.024,5 15.343,6 2.647,7 142.085,8 4.53,9 51.582,11 5.302,12 1.654,13 7.056,14 1.03,15 1.062,16 66.997,17 8.32,18 0.55,19 3.515,20 3.621,21 3.176,22 3.045,23 4.732,24 3.066,25 3.985,26 4.123,27 3.516,28 3.415,29 5.202,30 3.421,31 4.077,32 4.232,33 3.434,34 3.444,35 5.263,36 3.417,37 4.068,38 4.241,39 3.338,40 3.381,41 5.223,42 3.337,43 4.074,44 4.278,45 3.363,46 3.251,47 5.33,48 3.231,49 3.914,50 4.09,51 3.201,52 3.091,53 5.237,54 3.078,55 3.773,56 3.996,57 2.725,58 2.868,59 4.894,60 2.783,61 3.542,62 3.816,63 2.281,64 2.447,65 4.555,66 2.334,67 0.067,68 0.445,69 4.761,70 5.1}
{0 CHEMBL2002682,1 1,2 24.271,3 45.513,4 0.038,5 22.891,6 11.098,7 497.511,8 17.602,9 67.693,11 6.505,12 1.504,13 16.023,14 6.454,15 41.655,16 172.4,17 7.41,18 0.574,19 4.474,20 4.589,21 4.032,22 4.033,23 5.535,24 4.001,25 5.017,26 5.177,27 4.365,28 4.419,29 6.028,30 4.361,31 5.257,32 5.457,33 4.493,34 4.569,35 6.252,36 4.486,37 5.296,38 5.49,39 4.515,40 4.606,41 6.28,42 4.516,43 5.38,44 5.591,45 4.479,46 4.622,47 6.372,48 4.513,49 5.404,50 5.636,51 4.44,52 4.604,53 6.364,54 4.485,55 5.372,56 5.61,57 4.334,58 4.547,59 6.289,60 4.42,61 5.307,62 5.533,63 4.422,64 4.517,65 6.316,66 4.413,67 0.047,68 1.09,69 16.963,70 5.7}
{0 CHEMBL2002702,1 1,2 12.37,3 13.761,4 0.062,5 15.104,6 2.511,7 166.398,8 6.24,9 34.796,11 5.459,12 1.44,13 7.111,14 2.748,15 7.551,16 72.469,17 7.447,18 0.55,19 3.568,20 3.688,21 3.144,22 3.178,23 4.683,24 3.149,25 4.061,26 4.221,27 3.525,28 3.566,29 5.155,30 3.52,31 4.226,32 4.403,33 3.471,34 3.62,35 5.325,36 3.547,37 4.304,38 4.54,39 3.302,40 3.546,41 5.295,42 3.433,43 4.128,44 4.345,45 3.258,46 3.372,47 5.266,48 3.288,49 4.094,50 4.33,51 3.185,52 3.301,53 5.184,54 3.225,55 3.94,56 4.152,57 2.823,58 3.169,59 5.006,60 3.043,61 3.82,62 4.097,63 2.177,64 2.894,65 4.676,66 2.666,67 0.026,68 0.452,69 6.295,70 5.2}
{0 CHEMBL2002726,2 11.017,3 24.012,4 0.055,5 9.41,6 5.079,7 234.651,8 10.137,9 83.009,11 5.492,12 1.447,13 11.889,14 3.212,15 10.318,16 107.094,17 7.316,18 0.733,19 3.988,20 4.113,21 3.548,22 3.566,23 5.096,24 3.538,25 4.486,26 4.649,27 3.875,28 3.946,29 5.513,30 3.897,31 4.722,32 4.921,33 3.882,34 4.052,35 5.728,36 3.964,37 4.797,38 5.045,39 3.741,40 3.999,41 5.685,42 3.879,43 4.677,44 4.916,45 3.705,46 3.912,47 5.619,48 3.805,49 4.661,50 4.897,51 3.667,52 3.85,53 5.636,54 3.748,55 4.59,56 4.847,57 3.557,58 3.746,59 5.517,60 3.64,61 4.42,62 4.66,63 3.467,64 3.656,65 5.379,66 3.548,67 0.07,68 0.719,69 10.103,70 6.5}
{0 CHEMBL2002992,1 1,2 12.427,3 26.819,4 0.066,5 15.179,6 4.155,7 237.025,8 9.033,9 84.479,11 5.865,12 1.47,13 8.857,14 1.461,15 2.133,16 81.7,17 6.661,18 0.435,19 3.845,20 3.993,21 3.311,22 3.355,23 4.859,24 3.316,25 4.416,26 4.61,27 3.673,28 3.795,29 5.356,30 3.716,31 4.758,32 5.01,33 3.701,34 3.932,35 5.643,36 3.814,37 4.825,38 5.103,39 3.585,40 3.878,41 5.74,42 3.735,43 4.733,44 5.036,45 3.337,46 3.712,47 5.62,48 3.548,49 4.454,50 4.735,51 3.319,52 3.545,53 5.41,54 3.413,55 4.298,56 4.532,57 3.251,58 3.494,59 5.337,60 3.371,61 4.343,62 4.62,63 2.961,64 3.386,65 5.225,66 3.227,67 0.053,68 0.659,69 10.153,70 5.4}
{0 CHEMBL2003271,2 14.113,3 15.538,4 0.119,5 16.802,6 5.013,7 238.362,8 6.682,9 50.908,11 6.014,12 1.975,13 8.833,14 4.763,15 22.689,16 97.47,17 12.112,18 0.615,19 3.638,20 3.701,21 3.642,22 3.394,23 4.941,24 3.351,25 4.081,26 4.144,27 4.114,28 3.812,29 5.482,30 3.741,31 4.327,32 4.41,33 4.354,34 3.914,35 5.728,36 3.833,37 4.31,38 4.405,39 4.206,40 3.816,41 5.734,42 3.73,43 4.219,44 4.333,45 4.112,46 3.661,47 5.668,48 3.62,49 4.197,50 4.29,51 4.148,52 3.633,53 5.989,54 3.61,55 4.153,56 4.26,57 3.952,58 3.628,59 5.689,60 3.531,61 3.992,62 4.12,63 3.658,64 3.47,65 5.336,66 3.333,67 0.152,68 0.411,69 0.573,70 5.7}
{0 CHEMBL2003286,2 10.216,3 10.062,4 0.071,5 8.592,6 3.402,7 186.371,8 4.446,9 18.011,11 5.218,12 1.832,13 7.235,14 1.659,15 2.751,16 64.378,17 9.665,18 0.333,19 3.403,20 3.464,21 3.224,22 2.99,23 4.733,24 2.98,25 3.839,26 3.925,27 3.644,28 3.321,29 5.228,30 3.304,31 3.951,32 4.034,33 3.531,34 3.312,35 5.417,36 3.294,37 3.928,38 4.069,39 3.316,40 3.21,41 5.381,42 3.151,43 3.89,44 4.061,45 3.206,46 3.161,47 5.121,48 3.066,49 3.767,50 3.934,51 3.158,52 2.955,53 5.083,54 2.903,55 3.584,56 3.759,57 3.067,58 2.604,59 5.055,60 2.614,61 3.193,62 3.268,63 2.626,64 2.261,65 5.035,66 2.249,67 0.15,68 0.352,69 3.354,70 5.2}
{0 CHEMBL2003341,2 11.666,3 22.505,4 0.049,5 15.34,6 6.017,7 310.921,8 8.749,9 34.796,11 5.95,12 1.668,13 11.077,14 3.808,15 14.497,16 102.699,17 9.221,18 0.643,19 3.836,20 3.928,21 3.573,22 3.485,23 5.047,24 3.457,25 4.306,26 4.427,27 3.945,28 3.866,29 5.519,30 3.813,31 4.587,32 4.753,33 4.013,34 4.003,35 5.749,36 3.917,37 4.62,38 4.8,39 4.097,40 3.952,41 5.837,42 3.866,43 4.637,44 4.829,45 3.938,46 3.88,47 5.919,48 3.79,49 4.521,50 4.711,51 3.854,52 3.776,53 5.803,54 3.68,55 4.322,56 4.507,57 3.743,58 3.597,59 5.681,60 3.523,61 4.166,62 4.358,63 3.555,64 3.481,65 5.371,66 3.39,67 0.074,68 0.531,69 5.607,70 5.1}
{0 CHEMBL2003405,2 17.808,3 22.381,4 0.041,5 22.626,6 6.084,7 237.025,8 9.298,9 51.337,11 6.028,12 1.664,13 13.143,14 5.418,15 29.359,16 104.92,17 8.072,18 0.567,19 3.967,20 4.087,21 3.578,22 3.515,23 5.152,24 3.509,25 4.504,26 4.667,27 3.997,28 3.883,29 6.111,30 3.863,31 4.695,32 4.898,33 3.957,34 3.974,35 5.907,36 3.924,37 4.774,38 4.992,39 3.911,40 3.92,41 6.075,42 3.878,43 4.699,44 4.932,45 3.712,46 3.858,47 5.843,48 3.78,49 4.563,50 4.807,51 3.634,52 3.781,53 5.574,54 3.679,55 4.539,56 4.79,57 3.675,58 3.675,59 5.742,60 3.608,61 4.414,62 4.636,63 3.671,64 3.553,65 5.749,66 3.527,67 0.126,68 0.905,69 8.315,70 5.9}
{0 CHEMBL2003420,2 20.734,3 30.523,4 -0.015,5 24.622,6 10.622,7 332.796,8 8.056,9 105.614,11 4.995,12 1.547,13 16.5,14 0.979,15 0.958,16 107.526,17 6.867,18 0.414,19 4.087,20 4.236,21 3.557,22 3.541,23 5.168,24 3.516,25 4.613,26 4.824,27 3.789,28 3.885,29 5.687,30 3.805,31 4.873,32 5.137,33 3.734,34 3.967,35 5.779,36 3.843,37 4.883,38 5.17,39 3.608,40 3.848,41 5.832,42 3.725,43 4.753,44 5.029,45 3.612,46 3.765,47 5.74,48 3.661,49 4.728,50 4.997,51 3.593,52 3.718,53 5.826,54 3.623,55 4.646,56 4.913,57 3.458,58 3.697,59 5.616,60 3.578,61 4.626,62 4.901,63 3.328,64 3.684,65 5.504,66 3.536,67 0.038,68 0.838,69 12.631,70 5.1}
{0 CHEMBL2003456,2 9.679,3 9.87,4 0.057,5 15.401,6 2.031,7 107.543,8 3.841,9 52.807,11 4.821,12 1.592,13 6.938,14 1.6,15 2.559,16 59.726,17 8.45,18 0.667,19 3.37,20 3.482,21 3.05,22 2.962,23 4.58,24 2.971,25 3.822,26 3.951,27 3.408,28 3.339,29 5.088,30 3.321,31 4.01,32 4.192,33 3.312,34 3.365,35 5.167,36 3.316,37 3.893,38 4.108,39 3.084,40 3.196,41 5.025,42 3.118,43 3.743,44 3.966,45 2.903,46 2.985,47 4.856,48 2.918,49 3.513,50 3.736,51 2.683,52 2.748,53 4.592,54 2.69,55 3.319,56 3.549,57 2.437,58 2.483,59 4.47,60 2.429,61 3.035,62 3.273,63 1.929,64 2.009,65 4.302,66 1.949,67 0.041,68 0.391,69 3.836,70 5.1}
{0 CHEMBL2003482,2 15.894,3 19.497,4 0.055,5 16.748,6 3.47,7 205.547,8 5.361,9 51.337,11 5.223,12 1.67,13 8.737,14 2.947,15 8.682,16 74.065,17 8.356,18 0.524,19 3.613,20 3.733,21 3.278,22 3.204,23 4.709,24 3.177,25 4.142,26 4.301,27 3.656,28 3.613,29 5.22,30 3.553,31 4.376,32 4.59,33 3.568,34 3.619,35 5.415,36 3.518,37 4.269,38 4.514,39 3.345,40 3.396,41 5.337,42 3.299,43 4.099,44 4.332,45 3.261,46 3.211,47 5.3,48 3.161,49 3.982,50 4.197,51 3.148,52 3.172,53 5.106,54 3.093,55 3.835,56 4.03,57 3.185,58 3.107,59 5.049,60 3.029,61 3.79,62 4.035,63 2.918,64 3.095,65 4.653,66 2.963,67 0.06,68 0.495,69 5.779,70 5.1}
{0 CHEMBL2003638,2 17.529,3 19.258,4 0.042,5 24.912,6 5.028,7 201.711,8 7.948,9 86.317,11 6.046,12 1.647,13 13.065,14 4.439,15 19.7,16 116.372,17 8.593,18 0.771,19 4.012,20 4.127,21 3.704,22 3.597,23 5.248,24 3.604,25 4.48,26 4.617,27 4.061,28 3.978,29 5.716,30 3.972,31 4.703,32 4.887,33 4.044,34 4.034,35 5.9,36 4.001,37 4.737,38 4.955,39 3.986,40 3.933,41 5.924,42 3.907,43 4.626,44 4.836,45 3.976,46 3.839,47 5.988,48 3.836,49 4.521,50 4.717,51 3.897,52 3.827,53 5.724,54 3.813,55 4.513,56 4.72,57 3.863,58 3.816,59 5.71,60 3.784,61 4.433,62 4.625,63 3.751,64 3.773,65 5.689,66 3.727,67 0.134,68 0.835,69 7.057,70 5.6}
{0 CHEMBL2003768,2 22.338,3 14.85,4 0.003,5 31.076,6 5.122,7 283.933,8 6.676,9 50.357,11 5.41,12 1.647,13 10.8,14 1.312,15 1.721,16 93.289,17 8.08,18 0.444,19 3.862,20 3.952,21 3.481,22 3.351,23 5.121,24 3.373,25 4.293,26 4.441,27 3.752,28 3.621,29 5.494,30 3.642,31 4.391,32 4.53,33 3.827,34 3.705,35 5.726,36 3.706,37 4.477,38 4.646,39 3.714,40 3.724,41 5.677,42 3.678,43 4.516,44 4.726,45 3.682,46 3.724,47 5.599,48 3.673,49 4.521,50 4.709,51 3.701,52 3.652,53 5.727,54 3.64,55 4.409,56 4.578,57 3.646,58 3.579,59 5.734,60 3.553,61 4.444,62 4.684,63 3.451,64 3.473,65 5.609,66 3.414,67 0.126,68 0.59,69 7.535,70 5.1}
{0 CHEMBL2003817,2 16.178,3 9.813,4 0.009,5 22.484,6 4.217,7 119.314,8 5.63,9 86.378,10 1,11 5.515,12 1.905,13 10.167,14 1.889,15 3.57,16 78.386,17 9.803,18 0.654,19 3.689,20 3.796,21 3.454,22 3.186,23 5.037,24 3.248,25 4.182,26 4.314,27 3.902,28 3.523,29 6.065,30 3.584,31 4.327,32 4.495,33 3.835,34 3.607,35 5.75,36 3.647,37 4.371,38 4.559,39 3.773,40 3.507,41 5.865,42 3.554,43 4.295,44 4.492,45 3.701,46 3.372,47 5.877,48 3.43,49 4.113,50 4.295,51 3.57,52 3.23,53 5.646,54 3.298,55 4.027,56 4.216,57 3.464,58 3.145,59 5.599,60 3.206,61 3.922,62 4.123,63 3.286,64 3.08,65 5.344,66 3.118,67 0.254,68 0.778,69 3.155,70 5.1}
{0 CHEMBL2004290,2 25.408,3 31.333,4 0.058,5 31.066,6 7.388,7 349.564,8 14.786,9 104.144,11 6.342,12 1.658,13 16.711,14 3.74,15 13.988,16 151.3,17 8.01,18 0.643,19 4.3,20 4.415,21 3.954,22 3.864,23 5.466,24 3.838,25 4.793,26 4.946,27 4.34,28 4.262,29 5.949,30 4.221,31 5.025,32 5.189,33 4.368,34 4.398,35 6.153,36 4.324,37 5.154,38 5.386,39 4.445,40 4.434,41 6.212,42 4.333,43 5.082,44 5.289,45 4.343,46 4.373,47 6.207,48 4.272,49 4.962,50 5.175,51 4.149,52 4.244,53 6.015,54 4.147,55 4.861,56 5.072,57 4.126,58 4.186,59 5.95,60 4.096,61 4.902,62 5.102,63 4.182,64 4.22,65 5.994,66 4.112,67 0.111,68 1.008,69 12.923,70 5.1}
{0 CHEMBL2004311,2 26.744,3 23.633,4 0.058,5 40.338,6 5.121,7 285.712,8 11.451,9 54.032,11 5.721,12 1.454,13 11.897,14 4.462,15 19.905,16 114.783,17 7.413,18 0.563,19 4.038,20 4.159,21 3.601,22 3.637,23 5.158,24 3.607,25 4.546,26 4.712,27 3.981,28 4.038,29 5.671,30 3.985,31 4.766,32 4.935,33 4.019,34 4.178,35 5.856,36 4.103,37 4.887,38 5.106,39 4.001,40 4.164,41 5.944,42 4.071,43 4.861,44 5.073,45 3.876,46 4.102,47 5.948,48 4.003,49 4.873,50 5.141,51 3.805,52 4.001,53 5.873,54 3.883,55 4.694,56 4.933,57 3.556,58 3.797,59 5.81,60 3.698,61 4.455,62 4.705,63 3.476,64 3.657,65 5.477,66 3.559,67 0.038,68 0.73,69 10.284,70 5.1}
{0 CHEMBL2004365,2 20.652,3 26.127,4 0.102,5 22.349,6 6.181,7 239.459,8 10.343,9 68.919,11 6.337,12 1.864,13 9.2,14 2.418,15 5.849,16 121.644,17 9.779,18 0.303,19 3.98,20 4.06,21 3.871,22 3.668,23 5.211,24 3.603,25 4.466,26 4.565,27 4.299,28 4.078,29 5.739,30 3.986,31 4.643,32 4.763,33 4.325,34 4.143,35 5.846,36 4.063,37 4.757,38 4.851,39 4.617,40 4.262,41 6.214,42 4.205,43 4.901,44 4.997,45 4.727,46 4.333,47 6.302,48 4.283,49 4.948,50 5.057,51 4.574,52 4.262,53 6.645,54 4.214,55 4.919,56 5.113,57 4.161,58 4.17,59 6.114,60 4.037,61 4.755,62 4.957,63 3.99,64 4.033,65 5.919,66 3.863,67 0.131,68 0.679,69 6.256,70 5.1}
{0 CHEMBL2004419,2 9.117,3 23.007,4 0.033,5 4.86,6 4.681,7 200.109,8 9.952,9 69.654,11 5.998,12 1.688,13 10,14 5.969,15 35.634,16 115.367,17 8.643,18 0.735,19 4.026,20 4.14,21 3.76,22 3.631,23 5.202,24 3.608,25 4.545,26 4.702,27 4.192,28 4.036,29 5.716,30 4.008,31 4.76,32 4.949,33 4.192,34 4.129,35 5.948,36 4.083,37 4.853,38 5.083,39 4.184,40 4.146,41 5.95,42 4.095,43 4.792,44 4.971,45 4.285,46 4.221,47 5.994,48 4.157,49 4.921,50 5.116,51 4.26,52 4.254,53 6.135,54 4.16,55 4.862,56 5.091,57 4.23,58 4.108,59 6.036,60 4.034,61 4.702,62 4.914,63 4.047,64 3.914,65 5.987,66 3.859,67 0.078,68 0.915,69 8.044,70 5.2}
{0 CHEMBL2004447,2 17.673,3 18.471,4 0.064,5 19.707,6 3.657,7 175.795,8 9.251,9 97.283,11 6.076,12 1.648,13 6.522,14 3.742,15 14.006,16 85.929,17 7.809,18 0.44,19 3.797,20 3.92,21 3.393,22 3.338,23 5.026,24 3.331,25 4.309,26 4.473,27 3.811,28 3.76,29 5.449,30 3.739,31 4.581,32 4.738,33 3.944,34 3.949,35 5.749,36 3.909,37 4.835,38 5.083,39 4.013,40 4.007,41 6.022,42 3.963,43 4.741,44 4.953,45 4.011,46 3.969,47 5.988,48 3.94,49 4.709,50 4.906,51 3.955,52 3.861,53 6.189,54 3.833,55 4.565,56 4.793,57 3.458,58 3.674,59 5.851,60 3.562,61 4.465,62 4.783,63 2.345,64 3.243,65 5.621,66 3.001,67 0.084,68 0.669,69 7.52,70 5.1}
{0 CHEMBL2004513,2 18.227,3 17.077,4 0.049,5 28.306,6 4.191,7 226.085,8 8.511,9 36.022,11 6.071,12 1.512,13 9.346,14 3.709,15 13.754,16 98.405,17 8.2,18 0.621,19 3.857,20 3.952,21 3.508,22 3.47,23 5.064,24 3.465,25 4.335,26 4.452,27 3.872,28 3.852,29 5.568,30 3.831,31 4.595,32 4.745,33 4.045,34 4.037,35 5.789,36 4.01,37 4.699,38 4.863,39 4.001,40 4.017,41 5.966,42 3.985,43 4.675,44 4.852,45 3.878,46 3.98,47 5.881,48 3.924,49 4.572,50 4.767,51 3.669,52 3.839,53 5.69,54 3.756,55 4.431,56 4.641,57 3.544,58 3.692,59 5.528,60 3.603,61 4.31,62 4.525,63 3.46,64 3.527,65 5.44,66 3.467,67 0.047,68 0.554,69 6.79,70 5.1}
{0 CHEMBL2004544,2 21.63,3 16.897,4 0.079,5 30.367,6 4.245,7 289.345,8 9.401,9 18.011,11 6.193,12 1.719,13 9.731,14 2.595,15 6.732,16 95.398,17 9.108,18 0.586,19 3.876,20 3.929,21 3.753,22 3.452,23 5.053,24 3.452,25 4.387,26 4.464,27 4.036,28 3.832,29 5.946,30 3.834,31 4.564,32 4.691,33 4.061,34 3.968,35 5.796,36 3.927,37 4.666,38 4.812,39 4.049,40 3.946,41 5.956,42 3.897,43 4.683,44 4.862,45 3.92,46 3.836,47 5.917,48 3.778,49 4.545,50 4.721,51 3.75,52 3.688,53 6.028,54 3.618,55 4.403,56 4.6,57 3.529,58 3.59,59 5.565,60 3.516,61 4.252,62 4.41,63 3.572,64 3.503,65 5.483,66 3.456,67 0.215,68 0.561,69 8.7,70 5.5}
{0 CHEMBL2004615,2 12.596,3 9.994,4 0.089,5 12.877,6 3.355,7 107.543,8 3.542,9 101.019,11 5.046,12 1.847,13 6.412,14 0.906,15 0.821,16 68.331,17 8.905,18 0.611,19 3.463,20 3.596,21 3.226,22 3.002,23 4.745,24 2.976,25 3.88,26 4.036,27 3.549,28 3.313,29 5.177,30 3.275,31 3.983,32 4.149,33 3.633,34 3.334,35 5.295,36 3.322,37 4.073,38 4.252,39 3.715,40 3.338,41 5.558,42 3.313,43 4.068,44 4.268,45 3.347,46 3.317,47 5.307,48 3.222,49 3.983,50 4.21,51 3.099,52 3.165,53 5.262,54 3.024,55 3.839,56 4.133,57 2.642,58 2.878,59 4.885,60 2.682,61 3.355,62 3.626,63 1.838,64 2.351,65 4.425,66 2.137,67 0.105,68 0.484,69 4.876,70 5.3}
{0 CHEMBL2004647,2 19.435,3 22.528,4 0.026,5 27.579,6 4.449,7 275.307,8 9.432,9 100.66,11 6.048,12 1.801,13 8.957,14 1.847,15 3.41,16 87.482,17 9.531,18 0.44,19 3.815,20 3.926,21 3.574,22 3.319,23 4.991,24 3.315,25 4.348,26 4.524,27 4.027,28 3.742,29 5.545,30 3.716,31 4.591,32 4.774,33 4.324,34 3.918,35 5.728,36 3.872,37 4.705,38 4.9,39 4.324,40 3.946,41 6.063,42 3.864,43 4.66,44 4.88,45 4.297,46 3.877,47 5.764,48 3.767,49 4.435,50 4.635,51 4.005,52 3.709,53 5.592,54 3.585,55 4.413,56 4.641,57 3.885,58 3.522,59 5.544,60 3.399,61 4.187,62 4.439,63 3.063,64 3.247,65 5.174,66 3.085,67 0.133,68 0.607,69 5.825,70 5.1}
{0 CHEMBL2004692,2 12.198,3 14.879,4 0.071,5 8.953,6 4.937,7 141.046,8 4.58,9 141.622,11 5.691,12 1.875,13 9.815,14 2.77,15 7.674,16 105.144,17 9.755,18 0.7,19 3.842,20 3.952,21 3.67,22 3.389,23 5.184,24 3.399,25 4.242,26 4.364,27 3.999,28 3.738,29 5.535,30 3.731,31 4.371,32 4.538,33 3.924,34 3.682,35 5.702,36 3.675,37 4.407,38 4.586,39 3.989,40 3.636,41 5.768,42 3.687,43 4.398,44 4.565,45 3.998,46 3.667,47 5.772,48 3.72,49 4.411,50 4.566,51 3.984,52 3.658,53 5.839,54 3.702,55 4.437,56 4.613,57 3.901,58 3.56,59 5.939,60 3.592,61 4.264,62 4.47,63 3.617,64 3.431,65 5.517,66 3.39,67 0.247,68 0.704,69 4.571,70 5.1}
{0 CHEMBL2004716,2 29.302,3 38.084,4 0.041,5 37.713,6 9.959,7 391.652,8 16.105,9 106.839,11 5.63,12 1.564,13 17.385,14 4.543,15 20.642,16 162.121,17 7.435,18 0.524,19 4.363,20 4.495,21 3.95,22 3.931,23 5.469,24 3.882,25 4.87,26 5.055,27 4.289,28 4.307,29 5.954,30 4.228,31 5.105,32 5.318,33 4.355,34 4.449,35 6.121,36 4.35,37 5.196,38 5.417,39 4.388,40 4.487,41 6.221,42 4.362,43 5.247,44 5.5,45 4.266,46 4.421,47 6.27,48 4.283,49 5.107,50 5.359,51 4.246,52 4.289,53 6.185,54 4.19,55 4.969,56 5.176,57 4.137,58 4.241,59 6.103,60 4.151,61 4.966,62 5.185,63 4.065,64 4.242,65 6.048,66 4.111,67 0.062,68 1.096,69 15.755,70 5.5}
{0 CHEMBL2004771,2 17.232,3 17.315,4 0.051,5 27.874,6 3.506,7 187.677,8 7.382,9 52.807,11 6.044,12 1.514,13 11.038,14 3.927,15 15.424,16 97.851,17 8.327,18 0.733,19 3.858,20 3.955,21 3.535,22 3.482,23 5.022,24 3.482,25 4.348,26 4.467,27 3.923,28 3.884,29 5.536,30 3.866,31 4.558,32 4.728,33 3.898,34 3.948,35 5.657,36 3.904,37 4.54,38 4.719,39 3.774,40 3.867,41 5.643,42 3.809,43 4.475,44 4.682,45 3.624,46 3.758,47 5.522,48 3.685,49 4.379,50 4.6,51 3.477,52 3.661,53 5.394,54 3.572,55 4.199,56 4.416,57 3.322,58 3.483,59 5.248,60 3.396,61 4.033,62 4.245,63 3.197,64 3.296,65 5.084,66 3.225,67 0.038,68 0.57,69 6.439,70 5.1}
{0 CHEMBL2004871,2 7.449,3 18.366,4 0.003,5 4.867,6 4.38,7 219.25,8 6.584,9 35.47,11 5.243,12 1.61,13 8.318,14 2.258,15 5.097,16 82.905,17 7.825,18 0.708,19 3.744,20 3.858,21 3.348,22 3.297,23 4.931,24 3.289,25 4.235,26 4.4,27 3.658,28 3.659,29 5.387,30 3.63,31 4.454,32 4.668,33 3.676,34 3.754,35 5.532,36 3.694,37 4.461,38 4.677,39 3.677,40 3.755,41 5.521,42 3.696,43 4.463,44 4.667,45 3.706,46 3.814,47 5.504,48 3.747,49 4.536,50 4.748,51 3.646,52 3.81,53 5.656,54 3.711,55 4.516,56 4.769,57 3.429,58 3.669,59 5.55,60 3.535,61 4.379,62 4.656,63 3.147,64 3.336,65 5.489,66 3.21,67 0.047,68 0.623,69 6.991,70 5.1}
{0 CHEMBL2004872,2 13.021,3 19.321,4 -0.003,5 18.055,6 5.295,7 248.025,8 8.379,9 51.582,11 5.925,12 1.507,13 11.56,14 3.151,15 9.928,16 96.49,17 7.578,18 0.667,19 3.871,20 3.983,21 3.453,22 3.441,23 5.039,24 3.422,25 4.354,26 4.515,27 3.758,28 3.785,29 5.487,30 3.748,31 4.552,32 4.734,33 3.81,34 3.915,35 5.644,36 3.852,37 4.632,38 4.835,39 3.721,40 3.891,41 5.74,42 3.804,43 4.662,44 4.897,45 3.627,46 3.841,47 5.713,48 3.735,49 4.527,50 4.756,51 3.485,52 3.726,53 5.543,54 3.615,55 4.423,56 4.672,57 3.417,58 3.59,59 5.536,60 3.479,61 4.277,62 4.527,63 3.296,64 3.444,65 5.323,66 3.35,67 0.011,68 0.615,69 8.339,70 5.1}
{0 CHEMBL2004892,2 8.035,3 15.392,4 0.106,5 5.975,6 3.353,7 162.024,8 6.891,9 82.628,11 6.088,12 1.798,13 8.857,14 2.168,15 4.701,16 85.059,17 8.64,18 0.696,19 3.688,20 3.795,21 3.56,22 3.289,23 4.832,24 3.251,25 4.174,26 4.301,27 3.775,28 3.651,29 5.617,30 3.613,31 4.385,32 4.558,33 3.706,34 3.728,35 5.606,36 3.66,37 4.365,38 4.57,39 3.602,40 3.694,41 5.487,42 3.582,43 4.318,44 4.536,45 3.417,46 3.562,47 5.467,48 3.443,49 4.159,50 4.393,51 3.239,52 3.347,53 5.25,54 3.237,55 3.927,56 4.174,57 3.159,58 3.12,59 4.993,60 3.014,61 3.77,62 3.993,63 3.074,64 2.971,65 4.973,66 2.862,67 0.135,68 0.583,69 8.534,70 5.4}
{0 CHEMBL2004934,2 14.648,3 20.186,4 0.012,5 18.717,6 5.523,7 248.025,8 9.257,9 34.796,11 5.935,12 1.56,13 11.538,14 3.556,15 12.645,16 98.225,17 7.787,18 0.643,19 3.894,20 4.001,21 3.492,22 3.474,23 5.092,24 3.458,25 4.382,26 4.534,27 3.818,28 3.824,29 5.565,30 3.795,31 4.606,32 4.783,33 3.903,34 3.958,35 5.783,36 3.911,37 4.684,38 4.876,39 3.857,40 3.935,41 5.903,42 3.872,43 4.734,44 4.959,45 3.8,46 3.875,47 6.038,48 3.799,49 4.581,50 4.805,51 3.588,52 3.747,53 5.728,54 3.658,55 4.447,56 4.686,57 3.504,58 3.607,59 5.621,60 3.524,61 4.338,62 4.573,63 3.415,64 3.467,65 5.558,66 3.41,67 0.034,68 0.666,69 8.115,70 5.1}
{0 CHEMBL2005112,2 21.112,3 21.459,4 0.016,5 23.59,6 4.855,7 244.395,8 8.787,9 114.138,11 6.415,12 1.676,13 10.906,14 5.391,15 29.061,16 123.924,17 10.132,18 0.583,19 4.007,20 4.1,21 3.841,22 3.652,23 5.262,24 3.644,25 4.487,26 4.614,27 4.294,28 4.056,29 5.685,30 4.039,31 4.708,32 4.846,33 4.417,34 4.192,35 5.989,36 4.175,37 4.82,38 4.976,39 4.421,40 4.208,41 6.156,42 4.187,43 4.814,44 4.974,45 4.366,46 4.175,47 6.164,48 4.154,49 4.781,50 4.924,51 4.441,52 4.173,53 6.251,54 4.129,55 4.8,56 4.994,57 4.148,58 4.089,59 6.02,60 4.007,61 4.707,62 4.934,63 4.022,64 3.964,65 5.956,66 3.863,67 0.095,68 0.685,69 4.334,70 5.1}
{0 CHEMBL2005186,2 20.292,3 27.707,4 0.03,5 31.925,6 6.217,7 283.338,8 10.243,9 102.919,11 6.108,12 1.552,13 13.118,14 4.724,15 22.319,16 128.495,17 7.803,18 0.711,19 4.174,20 4.294,21 3.786,22 3.731,23 5.322,24 3.724,25 4.672,26 4.829,27 4.144,28 4.101,29 5.804,30 4.08,31 4.903,32 5.099,33 4.165,34 4.195,35 6.017,36 4.149,37 4.924,38 5.155,39 4.106,40 4.144,41 5.966,42 4.089,43 4.837,44 5.033,45 4.085,46 4.113,47 5.98,48 4.07,49 4.838,50 5.038,51 4.085,52 4.167,53 5.893,54 4.116,55 4.835,56 5.022,57 4.133,58 4.228,59 5.916,60 4.164,61 4.897,62 5.095,63 4.071,64 4.228,65 5.969,66 4.138,67 0.068,68 0.891,69 10.778,70 5.1}
{0 CHEMBL2005375,2 35.279,3 47.6,4 -0.009,5 56.934,6 8.086,7 485.049,8 14.809,9 75.841,11 6.218,12 1.505,13 13.568,14 5.403,15 29.189,16 143.775,17 6.756,18 0.293,19 4.402,20 4.538,21 3.889,22 3.887,23 5.386,24 3.858,25 5.01,26 5.212,27 4.271,28 4.319,29 5.937,30 4.258,31 5.321,32 5.565,33 4.402,34 4.491,35 6.239,36 4.409,37 5.375,38 5.617,39 4.422,40 4.509,41 6.366,42 4.438,43 5.389,44 5.619,45 4.439,46 4.544,47 6.458,48 4.467,49 5.385,50 5.62,51 4.329,52 4.536,53 6.356,54 4.429,55 5.394,56 5.667,57 4.143,58 4.438,59 6.282,60 4.304,61 5.234,62 5.514,63 4.063,64 4.312,65 6.074,66 4.179,67 0.038,68 1.135,69 17.559,70 5.1}
{0 CHEMBL2005475,2 5.939,3 29.943,4 0.071,5 5.692,6 4.656,7 248.796,8 10.121,9 51.337,11 5.636,12 1.543,13 10.75,14 4.693,15 22.027,16 99.096,17 7.544,18 0.556,19 3.903,20 4.024,21 3.541,22 3.537,23 4.906,24 3.469,25 4.463,26 4.63,27 3.929,28 3.968,29 5.411,30 3.862,31 4.747,32 4.985,33 3.924,34 4.023,35 5.604,36 3.88,37 4.731,38 4.997,39 3.716,40 3.893,41 5.606,42 3.747,43 4.567,44 4.822,45 3.733,46 3.802,47 5.537,48 3.666,49 4.408,50 4.615,51 3.693,52 3.733,53 5.466,54 3.591,55 4.257,56 4.431,57 3.53,58 3.628,59 5.334,60 3.475,61 4.189,62 4.381,63 3.31,64 3.499,65 5.209,66 3.358,67 0.062,68 0.67,69 9.927,70 5.1}
{0 CHEMBL2005528,1 1,2 12.088,3 16.727,4 0.04,5 10.17,6 3.03,7 202.543,8 5.69,9 34.796,11 5.819,12 1.609,13 7.737,14 1.902,15 3.617,16 70.084,17 7.827,18 0.476,19 3.623,20 3.728,21 3.227,22 3.151,23 4.759,24 3.155,25 4.164,26 4.314,27 3.608,28 3.548,29 5.353,30 3.532,31 4.372,32 4.559,33 3.66,34 3.642,35 5.526,36 3.611,37 4.344,38 4.508,39 3.533,40 3.555,41 5.588,42 3.527,43 4.203,44 4.391,45 3.288,46 3.392,47 5.379,48 3.33,49 4.1,50 4.307,51 3.186,52 3.223,53 5.272,54 3.156,55 3.973,56 4.213,57 2.803,58 2.937,59 5.027,60 2.852,61 3.649,62 3.849,63 2.687,64 2.637,65 5.144,66 2.574,67 0.064,68 0.479,69 6.199,70 5.1}
{0 CHEMBL2005631,2 21.624,3 21.036,4 0.087,5 25.287,6 6.283,7 226.856,8 10.756,9 103.715,11 6.093,12 1.776,13 13.313,14 3.445,15 11.867,16 124.504,17 8.645,18 0.629,19 4.065,20 4.179,21 3.78,22 3.665,23 5.306,24 3.643,25 4.533,26 4.678,27 4.161,28 4.052,29 5.8,30 4.009,31 4.75,32 4.906,33 4.266,34 4.172,35 6.034,36 4.124,37 4.855,38 5.032,39 4.325,40 4.17,41 6.147,42 4.112,43 4.817,44 5.005,45 4.162,46 4.098,47 6.165,48 4.019,49 4.739,50 4.949,51 3.935,52 3.97,53 5.999,54 3.893,55 4.605,56 4.804,57 3.798,58 3.854,59 5.825,60 3.789,61 4.569,62 4.793,63 3.738,64 3.792,65 5.769,66 3.708,67 0.115,68 0.862,69 8.544,70 5.1}
{0 CHEMBL2005828,2 17.311,3 17.043,4 0.057,5 22.301,6 4.587,7 187.677,8 8.002,9 102.49,11 5.577,12 1.606,13 12.444,14 2.904,15 8.435,16 103.173,17 8.169,18 0.733,19 3.913,20 4.029,21 3.555,22 3.462,23 5.137,24 3.472,25 4.368,26 4.51,27 3.914,28 3.838,29 5.607,30 3.824,31 4.559,32 4.728,33 3.915,34 3.931,35 5.712,36 3.896,37 4.643,38 4.849,39 3.864,40 3.878,41 5.824,42 3.824,43 4.594,44 4.815,45 3.697,46 3.727,47 5.765,48 3.68,49 4.371,50 4.583,51 3.537,52 3.574,53 5.539,54 3.536,55 4.251,56 4.472,57 3.415,58 3.529,59 5.325,60 3.452,61 4.217,62 4.435,63 3.314,64 3.436,65 5.328,66 3.354,67 0.077,68 0.681,69 7.505,70 5.1}
{0 CHEMBL2005886,2 32.179,3 33.93,4 0.035,5 47.172,6 6.721,7 376.941,8 12.815,9 72.717,11 6.074,12 1.662,13 12.971,14 2.385,15 5.69,16 133.134,17 8,18 0.421,19 4.213,20 4.329,21 3.837,22 3.742,23 5.311,24 3.735,25 4.756,26 4.916,27 4.225,28 4.152,29 5.84,30 4.125,31 5.012,32 5.205,33 4.295,34 4.304,35 6.083,36 4.244,37 5.067,38 5.279,39 4.278,40 4.307,41 6.157,42 4.224,43 5.094,44 5.323,45 4.234,46 4.276,47 6.136,48 4.198,49 5.051,50 5.274,51 4.17,52 4.258,53 6.055,54 4.177,55 5.032,56 5.254,57 4.188,58 4.214,59 6.19,60 4.142,61 4.968,62 5.195,63 4.066,64 4.128,65 6.044,66 4.047,67 0.095,68 0.901,69 11.479,70 5.2}
{0 CHEMBL2005899,2 16.136,3 21.862,4 -0.024,5 23.584,6 4.601,7 328.395,8 9.561,9 36.695,11 6.346,12 1.568,13 7.913,14 0.937,15 0.878,16 87.641,17 7.168,18 0.25,19 3.854,20 3.975,21 3.366,22 3.351,23 5.021,24 3.329,25 4.358,26 4.557,27 3.725,28 3.675,29 5.466,30 3.648,31 4.6,32 4.782,33 3.824,34 3.863,35 5.865,36 3.808,37 4.821,38 5.085,39 3.808,40 3.952,41 5.861,42 3.854,43 4.748,44 4.966,45 3.917,46 3.918,47 6.025,48 3.866,49 4.707,50 4.879,51 3.833,52 3.809,53 6.142,54 3.781,55 4.669,56 4.879,57 3.542,58 3.665,59 5.973,60 3.608,61 4.495,62 4.702,63 3.264,64 3.615,65 5.69,66 3.483,67 0.039,68 0.63,69 9.283,70 5.1}
{0 CHEMBL2005936,2 16.433,3 27.344,4 0.035,5 24.041,6 6.01,7 284.109,8 9.573,9 86.317,11 5.854,12 1.486,13 12.152,14 5.502,15 30.268,16 130.225,17 7.659,18 0.73,19 4.149,20 4.276,21 3.752,22 3.734,23 5.282,24 3.712,25 4.645,26 4.809,27 4.094,28 4.119,29 5.716,30 4.075,31 4.879,32 5.089,33 4.123,34 4.201,35 5.9,36 4.137,37 4.922,38 5.147,39 4.157,40 4.177,41 5.979,42 4.128,43 4.892,44 5.098,45 4.195,46 4.197,47 6.019,48 4.166,49 4.909,50 5.113,51 4.188,52 4.274,53 5.97,54 4.214,55 4.954,56 5.167,57 4.146,58 4.303,59 5.981,60 4.216,61 4.945,62 5.169,63 4.018,64 4.261,65 5.928,66 4.147,67 0.102,68 0.884,69 10.842,70 5.3}
{0 CHEMBL2006010,2 18.345,3 12.983,4 0.033,5 25.308,6 5.122,7 185.84,8 5.976,9 69.593,11 5.954,12 2.064,13 10.385,14 4.797,15 23.014,16 89.78,17 11.463,18 0.607,19 3.72,20 3.808,21 3.614,22 3.297,23 5.068,24 3.337,25 4.221,26 4.325,27 4.11,28 3.661,29 6.102,30 3.696,31 4.409,32 4.553,33 4.256,34 3.775,35 5.952,36 3.786,37 4.383,38 4.537,39 4.068,40 3.657,41 5.906,42 3.679,43 4.341,44 4.506,45 3.948,46 3.517,47 5.922,48 3.549,49 4.233,50 4.408,51 3.729,52 3.355,53 5.754,54 3.38,55 4.036,56 4.177,57 3.769,58 3.251,59 6.001,60 3.285,61 3.893,62 4.046,63 3.578,64 3.262,65 5.37,66 3.26,67 0.316,68 0.742,69 1.038,70 5.1}
{0 CHEMBL2006156,2 15.508,3 27.478,4 -0.024,5 24.392,6 5.71,7 314.895,8 10.071,9 54.706,10 1,11 6.117,12 1.554,13 10.5,14 4.753,15 22.593,16 111.645,17 7.491,18 0.636,19 4.092,20 4.205,21 3.668,22 3.608,23 5.216,24 3.602,25 4.615,26 4.785,27 4.046,28 3.969,29 5.71,30 3.954,31 4.829,32 5.039,33 4.069,34 4.072,35 5.875,36 4.035,37 4.905,38 5.112,39 4.178,40 4.139,41 6.058,42 4.105,43 5.011,44 5.218,45 4.09,46 4.18,47 6.161,48 4.125,49 4.98,50 5.233,51 4.034,52 4.161,53 5.937,54 4.075,55 4.789,56 4.973,57 3.868,58 4.104,59 5.823,60 3.995,61 4.817,62 5.092,63 3.61,64 3.905,65 5.676,66 3.751,67 0.029,68 0.789,69 10.824,70 5.1}
{0 CHEMBL2006188,2 22.508,3 29.416,4 0.034,5 34,6 7.831,7 318.651,8 11.659,9 85.704,11 6.046,12 1.468,13 11.633,14 2.393,15 5.725,16 121.018,17 6.975,18 0.563,19 4.128,20 4.261,21 3.626,22 3.659,23 5.233,24 3.626,25 4.634,26 4.818,27 3.92,28 4.021,29 5.672,30 3.96,31 4.878,32 5.099,33 4.008,34 4.171,35 5.859,36 4.086,37 4.946,38 5.167,39 4.009,40 4.192,41 5.996,42 4.092,43 5.013,44 5.253,45 3.982,46 4.198,47 6.013,48 4.091,49 4.962,50 5.189,51 3.959,52 4.173,53 5.958,54 4.07,55 4.972,56 5.212,57 3.954,58 4.161,59 6.014,60 4.051,61 4.996,62 5.256,63 3.883,64 4.131,65 6.014,66 4.004,67 0.055,68 0.832,69 12.691,70 5.1}
{0 CHEMBL2006237,2 21.255,3 31.325,4 0.005,5 31.619,6 6.092,7 295.88,8 10.523,9 107.513,11 5.561,12 1.517,13 13.345,14 2.057,15 4.231,16 115.076,17 7.028,18 0.5,19 4.123,20 4.271,21 3.642,22 3.598,23 5.171,24 3.582,25 4.677,26 4.887,27 3.986,28 3.994,29 5.698,30 3.951,31 4.926,32 5.167,33 4.001,34 4.138,35 5.866,36 4.051,37 5,38 5.273,39 3.917,40 4.11,41 5.924,42 3.99,43 4.928,44 5.221,45 3.801,46 3.991,47 5.825,48 3.868,49 4.75,50 5.018,51 3.669,52 3.888,53 5.637,54 3.776,55 4.705,56 4.983,57 3.656,58 3.846,59 5.619,60 3.731,61 4.624,62 4.877,63 3.604,64 3.787,65 5.569,66 3.685,67 0.045,68 0.899,69 12.627,70 5.1}
{0 CHEMBL2006263,2 12.483,3 19.396,4 0.063,5 8.394,6 3.863,7 197.337,8 8.192,9 82.873,10 1,11 5.724,12 1.747,13 9.957,14 2.073,15 4.297,16 89.947,17 8.421,18 0.68,19 3.777,20 3.881,21 3.619,22 3.387,23 4.912,24 3.345,25 4.272,26 4.414,27 3.911,28 3.741,29 5.669,30 3.696,31 4.48,32 4.644,33 3.974,34 3.858,35 5.763,36 3.794,37 4.552,38 4.746,39 3.812,40 3.798,41 5.817,42 3.7,43 4.465,44 4.682,45 3.674,46 3.656,47 5.646,48 3.56,49 4.234,50 4.415,51 3.578,52 3.527,53 5.621,54 3.432,55 4.226,56 4.452,57 3.401,58 3.423,59 5.441,60 3.317,61 4.017,62 4.245,63 3.272,64 3.268,65 5.155,66 3.175,67 0.105,68 0.624,69 9.422,70 5.2}
{0 CHEMBL2006276,2 26.994,3 17.481,4 0.041,5 48.592,6 4.097,7 189.169,8 7.757,9 70.818,11 5.587,12 1.584,13 9.48,14 2.718,15 7.387,16 94.534,17 8.107,18 0.643,19 3.846,20 3.958,21 3.488,22 3.402,23 5.036,24 3.409,25 4.315,26 4.452,27 3.835,28 3.769,29 5.486,30 3.762,31 4.57,32 4.735,33 3.984,34 3.936,35 5.718,36 3.918,37 4.646,38 4.838,39 3.903,40 3.917,41 5.811,42 3.873,43 4.633,44 4.841,45 3.776,46 3.889,47 5.718,48 3.826,49 4.514,50 4.728,51 3.653,52 3.766,53 5.623,54 3.681,55 4.411,56 4.641,57 3.451,58 3.603,59 5.444,60 3.511,61 4.207,62 4.432,63 3.268,64 3.382,65 5.298,66 3.308,67 0.059,68 0.621,69 7.082,70 5.1}
{0 CHEMBL2006439,1 1,2 11.088,3 25.548,4 0.024,5 19.407,6 4.085,7 227.486,8 7.508,9 85.153,11 5.528,12 1.549,13 9.217,14 4.262,15 18.165,16 93.388,17 7.996,18 0.615,19 3.831,20 3.961,21 3.471,22 3.403,23 4.864,24 3.377,25 4.386,26 4.564,27 3.861,28 3.82,29 5.409,30 3.76,31 4.667,32 4.917,33 3.83,34 3.91,35 5.531,36 3.807,37 4.605,38 4.866,39 3.814,40 3.801,41 5.527,42 3.702,43 4.47,44 4.72,45 3.736,46 3.705,47 5.439,48 3.618,49 4.343,50 4.551,51 3.83,52 3.675,53 5.41,54 3.597,55 4.285,56 4.478,57 3.645,58 3.639,59 5.33,60 3.513,61 4.204,62 4.419,63 3.333,64 3.523,65 5.083,66 3.365,67 0.02,68 0.652,69 7.805,70 5.8}
{0 CHEMBL2006481,2 8.136,3 20.416,4 0.014,5 8.198,6 3.429,7 211.446,8 6.931,9 56.047,11 5.989,12 1.616,13 9.364,14 2.497,15 6.237,16 82.672,17 7.799,18 0.6,19 3.778,20 3.893,21 3.399,22 3.306,23 4.892,24 3.305,25 4.319,26 4.485,27 3.75,28 3.714,29 5.36,30 3.692,31 4.552,32 4.772,33 3.714,34 3.779,35 5.577,36 3.713,37 4.55,38 4.777,39 3.621,40 3.653,41 5.66,42 3.595,43 4.306,44 4.525,45 3.443,46 3.455,47 5.377,48 3.416,49 4.158,50 4.34,51 3.385,52 3.306,53 5.32,54 3.295,55 4.013,56 4.211,57 3.181,58 3.16,59 5.134,60 3.139,61 3.801,62 3.982,63 2.974,64 3.111,65 4.836,66 3.04,67 0.106,68 0.6,69 7.297,70 5.1}
{0 CHEMBL2006493,2 16.524,3 12.248,4 0.028,5 20.068,6 2.806,7 167.23,8 6.249,11 6.152,12 1.708,13 7.15,14 2.757,15 7.603,16 65.454,17 9.732,18 0.273,19 3.531,20 3.593,21 3.29,22 3.1,23 4.819,24 3.143,25 4.126,26 4.228,27 3.817,28 3.502,29 5.972,30 3.551,31 4.352,32 4.484,33 3.847,34 3.598,35 5.795,36 3.652,37 4.369,38 4.5,39 3.784,40 3.425,41 6.063,42 3.515,43 4.116,44 4.239,45 3.475,46 3.192,47 5.779,48 3.25,49 3.788,50 3.931,51 3.193,52 2.992,53 5.265,54 3.019,55 3.778,56 3.953,57 3.168,58 2.715,59 5.749,60 2.772,61 3.525,62 3.78,63 2.658,64 2.188,65 5.043,66 2.304,67 0.268,68 0.6,69 2.614,70 5.1}
{0 CHEMBL2006580,2 13.245,3 10.908,4 0.078,5 20.57,6 3.055,7 152.459,8 4.309,9 51.582,11 5.129,12 1.94,13 7.389,14 3.459,15 11.963,16 73.29,17 10.683,18 0.8,19 3.424,20 3.503,21 3.344,22 3.111,23 4.686,24 3.077,25 3.841,26 3.937,27 3.738,28 3.475,29 5.12,30 3.424,31 4.011,32 4.147,33 3.825,34 3.493,35 5.254,36 3.418,37 3.965,38 4.148,39 3.617,40 3.291,41 5.185,42 3.227,43 3.781,44 3.979,45 3.28,46 3.21,47 4.883,48 3.099,49 3.62,50 3.76,51 3.32,52 3.175,53 4.822,54 3.075,55 3.621,56 3.777,57 3.208,58 3.083,59 4.843,60 2.921,61 3.272,62 3.458,63 2.678,64 2.538,65 4.471,66 2.383,67 0.095,68 0.385,69 2.09,70 5.1}
{0 CHEMBL2006631,2 20.97,3 27.853,4 0.039,5 31.62,6 4.615,7 269.567,8 11.744,9 37.54,11 6.318,12 1.672,13 9.5,14 3.495,15 12.213,16 109.227,17 8.372,18 0.581,19 3.964,20 4.059,21 3.781,22 3.593,23 5.082,24 3.553,25 4.481,26 4.618,27 4.115,28 3.993,29 5.798,30 3.943,31 4.749,32 4.884,33 4.265,34 4.21,35 5.99,36 4.144,37 4.933,38 5.114,39 4.203,40 4.191,41 6.225,42 4.128,43 4.811,44 4.984,45 4.084,46 4.152,47 6.044,48 4.071,49 4.776,50 4.978,51 3.903,52 4.05,53 5.899,54 3.94,55 4.668,56 4.892,57 3.779,58 3.919,59 5.75,60 3.79,61 4.553,62 4.787,63 3.798,64 3.764,65 5.616,66 3.654,67 0.097,68 0.7,69 10.642,70 5.1}
{0 CHEMBL2006715,2 30.521,3 29.837,4 0.018,5 47.849,6 7.527,7 297.483,8 11.992,9 90.789,11 6.465,12 1.772,13 15.364,14 6.348,15 40.302,16 162.495,17 9.07,18 0.66,19 4.347,20 4.448,21 4.108,22 3.957,23 5.569,24 3.954,25 4.851,26 4.983,27 4.515,28 4.347,29 6.099,30 4.336,31 5.095,32 5.277,33 4.533,34 4.425,35 6.325,36 4.406,37 5.088,38 5.262,39 4.576,40 4.39,41 6.607,42 4.383,43 5.094,44 5.267,45 4.553,46 4.465,47 6.329,48 4.432,49 5.125,50 5.308,51 4.566,52 4.505,53 6.325,54 4.445,55 5.127,56 5.322,57 4.497,58 4.44,59 6.314,60 4.381,61 5.056,62 5.263,63 4.416,64 4.356,65 6.251,66 4.308,67 0.151,68 1.176,69 8.916,70 5.1}
{0 CHEMBL2006778,1 1,2 11.573,3 17.444,4 0.095,5 7.825,6 4.541,7 178.169,8 9.742,9 84.479,11 6.045,12 1.734,13 10.519,14 3.173,15 10.065,16 109.275,17 8.647,18 0.667,19 3.905,20 4.018,21 3.635,22 3.536,23 5.118,24 3.504,25 4.382,26 4.528,27 4.029,28 3.938,29 5.594,30 3.889,31 4.566,32 4.72,33 4.106,34 4.047,35 5.808,36 3.983,37 4.669,38 4.847,39 4.126,40 4.072,41 5.878,42 3.985,43 4.588,44 4.774,45 3.949,46 3.981,47 5.753,48 3.872,49 4.554,50 4.747,51 4.041,52 3.868,53 5.833,54 3.808,55 4.455,56 4.649,57 3.893,58 3.788,59 5.733,60 3.71,61 4.41,62 4.623,63 3.609,64 3.661,65 5.651,66 3.557,67 0.077,68 0.732,69 7.32,70 5.1}
{0 CHEMBL2006785,2 13.727,3 14.045,4 0.054,5 14.03,6 4.472,7 209.382,8 7.022,9 49.07,11 5.914,12 1.811,13 8.783,14 5.462,15 29.831,16 94.863,17 10.947,18 0.64,19 3.613,20 3.68,21 3.553,22 3.393,23 4.886,24 3.336,25 4.07,26 4.161,27 3.998,28 3.8,29 5.309,30 3.716,31 4.293,32 4.397,33 4.23,34 3.9,35 5.623,36 3.809,37 4.337,38 4.486,39 4.103,40 3.806,41 5.665,42 3.7,43 4.169,44 4.322,45 4.003,46 3.614,47 5.592,48 3.546,49 3.962,50 4.062,51 3.878,52 3.521,53 5.676,54 3.475,55 3.956,56 4.068,57 3.752,58 3.498,59 5.494,60 3.406,61 3.829,62 3.978,63 3.448,64 3.375,65 5.097,66 3.23,67 0.06,68 0.377,69 1.78,70 5.1}
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{0 CHEMBL2007002,2 12.596,3 17.547,4 0.066,5 15.484,6 4.629,7 243.624,8 7.992,9 51.337,11 5.904,12 1.568,13 10.778,14 3.922,15 15.379,16 102.25,17 8.168,18 0.733,19 3.91,20 4.01,21 3.551,22 3.487,23 5.14,24 3.489,25 4.364,26 4.488,27 3.899,28 3.856,29 5.57,30 3.845,31 4.575,32 4.727,33 3.968,34 3.955,35 5.824,36 3.923,37 4.633,38 4.817,39 3.878,40 3.906,41 5.833,42 3.861,43 4.597,44 4.797,45 3.775,46 3.837,47 5.765,48 3.788,49 4.492,50 4.676,51 3.793,52 3.783,53 5.686,54 3.753,55 4.456,56 4.634,57 3.703,58 3.735,59 5.648,60 3.698,61 4.436,62 4.654,63 3.563,64 3.631,65 5.55,66 3.565,67 0.097,68 0.621,69 7.479,70 5.3}
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{0 CHEMBL208637,2 15.702,3 12.188,4 -0.006,5 22.096,6 4.094,7 142.085,8 3.394,9 98.753,11 5.062,12 1.727,13 6.375,14 0.343,15 0.117,16 59.26,17 7.866,18 0.375,19 3.424,20 3.553,21 2.998,22 2.848,23 4.736,24 2.871,25 3.878,26 4.059,27 3.299,28 3.115,29 5.152,30 3.124,31 4.03,32 4.216,33 3.347,34 3.172,35 5.353,36 3.207,37 3.975,38 4.164,39 3.395,40 3.165,41 5.525,42 3.167,43 3.983,44 4.181,45 3.096,46 3.12,47 5.269,48 3.096,49 3.923,50 4.141,51 2.979,52 3.024,53 5.335,54 2.942,55 3.883,56 4.156,57 2.389,58 2.771,59 5.104,60 2.637,61 3.551,62 3.882,63 1.992,64 2.352,65 4.836,66 2.144,67 0.089,68 0.411,69 5.242,70 5.1}
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{0 CHEMBL513909,2 41.796,3 47.751,4 -0.029,5 69.22,6 8.292,7 496.821,8 15.746,9 78.966,11 6.218,12 1.525,13 14.237,14 3.655,15 13.36,16 148.213,17 6.776,18 0.286,19 4.432,20 4.57,21 3.921,22 3.892,23 5.424,24 3.869,25 5.038,26 5.248,27 4.303,28 4.321,29 5.967,30 4.272,31 5.327,32 5.562,33 4.434,34 4.515,35 6.261,36 4.439,37 5.431,38 5.678,39 4.445,40 4.554,41 6.405,42 4.474,43 5.442,44 5.683,45 4.457,46 4.572,47 6.485,48 4.487,49 5.406,50 5.644,51 4.35,52 4.546,53 6.381,54 4.44,55 5.411,56 5.686,57 4.183,58 4.452,59 6.3,60 4.321,61 5.263,62 5.539,63 4.107,64 4.326,65 6.139,66 4.205,67 0.032,68 1.179,69 18.11,70 5.377}
{0 CHEMBL514499,2 26.813,3 18.464,4 0.01,5 29.695,6 6.547,7 246.482,8 11.288,9 51.582,11 6.444,12 1.934,13 11.818,14 4.685,15 21.946,16 116.287,17 9.363,18 0.583,19 4.078,20 4.161,21 3.849,22 3.604,23 5.347,24 3.624,25 4.604,26 4.724,27 4.312,28 3.973,29 6.258,30 3.993,31 4.685,32 4.79,33 4.369,34 4.075,35 6.011,36 4.083,37 4.847,38 4.977,39 4.393,40 4.133,41 6.243,42 4.123,43 4.956,44 5.14,45 4.252,46 4.067,47 6.328,48 4.039,49 4.718,50 4.892,51 4.16,52 4.005,53 5.955,54 3.973,55 4.754,56 4.927,57 4.251,58 4.027,59 6.077,60 3.991,61 4.741,62 4.904,63 4.276,64 3.919,65 6.146,66 3.912,67 0.297,68 0.94,69 6.594,70 5.1}
{0 CHEMBL519697,2 21.854,3 30.473,4 -0.006,5 26.047,6 6.066,7 332.796,8 11.017,9 70.879,11 6.049,12 1.526,13 13.516,14 4.209,15 17.719,16 117.512,17 7.42,18 0.471,19 4.113,20 4.236,21 3.679,22 3.668,23 5.233,24 3.645,25 4.666,26 4.849,27 4.048,28 4.08,29 5.708,30 4.031,31 4.952,32 5.164,33 4.146,34 4.226,35 6.026,36 4.159,37 5.034,38 5.263,39 4.064,40 4.173,41 6.2,42 4.097,43 4.931,44 5.169,45 3.965,46 4.076,47 6.03,48 4,49 4.864,50 5.1,51 3.923,52 4.064,53 5.944,54 3.978,55 4.82,56 5.054,57 3.881,58 4.049,59 5.92,60 3.953,61 4.772,62 5.02,63 3.727,64 3.982,65 5.74,66 3.855,67 0.009,68 0.843,69 11.107,70 5.1}
{0 CHEMBL521851,2 24.599,3 43.941,4 -0.008,5 35.664,6 6.23,7 361.361,8 15.122,9 74.664,11 6.634,12 1.78,13 12.029,14 2.892,15 8.361,16 136.875,17 8.286,18 0.5,19 4.265,20 4.373,21 4.076,22 3.821,23 5.256,24 3.78,25 4.867,26 5.038,27 4.41,28 4.247,29 6.005,30 4.193,31 5.085,32 5.279,33 4.431,34 4.39,35 6.061,36 4.298,37 5.148,38 5.363,39 4.399,40 4.418,41 6.122,42 4.302,43 5.146,44 5.383,45 4.367,46 4.396,47 6.121,48 4.26,49 4.99,50 5.187,51 4.34,52 4.365,53 5.882,54 4.246,55 4.978,56 5.161,57 4.376,58 4.342,59 5.958,60 4.235,61 5.064,62 5.284,63 4.373,64 4.333,65 5.977,66 4.213,67 0.138,68 1.053,69 14.833,70 5}
{0 CHEMBL522892,2 24.416,3 25.624,4 0.043,5 38.408,6 4.391,7 225.254,8 11.103,9 90.728,11 6.242,12 1.644,13 11.483,14 1.782,15 3.174,16 110.583,17 7.85,18 0.485,19 4.047,20 4.179,21 3.661,22 3.564,23 5.18,24 3.569,25 4.589,26 4.768,27 4.07,28 3.99,29 5.696,30 3.982,31 4.85,32 5.047,33 4.167,34 4.158,35 5.955,36 4.124,37 4.961,38 5.19,39 4.158,40 4.149,41 6.204,42 4.082,43 4.929,44 5.188,45 3.955,46 4.015,47 6.03,48 3.953,49 4.683,50 4.915,51 3.899,52 3.876,53 5.946,54 3.823,55 4.553,56 4.765,57 3.733,58 3.765,59 5.709,60 3.722,61 4.466,62 4.715,63 3.529,64 3.669,65 5.461,66 3.571,67 0.083,68 0.886,69 9.549,70 5.05}
{0 CHEMBL52387,2 24.833,3 28.413,4 -0.016,5 38.665,6 6.069,7 313.419,8 8.473,9 88.277,11 5.526,12 1.5,13 9.462,14 3.181,15 10.12,16 106.143,17 6.817,18 0.571,19 4.034,20 4.18,21 3.519,22 3.496,23 5.088,24 3.472,25 4.572,26 4.785,27 3.856,28 3.869,29 5.559,30 3.815,31 4.81,32 5.061,33 3.912,34 3.985,35 5.757,36 3.906,37 4.882,38 5.147,39 3.89,40 3.981,41 5.84,42 3.892,43 4.843,44 5.117,45 3.806,46 3.913,47 5.833,48 3.834,49 4.671,50 4.9,51 3.827,52 3.894,53 5.652,54 3.838,55 4.764,56 4.999,57 3.846,58 3.969,59 5.745,60 3.896,61 4.877,62 5.132,63 3.736,64 4.031,65 5.779,66 3.9,67 0.052,68 0.803,69 12.071,70 5.1}
{0 CHEMBL525191,2 10.747,3 20.378,4 0.054,5 8.152,6 4.244,7 273.827,8 7.747,9 48.473,11 5.762,12 1.571,13 9.36,14 2.407,15 5.796,16 95.753,17 7.777,18 0.607,19 3.887,20 3.997,21 3.491,22 3.444,23 5.086,24 3.433,25 4.376,26 4.534,27 3.818,28 3.851,29 5.433,30 3.817,31 4.601,32 4.805,33 3.851,34 3.954,35 5.622,36 3.889,37 4.61,38 4.801,39 3.855,40 3.935,41 5.719,42 3.874,43 4.636,44 4.853,45 3.777,46 3.9,47 5.678,48 3.828,49 4.539,50 4.74,51 3.71,52 3.879,53 5.524,54 3.791,55 4.612,56 4.842,57 3.659,58 3.849,59 5.599,60 3.744,61 4.589,62 4.841,63 3.498,64 3.676,65 5.628,66 3.571,67 0.128,68 0.648,69 8.273,70 5}
{0 CHEMBL526133,2 10.63,3 12.775,4 0.06,5 16.814,6 3.008,7 142.856,8 5.749,9 68.122,11 5.941,12 1.543,13 8.591,14 2.837,15 8.05,16 85.795,17 8.48,18 0.64,19 3.67,20 3.78,21 3.358,22 3.291,23 4.883,24 3.291,25 4.123,26 4.25,27 3.714,28 3.675,29 5.374,30 3.655,31 4.326,32 4.501,33 3.676,34 3.753,35 5.438,36 3.7,37 4.324,38 4.529,39 3.575,40 3.66,41 5.422,42 3.599,43 4.244,44 4.448,45 3.537,46 3.557,47 5.421,48 3.513,49 4.17,50 4.354,51 3.488,52 3.452,53 5.462,54 3.432,55 4.022,56 4.211,57 3.282,58 3.306,59 5.25,60 3.27,61 3.87,62 4.077,63 3.059,64 3.131,65 5.093,66 3.054,67 0.059,68 0.523,69 5.077,70 5.1}
{0 CHEMBL535,1 1,2 25.99,3 29.378,4 0.012,5 30.71,6 6.557,7 332.796,8 11.644,9 55.931,11 5.705,12 1.584,13 11.655,14 2.998,15 8.987,16 113.678,17 7.117,18 0.355,19 4.101,20 4.238,21 3.612,22 3.603,23 5.199,24 3.578,25 4.649,26 4.852,27 3.983,28 3.985,29 5.735,30 3.943,31 4.864,32 5.08,33 4.051,34 4.122,35 5.954,36 4.066,37 4.978,38 5.196,39 4.03,40 4.168,41 6.076,42 4.077,43 5.06,44 5.324,45 3.954,46 4.095,47 6.164,48 3.994,49 4.949,50 5.221,51 3.905,52 4.029,53 6.047,54 3.935,55 4.824,56 5.053,57 3.867,58 3.978,59 5.943,60 3.895,61 4.825,62 5.057,63 3.837,64 3.927,65 6.073,66 3.851,67 0.042,68 0.89,69 12.112,70 5.675}
{0 CHEMBL535331,1 1,2 5.093,3 14.144,4 0.066,5 2.5,6 2.942,7 117.711,8 4.889,9 84.908,11 5.158,12 1.449,13 9.619,14 3.635,15 13.211,16 83.932,17 8.098,18 0.833,19 3.672,20 3.801,21 3.326,22 3.255,23 4.836,24 3.253,25 4.12,26 4.268,27 3.663,28 3.635,29 5.248,30 3.61,31 4.303,32 4.514,33 3.581,34 3.634,35 5.351,36 3.575,37 4.243,38 4.482,39 3.361,40 3.454,41 5.245,42 3.375,43 4.02,44 4.283,45 3.072,46 3.149,47 4.997,48 3.072,49 3.844,50 4.104,51 3.018,52 3.028,53 4.835,54 2.981,55 3.713,56 3.933,57 3.05,58 3.049,59 4.762,60 3.011,61 3.742,62 3.953,63 3.031,64 3.129,65 4.726,66 3.069,67 0.056,68 0.564,69 5.91,70 5.1}
{0 CHEMBL539474,1 1,2 22.608,3 19.342,4 0.007,5 30.643,6 2.858,7 215.085,8 7.032,9 23.034,11 5.95,12 1.577,13 8.048,14 1.541,15 2.374,16 78.274,17 7.815,18 0.458,19 3.719,20 3.833,21 3.342,22 3.276,23 4.811,24 3.273,25 4.277,26 4.437,27 3.743,28 3.705,29 5.363,30 3.682,31 4.531,32 4.732,33 3.735,34 3.799,35 5.612,36 3.741,37 4.508,38 4.721,39 3.609,40 3.716,41 5.64,42 3.652,43 4.355,44 4.582,45 3.39,46 3.59,47 5.408,48 3.492,49 4.219,50 4.45,51 3.196,52 3.389,53 5.247,54 3.284,55 4.056,56 4.302,57 3.042,58 3.134,59 5.106,60 3.045,61 3.836,62 4.066,63 2.957,64 2.969,65 4.901,66 2.92,67 0.031,68 0.556,69 6.689,70 5.1}
{0 CHEMBL553,2 25.355,3 23.177,4 -0.05,5 33.398,6 7.655,7 302.964,8 9.042,9 51.582,11 5.609,12 1.568,13 11.345,14 4.31,15 18.575,16 110.749,17 7.567,18 0.548,19 4.05,20 4.152,21 3.627,22 3.526,23 5.216,24 3.534,25 4.559,26 4.716,27 3.895,28 3.835,29 5.642,30 3.833,31 4.683,32 4.845,33 3.989,34 3.966,35 5.793,36 3.938,37 4.733,38 4.933,39 3.953,40 3.987,41 5.768,42 3.933,43 4.809,44 5.016,45 3.978,46 3.993,47 5.841,48 3.949,49 4.756,50 4.929,51 4.008,52 4.017,53 5.839,54 3.974,55 4.81,56 5.008,57 3.969,58 4.04,59 5.839,60 3.981,61 4.868,62 5.089,63 3.861,64 3.961,65 5.891,66 3.89,67 0.054,68 0.714,69 10.332,70 5.05}
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