@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL2323

@attribute molecule_id {CHEMBL11501,CHEMBL115426,CHEMBL115630,CHEMBL115701,CHEMBL115757,CHEMBL11585,CHEMBL115957,CHEMBL116036,CHEMBL116037,CHEMBL116264,CHEMBL116358,CHEMBL11641,CHEMBL116429,CHEMBL116458,CHEMBL116477,CHEMBL11651,CHEMBL11659,CHEMBL116623,CHEMBL116746,CHEMBL116863,CHEMBL116894,CHEMBL117023,CHEMBL117232,CHEMBL117255,CHEMBL117336,CHEMBL117450,CHEMBL117508,CHEMBL117706,CHEMBL117801,CHEMBL117839,CHEMBL117891,CHEMBL117905,CHEMBL118025,CHEMBL11843,CHEMBL11844,CHEMBL118907,CHEMBL118908,CHEMBL119011,CHEMBL11929,CHEMBL119622,CHEMBL11966,CHEMBL12145,CHEMBL129157,CHEMBL129831,CHEMBL130122,CHEMBL130146,CHEMBL130345,CHEMBL130359,CHEMBL130580,CHEMBL130599,CHEMBL130629,CHEMBL130722,CHEMBL131002,CHEMBL131257,CHEMBL131540,CHEMBL131639,CHEMBL131707,CHEMBL131779,CHEMBL131866,CHEMBL132526,CHEMBL132566,CHEMBL132611,CHEMBL132732,CHEMBL132987,CHEMBL133243,CHEMBL133521,CHEMBL133707,CHEMBL133749,CHEMBL133806,CHEMBL133936,CHEMBL133970,CHEMBL134092,CHEMBL273817,CHEMBL274606,CHEMBL275570,CHEMBL311735,CHEMBL324834,CHEMBL325147,CHEMBL325223,CHEMBL325401,CHEMBL326290,CHEMBL331383,CHEMBL331850,CHEMBL332924,CHEMBL333388,CHEMBL334744,CHEMBL335706,CHEMBL337462,CHEMBL337608,CHEMBL337635,CHEMBL337684,CHEMBL337830,CHEMBL338957,CHEMBL339174,CHEMBL339869,CHEMBL341219,CHEMBL413308,CHEMBL417071,CHEMBL419590,CHEMBL420872,CHEMBL421910,CHEMBL432433,CHEMBL432443,CHEMBL433112,CHEMBL435203,CHEMBL441280,CHEMBL444594,CHEMBL48605,CHEMBL48837,CHEMBL48945,CHEMBL51128}
@attribute CATS2D_04_DD numeric
@attribute SpMAD_EA.ed. numeric
@attribute Eig03_AEA.ed. numeric
@attribute Eig03_EA numeric
@attribute Eig03_EA.ed. numeric
@attribute SM11_AEA.bo. numeric
@attribute SM12_AEA.dm. numeric
@attribute PW3 numeric
@attribute CATS2D_06_DA numeric
@attribute Eig03_EA.ri. numeric
@attribute Eig03_AEA.ri. numeric
@attribute Eig05_AEA.dm. numeric
@attribute Eig02_AEA.ri. numeric
@attribute Eig02_EA numeric
@attribute SM10_AEA.bo. numeric
@attribute SM07_EA.ed. numeric
@attribute SM08_EA.ed. numeric
@attribute SM09_EA.ed. numeric
@attribute SM12_AEA.ed. numeric
@attribute SM13_AEA.ed. numeric
@attribute SM14_AEA.ed. numeric
@attribute SM15_AEA.ed. numeric
@attribute GGI2 numeric
@attribute Eig03_AEA.bo. numeric
@attribute IC3 numeric
@attribute Eig06_EA.dm. numeric
@attribute Eta_betaS_A numeric
@attribute SM05_EA numeric
@attribute SM09_EA.ri. numeric
@attribute SM03_EA.ed. numeric
@attribute SM05_AEA.ed. numeric
@attribute SM06_AEA.ed. numeric
@attribute SM03_EA.ri. numeric
@attribute SM05_EA.ri. numeric
@attribute SM07_EA.ri. numeric
@attribute SM08_EA.ri. numeric
@attribute SM10_EA.ri. numeric
@attribute Eig01_EA.bo. numeric
@attribute SM11_AEA.ri. numeric
@attribute SpMax_EA.bo. numeric
@attribute TIC1 numeric
@attribute SM10_AEA.ed. numeric
@attribute SM11_AEA.ed. numeric
@attribute SM15_EA numeric
@attribute SM15_EA.ed. numeric
@attribute SM04_EA.ed. numeric
@attribute SM05_EA.ed. numeric
@attribute SM06_EA.ed. numeric
@attribute SM07_AEA.ed. numeric
@attribute SM07_EA numeric
@attribute SM08_AEA.ed. numeric
@attribute SM08_EA numeric
@attribute SM09_AEA.ed. numeric
@attribute SM09_EA numeric
@attribute SM10_EA numeric
@attribute SM11_EA numeric
@attribute SM12_EA numeric
@attribute SM13_EA numeric
@attribute SM14_EA numeric
@attribute SM10_EA.ed. numeric
@attribute SM11_EA.ed. numeric
@attribute SM12_EA.ed. numeric
@attribute pXC50 numeric

@data
{2 3.794,3 5.376,4 2.533,5 7.009,6 2.533,7 7.009,8 0.288,9 2,10 2.487,11 3.516,12 2.816,13 3.752,14 2.761,15 2.761,16 16.057,17 18.402,18 20.419,19 22.641,20 24.411,21 26.188,22 27.97,23 3.111,24 3.847,25 5.315,26 0.363,27 0.61,28 6.312,29 10.275,30 7.222,31 10.544,32 12.222,33 4.057,34 6.224,35 8.259,36 9.441,37 11.369,38 3.625,39 3.625,40 3.625,41 254.727,42 19.122,43 20.877,44 16.627,45 33.559,46 10.207,47 11.688,48 14.219,49 13.923,50 8.379,51 15.643,52 9.584,53 17.376,54 10.426,55 11.54,56 12.479,57 13.553,58 14.546,59 15.605,60 22.682,61 24.79,62 27.016,63 4.658}
{0 CHEMBL115426,2 3.683,3 5.34,4 2.523,5 6.966,6 2.523,7 6.966,8 0.309,9 1,10 2.523,11 3.523,12 2.718,13 3.778,14 2.779,15 2.779,16 16.191,17 18.563,18 20.637,19 22.794,20 24.598,21 26.408,22 28.222,23 3.111,24 3.896,25 5.204,26 0.057,27 0.581,28 6.176,29 10.39,30 7.135,31 10.463,32 12.169,33 3.906,34 6.181,35 8.302,36 9.501,37 11.502,38 3.458,39 3.458,40 3.458,41 208.327,42 19.207,43 20.997,44 16.728,45 34,46 10.165,47 11.728,48 14.28,49 13.903,50 8.309,51 15.657,52 9.534,53 17.426,54 10.409,55 11.538,56 12.507,57 13.595,58 14.612,59 15.686,60 22.931,61 25.085,62 27.346,63 5.125}
{0 CHEMBL115630,2 3.791,3 5.362,4 2.54,5 7.018,6 2.54,7 7.018,8 0.313,9 1,10 2.497,11 3.523,12 2.761,13 3.776,14 2.785,15 2.785,16 16.256,17 18.618,18 20.679,19 22.862,20 24.658,21 26.461,22 28.269,23 3.333,24 3.901,25 4.866,26 0.636,27 0.603,28 6.293,29 10.437,30 7.256,31 10.592,32 12.291,33 3.997,34 6.258,35 8.363,36 9.57,37 11.552,38 3.487,39 3.487,40 3.487,41 219.298,42 19.291,43 21.072,44 16.795,45 34.012,46 10.285,47 11.821,48 14.365,49 14.015,50 8.42,51 15.76,52 9.661,53 17.519,54 10.51,55 11.646,56 12.596,57 13.686,58 14.69,59 15.762,60 22.967,61 25.112,62 27.369,63 5.398}
{0 CHEMBL115701,1 1,2 3.69,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.309,9 2,10 2.522,11 3.522,12 2.76,13 3.778,14 2.782,15 2.782,16 16.255,17 18.616,18 20.677,19 22.862,20 24.658,21 26.46,22 28.268,23 3.333,24 3.897,25 5.277,26 0.294,27 0.595,28 6.293,29 10.492,30 7.256,31 10.611,32 12.303,33 4.01,34 6.285,35 8.404,36 9.63,37 11.619,38 3.459,39 3.459,40 3.459,41 251.928,42 19.293,43 21.073,44 16.789,45 34.009,46 10.294,47 11.821,48 14.366,49 14.024,50 8.42,51 15.765,52 9.674,53 17.523,54 10.509,55 11.651,56 12.593,57 13.686,58 14.685,59 15.758,60 22.964,61 25.11,62 27.366,63 5.921}
{0 CHEMBL115757,1 1,2 3.804,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.303,9 2,10 2.497,11 3.522,12 2.76,13 3.779,14 2.783,15 2.783,16 16.201,17 18.572,18 20.642,19 22.808,20 24.61,21 26.417,22 28.23,23 3.333,24 3.897,25 4.976,26 0.294,27 0.597,28 6.256,29 10.425,30 7.191,31 10.506,32 12.209,33 4.01,34 6.245,35 8.343,36 9.519,37 11.529,38 3.46,39 3.46,40 3.46,41 212.209,42 19.227,43 21.014,44 16.749,45 34.004,46 10.195,47 11.749,48 14.297,49 13.939,50 8.363,51 15.687,52 9.57,53 17.451,54 10.447,55 11.567,56 12.536,57 13.62,58 14.636,59 15.707,60 22.937,61 25.089,62 27.351,63 5.398}
{0 CHEMBL11585,2 3.711,3 5.321,4 2.438,5 6.873,6 2.438,7 6.873,8 0.286,9 2,10 2.414,11 3.428,12 2.814,13 3.744,14 2.753,15 2.753,16 16.026,17 18.373,18 20.399,19 22.599,20 24.375,21 26.155,22 27.941,23 2.667,24 3.776,25 5.242,26 0.363,27 0.606,28 6.217,29 10.218,30 7.14,31 10.471,32 12.151,33 3.971,34 6.148,35 8.194,36 9.388,37 11.319,38 3.474,39 3.474,40 3.474,41 239.656,42 19.07,43 20.831,44 16.572,45 33.551,46 10.146,47 11.637,48 14.175,49 13.855,50 8.295,51 15.58,52 9.515,53 17.319,54 10.351,55 11.474,56 12.412,57 13.492,58 14.486,59 15.549,60 22.663,61 24.776,62 27.004,63 5.824}
{0 CHEMBL115957,2 4.277,3 6.156,4 2.841,5 9.106,6 2.841,7 9.106,8 0.332,9 1,10 2.834,11 3.84,12 2.846,13 3.961,14 2.959,15 2.959,16 17.939,17 20.474,18 22.909,19 24.239,20 26.179,21 28.126,22 30.079,23 4.667,24 4.186,25 5.216,27 0.594,28 6.825,29 11.062,30 7.97,31 11.02,32 12.845,33 4.277,34 6.64,35 8.865,36 10.061,37 12.199,38 4.734,39 4.734,40 4.734,41 214.864,42 20.386,43 22.308,44 18.588,45 37.977,46 10.988,47 12.992,48 15.627,49 14.701,50 9.163,51 16.579,52 10.408,53 18.475,54 11.491,55 12.691,56 13.836,57 15.027,58 16.202,59 17.397,60 25.424,61 27.911,62 30.427,63 4.721}
{0 CHEMBL116036,1 1,2 3.499,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.297,9 2,10 2.497,11 3.522,12 2.76,13 3.778,14 2.782,15 2.782,16 16.192,17 18.566,18 20.639,19 22.798,20 24.601,21 26.41,22 28.224,23 3.111,24 3.897,25 5.121,26 0.294,27 0.581,28 6.176,29 10.392,30 7.135,31 10.505,32 12.198,33 3.895,34 6.166,35 8.292,36 9.517,37 11.52,38 3.459,39 3.459,40 3.459,41 246.876,42 19.212,43 21.001,44 16.735,45 34.002,46 10.189,47 11.728,48 14.288,49 13.922,50 8.309,51 15.67,52 9.565,53 17.434,54 10.41,55 11.555,56 12.51,57 13.607,58 14.618,59 15.695,60 22.934,61 25.087,62 27.348,63 5.301}
{0 CHEMBL116037,2 4.253,3 6.169,4 2.866,5 9.135,6 2.866,7 9.135,8 0.324,9 2,10 2.856,11 3.865,12 3.084,13 3.978,14 2.98,15 2.98,16 17.998,17 20.524,18 22.944,19 24.315,20 26.245,21 28.183,22 30.128,23 5.556,24 4.192,25 5.188,26 0.14,27 0.594,28 6.995,29 11.212,30 8.109,31 11.191,32 13,33 4.499,34 6.834,35 9.035,36 10.223,37 12.341,38 4.734,39 4.734,40 4.734,41 272.87,42 20.484,43 22.394,44 18.642,45 37.983,46 11.128,47 13.085,48 15.714,49 14.841,50 9.301,51 16.704,52 10.538,53 18.586,54 11.603,55 12.793,56 13.925,57 15.107,58 16.272,59 17.459,60 25.452,61 27.931,62 30.442,63 4.602}
{0 CHEMBL116264,2 3.778,3 5.116,4 2.354,5 6.148,6 2.354,7 6.148,8 0.299,9 1,10 2.229,11 3.308,12 2.367,13 3.773,14 2.78,15 2.78,16 16.133,17 18.515,18 20.6,19 22.737,20 24.547,21 26.363,22 28.182,23 3.111,24 3.597,25 4.745,26 0.181,27 0.596,28 6.133,29 10.27,30 7.06,31 10.348,32 12.067,33 3.88,34 6.096,35 8.187,36 9.322,37 11.353,38 3.458,39 3.458,40 3.458,41 155.046,42 19.136,43 20.933,44 16.684,45 33.993,46 10.056,47 11.648,48 14.206,49 13.81,50 8.245,51 15.572,52 9.42,53 17.348,54 10.34,55 11.446,56 12.443,57 13.523,58 14.558,59 15.63,60 22.903,61 25.063,62 27.329,63 6.398}
{0 CHEMBL116358,2 3.689,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.302,9 1,10 2.497,11 3.522,12 2.761,13 3.775,14 2.783,15 2.783,16 16.208,17 18.585,18 20.661,19 22.801,20 24.606,21 26.416,22 28.23,23 3.111,24 3.897,25 5.257,26 0.294,27 0.597,28 6.176,29 10.348,30 7.135,31 10.464,32 12.172,33 3.88,34 6.14,35 8.257,36 9.451,37 11.459,38 3.46,39 3.46,40 3.46,41 207.853,42 19.212,43 21.003,44 16.749,45 34.044,46 10.177,47 11.736,48 14.298,49 13.907,50 8.313,51 15.661,52 9.541,53 17.431,54 10.417,55 11.549,56 12.519,57 13.61,58 14.629,59 15.705,60 22.959,61 25.115,62 27.38,63 4.699}
{0 CHEMBL11641,2 3.737,3 5.352,4 2.43,5 6.901,6 2.43,7 6.901,8 0.292,9 2,10 2.384,11 3.413,12 2.455,13 3.749,14 2.758,15 2.758,16 16.217,17 18.593,18 20.704,19 22.772,20 24.587,21 26.405,22 28.228,23 2.667,24 3.512,25 4.858,26 0.198,27 0.583,28 6.133,29 10.24,30 7.086,31 10.36,32 12.08,33 3.884,34 6.092,35 8.174,36 9.327,37 11.326,38 3.28,39 3.28,40 3.28,41 177.488,42 19.163,43 20.964,44 16.739,45 34.175,46 10.092,47 11.707,48 14.262,49 13.826,50 8.256,51 15.592,52 9.443,53 17.372,54 10.363,55 11.477,56 12.477,57 13.563,58 14.603,59 15.68,60 23.005,61 25.189,62 27.459,63 8.398}
{0 CHEMBL116429,1 1,2 3.577,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.301,9 2,10 2.497,11 3.522,12 2.76,13 3.778,14 2.782,15 2.782,16 16.192,17 18.566,18 20.639,19 22.797,20 24.6,21 26.41,22 28.223,23 3.111,24 3.897,25 5.278,26 0.294,27 0.588,28 6.176,29 10.392,30 7.135,31 10.484,32 12.184,33 3.895,34 6.166,35 8.292,36 9.501,37 11.512,38 3.459,39 3.459,40 3.459,41 230.316,42 19.21,43 20.999,44 16.735,45 34.002,46 10.178,47 11.728,48 14.285,49 13.913,50 8.309,51 15.664,52 9.55,53 17.431,54 10.41,55 11.548,56 12.51,57 13.603,58 14.618,59 15.694,60 22.934,61 25.087,62 27.348,63 4.854}
{0 CHEMBL116458,1 1,2 3.81,3 5.361,4 2.539,5 7.016,6 2.539,7 7.016,8 0.314,9 2,10 2.497,11 3.522,12 2.761,13 3.785,14 2.792,15 2.792,16 16.231,17 18.607,18 20.673,19 22.837,20 24.638,21 26.444,22 28.256,23 3.333,24 3.897,25 5.188,26 0.294,27 0.597,28 6.275,29 10.444,30 7.217,31 10.529,32 12.236,33 3.999,34 6.25,35 8.356,36 9.533,37 11.548,38 3.466,39 3.466,40 3.466,41 211.454,42 19.257,43 21.043,44 16.793,45 34.046,46 10.229,47 11.78,48 14.334,49 13.967,50 8.392,51 15.717,52 9.598,53 17.481,54 10.481,55 11.601,56 12.574,57 13.658,58 14.677,59 15.749,60 22.972,61 25.122,62 27.387,63 6.301}
{0 CHEMBL116477,1 1,2 3.75,3 5.412,4 2.538,5 7.075,6 2.538,7 7.075,8 0.304,9 2,10 2.499,11 3.522,12 2.761,13 3.782,14 2.789,15 2.789,16 16.303,17 18.682,18 20.75,19 22.883,20 24.682,21 26.488,22 28.298,23 3.111,24 3.897,25 5.133,26 0.294,27 0.6,28 6.293,29 10.512,30 7.256,31 10.601,32 12.3,33 4.01,34 6.285,35 8.413,36 9.636,37 11.642,38 3.525,39 3.525,40 3.525,41 236.239,42 19.307,43 21.091,44 16.86,45 34.155,46 10.312,47 11.843,48 14.41,49 14.025,50 8.429,51 15.771,52 9.68,53 17.533,54 10.531,55 11.675,56 12.631,57 13.728,58 14.739,59 15.819,60 23.052,61 25.207,62 27.476,63 5.523}
{0 CHEMBL11651,2 3.694,3 5.308,4 2.409,5 6.812,6 2.409,7 6.812,8 0.299,9 2,10 2.368,11 3.394,12 2.506,13 3.782,14 2.793,15 2.793,16 16.306,17 18.692,18 20.819,19 22.83,20 24.649,21 26.472,22 28.3,23 2.889,24 3.498,25 5.063,26 0.198,27 0.58,28 6.155,29 10.283,30 7.125,31 10.395,32 12.118,33 3.884,34 6.115,35 8.208,36 9.368,37 11.375,38 3.281,39 3.281,40 3.281,41 183.446,42 19.213,43 21.018,44 16.802,45 34.368,46 10.142,47 11.771,48 14.335,49 13.866,50 8.288,51 15.635,52 9.481,53 17.418,54 10.404,55 11.522,56 12.526,57 13.616,58 14.659,59 15.74,60 23.132,61 25.331,62 27.614,63 5.699}
{0 CHEMBL11659,2 3.791,3 5.415,4 2.572,5 7.159,6 2.572,7 7.159,8 0.288,9 2,10 2.525,11 3.555,12 2.815,13 3.739,14 2.748,15 2.748,16 16.057,17 18.402,18 20.419,19 22.641,20 24.411,21 26.188,22 27.97,23 3.111,24 3.863,25 5.315,26 0.363,27 0.61,28 6.312,29 10.275,30 7.222,31 10.544,32 12.222,33 4.057,34 6.224,35 8.259,36 9.441,37 11.369,38 3.626,39 3.626,40 3.626,41 254.727,42 19.122,43 20.877,44 16.627,45 33.56,46 10.207,47 11.688,48 14.219,49 13.923,50 8.379,51 15.643,52 9.584,53 17.376,54 10.426,55 11.54,56 12.479,57 13.553,58 14.546,59 15.605,60 22.682,61 24.79,62 27.017,63 5.796}
{0 CHEMBL116623,2 3.817,3 5.408,4 2.538,5 7.053,6 2.538,7 7.053,8 0.312,9 1,10 2.497,11 3.522,12 2.761,13 3.778,14 2.787,15 2.787,16 16.294,17 18.67,18 20.739,19 22.878,20 24.677,21 26.482,22 28.292,23 3.111,24 3.896,25 4.933,26 0.294,27 0.606,28 6.293,29 10.465,30 7.256,31 10.588,32 12.289,33 3.997,34 6.261,35 8.377,36 9.592,37 11.588,38 3.524,39 3.524,40 3.524,41 215.071,42 19.301,43 21.086,44 16.849,45 34.135,46 10.298,47 11.838,48 14.398,49 14.017,50 8.426,51 15.765,52 9.666,53 17.527,54 10.525,55 11.664,56 12.623,57 13.718,58 14.73,59 15.808,60 23.037,61 25.193,62 27.459,63 4}
{0 CHEMBL116746,1 1,2 3.859,3 5.377,4 2.537,5 7.014,6 2.537,7 7.014,8 0.306,9 2,10 2.497,11 3.521,12 2.76,13 3.773,14 2.778,15 2.778,16 16.225,17 18.591,18 20.649,19 22.827,20 24.622,21 26.423,22 28.228,23 2.889,24 3.896,25 4.898,26 0.294,27 0.602,28 6.275,29 10.475,30 7.222,31 10.559,32 12.258,33 4.01,34 6.268,35 8.385,36 9.598,37 11.598,38 3.514,39 3.514,40 3.514,41 212.733,42 19.258,43 21.038,44 16.792,45 33.972,46 10.257,47 11.786,48 14.34,49 13.983,50 8.398,51 15.727,52 9.635,53 17.487,54 10.49,55 11.627,56 12.581,57 13.673,58 14.681,59 15.756,60 22.936,61 25.08,62 27.334,63 4.495}
{0 CHEMBL116863,1 1,2 3.713,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.309,9 2,10 2.497,11 3.522,12 2.76,13 3.778,14 2.782,15 2.782,16 16.192,17 18.565,18 20.639,19 22.795,20 24.599,21 26.409,22 28.223,23 3.111,24 3.897,25 5.124,26 0.294,27 0.6,28 6.176,29 10.392,30 7.135,31 10.455,32 12.165,33 3.895,34 6.166,35 8.292,36 9.48,37 11.503,38 3.459,39 3.459,40 3.459,41 204.988,42 19.207,43 20.997,44 16.735,45 34.002,46 10.163,47 11.728,48 14.282,49 13.9,50 8.309,51 15.656,52 9.53,53 17.425,54 10.41,55 11.538,56 12.51,57 13.599,58 14.618,59 15.691,60 22.934,61 25.087,62 27.348,63 5.097}
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{0 CHEMBL117336,1 1,2 3.753,3 5.36,4 2.539,5 7.015,6 2.539,7 7.015,8 0.312,9 2,10 2.517,11 3.523,12 2.761,13 3.778,14 2.783,15 2.783,16 16.255,17 18.616,18 20.678,19 22.861,20 24.658,21 26.46,22 28.267,23 3.333,24 3.899,25 5.133,26 0.294,27 0.6,28 6.293,29 10.491,30 7.256,31 10.599,32 12.295,33 4.01,34 6.285,35 8.404,36 9.621,37 11.614,38 3.465,39 3.465,40 3.465,41 236.239,42 19.291,43 21.072,44 16.789,45 34.009,46 10.288,47 11.821,48 14.365,49 14.018,50 8.42,51 15.761,52 9.665,53 17.52,54 10.509,55 11.647,56 12.593,57 13.684,58 14.686,59 15.758,60 22.964,61 25.11,62 27.366,63 5.886}
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{0 CHEMBL117706,2 4.188,3 6.145,4 2.835,5 8.962,6 2.835,7 8.962,8 0.318,9 2,10 2.801,11 3.83,12 3.084,13 3.977,14 2.979,15 2.979,16 17.917,17 20.449,18 22.883,19 24.232,20 26.169,21 28.114,22 30.065,23 5.333,24 4.03,25 5.064,26 0.14,27 0.588,28 6.909,29 11.065,30 8.007,31 11.077,32 12.887,33 4.43,34 6.732,35 8.907,36 10.074,37 12.183,38 4.701,39 4.701,40 4.701,41 255.513,42 20.387,43 22.304,44 18.558,45 37.942,46 11.004,47 12.984,48 15.613,49 14.729,50 9.203,51 16.597,52 10.429,53 18.484,54 11.503,55 12.691,56 13.829,57 15.013,58 16.182,59 17.371,60 25.397,61 27.883,62 30.397,63 4.161}
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{0 CHEMBL117839,2 3.872,3 5.938,4 2.681,5 8.316,6 2.681,7 8.316,8 0.313,9 2,10 2.662,11 3.677,12 3.035,13 3.876,14 2.875,15 2.875,16 16.483,17 18.853,18 20.924,19 23.078,20 24.88,21 26.687,22 28.498,23 4,24 3.913,25 4.977,26 0.815,27 0.59,28 6.479,29 10.705,30 7.431,31 10.727,32 12.442,33 4.216,34 6.483,35 8.605,36 9.78,37 11.81,38 3.456,39 3.456,40 3.456,41 240.719,42 19.491,43 21.281,44 17.03,45 34.255,46 10.445,47 12.019,48 14.572,49 14.182,50 8.605,51 15.939,52 9.806,53 17.71,54 10.704,55 11.822,56 12.804,57 13.888,58 14.912,59 15.984,60 23.214,61 25.363,62 27.618,63 4.658}
{0 CHEMBL117891,2 3.734,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.306,9 1,10 2.497,11 3.522,12 2.761,13 3.775,14 2.782,15 2.782,16 16.207,17 18.584,18 20.66,19 22.801,20 24.605,21 26.415,22 28.23,23 3.111,24 3.897,25 5.184,26 0.294,27 0.6,28 6.176,29 10.347,30 7.135,31 10.457,32 12.167,33 3.88,34 6.14,35 8.257,36 9.444,37 11.455,38 3.46,39 3.46,40 3.46,41 201.09,42 19.211,43 21.002,44 16.747,45 34.042,46 10.173,47 11.736,48 14.296,49 13.903,50 8.313,51 15.659,52 9.535,53 17.429,54 10.416,55 11.545,56 12.518,57 13.608,58 14.628,59 15.702,60 22.958,61 25.114,62 27.378,63 4.602}
{0 CHEMBL117905,2 3.764,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.312,9 1,10 2.497,11 3.522,12 2.761,13 3.774,14 2.781,15 2.781,16 16.192,17 18.564,18 20.638,19 22.794,20 24.599,21 26.409,22 28.222,23 3.111,24 3.897,25 5.107,26 0.294,27 0.603,28 6.176,29 10.341,30 7.135,31 10.448,32 12.16,33 3.88,34 6.14,35 8.254,36 9.433,37 11.444,38 3.459,39 3.459,40 3.459,41 193.815,42 19.205,43 20.996,44 16.733,45 34.001,46 10.159,47 11.728,48 14.28,49 13.897,50 8.309,51 15.653,52 9.524,53 17.424,54 10.41,55 11.534,56 12.509,57 13.596,58 14.616,59 15.689,60 22.933,61 25.086,62 27.347,63 4.523}
{0 CHEMBL118025,1 1,2 3.791,3 5.362,4 2.54,5 7.018,6 2.54,7 7.018,8 0.313,9 2,10 2.502,11 3.524,12 2.761,13 3.78,14 2.785,15 2.785,16 16.256,17 18.618,18 20.679,19 22.862,20 24.658,21 26.461,22 28.269,23 3.333,24 3.901,25 5.055,26 0.473,27 0.603,28 6.293,29 10.488,30 7.256,31 10.592,32 12.291,33 4.01,34 6.283,35 8.401,36 9.613,37 11.608,38 3.487,39 3.487,40 3.487,41 225.286,42 19.291,43 21.072,44 16.795,45 34.012,46 10.285,47 11.821,48 14.365,49 14.015,50 8.42,51 15.76,52 9.661,53 17.519,54 10.51,55 11.646,56 12.596,57 13.686,58 14.69,59 15.762,60 22.967,61 25.112,62 27.369,63 5.886}
{0 CHEMBL11843,2 3.741,3 5.306,4 2.407,5 6.805,6 2.407,7 6.805,8 0.292,9 2,10 2.367,11 3.392,12 2.452,13 3.772,14 2.782,15 2.782,16 16.216,17 18.59,18 20.699,19 22.772,20 24.586,21 26.405,22 28.227,23 2.667,24 3.498,25 4.858,26 0.198,27 0.583,28 6.133,29 10.24,30 7.086,31 10.36,32 12.08,33 3.884,34 6.092,35 8.174,36 9.327,37 11.326,38 3.275,39 3.275,40 3.275,41 177.488,42 19.163,43 20.964,44 16.734,45 34.146,46 10.092,47 11.707,48 14.262,49 13.826,50 8.256,51 15.592,52 9.443,53 17.372,54 10.363,55 11.477,56 12.477,57 13.562,58 14.6,59 15.677,60 22.997,61 25.178,62 27.445,63 4.553}
{0 CHEMBL11844,2 3.673,3 5.301,4 2.405,5 6.792,6 2.405,7 6.792,8 0.279,9 2,10 2.365,11 3.39,12 2.387,13 3.722,14 2.731,15 2.731,16 15.932,17 18.286,18 20.321,19 22.507,20 24.29,21 26.078,22 27.869,23 2.444,24 3.498,25 4.642,26 0.198,27 0.58,28 6.089,29 10.112,30 7.002,31 10.307,32 11.999,33 3.884,34 6.051,35 8.09,36 9.242,37 11.188,38 3.246,39 3.246,40 3.246,41 183.446,42 18.961,43 20.73,44 16.482,45 33.484,46 9.997,47 11.519,48 14.063,49 13.715,50 8.169,51 15.451,52 9.355,53 17.2,54 10.233,55 11.338,56 12.304,57 13.376,58 14.387,59 15.448,60 22.589,61 24.706,62 26.936,63 6.886}
{0 CHEMBL118907,2 3.708,3 5.342,4 2.526,5 6.971,6 2.526,7 6.971,8 0.31,9 1,10 2.528,11 3.527,12 2.715,13 3.778,14 2.78,15 2.78,16 16.191,17 18.562,18 20.637,19 22.794,20 24.598,21 26.408,22 28.222,23 3.111,24 3.896,25 5.191,26 0.057,27 0.583,28 6.176,29 10.39,30 7.135,31 10.455,32 12.165,33 3.906,34 6.181,35 8.302,36 9.495,37 11.5,38 3.458,39 3.458,40 3.458,41 201.644,42 19.206,43 20.996,44 16.729,45 34,46 10.162,47 11.728,48 14.28,49 13.9,50 8.309,51 15.655,52 9.529,53 17.425,54 10.409,55 11.535,56 12.507,57 13.594,58 14.613,59 15.686,60 22.931,61 25.085,62 27.346,63 4.638}
{0 CHEMBL118908,1 1,2 3.842,3 5.36,4 2.537,5 7.014,6 2.537,7 7.014,8 0.311,9 2,10 2.497,11 3.521,12 2.76,13 3.762,14 2.765,15 2.765,16 16.105,17 18.463,18 20.526,19 22.733,20 24.533,21 26.339,22 28.148,23 2.889,24 3.895,25 4.992,26 0.294,27 0.602,28 6.155,29 10.314,30 7.096,31 10.406,32 12.117,33 3.88,34 6.126,35 8.232,36 9.408,37 11.414,38 3.448,39 3.448,40 3.448,41 184.547,42 19.152,43 20.939,44 16.659,45 33.8,46 10.099,47 11.664,48 14.203,49 13.852,50 8.274,51 15.606,52 9.478,53 17.373,54 10.364,55 11.482,56 12.454,57 13.536,58 14.552,59 15.62,60 22.805,61 24.945,62 27.191,63 5.824}
{0 CHEMBL119011,2 3.861,3 5.939,4 2.684,5 8.324,6 2.684,7 8.324,8 0.305,9 2,10 2.655,11 3.675,12 3.109,13 3.878,14 2.887,15 2.887,16 16.573,17 18.951,18 21.017,19 23.148,20 24.947,21 26.751,22 28.56,23 4,24 3.913,25 4.983,26 0.815,27 0.601,28 6.567,29 10.724,30 7.522,31 10.846,32 12.551,33 4.281,34 6.534,35 8.643,36 9.843,37 11.838,38 3.526,39 3.526,40 3.526,41 283.669,42 19.571,43 21.356,44 17.131,45 34.39,46 10.568,47 12.111,48 14.677,49 14.282,50 8.698,51 16.031,52 9.929,53 17.795,54 10.8,55 11.934,56 12.9,57 13.993,58 15.01,59 16.088,60 23.315,61 25.465,62 27.729,63 4.377}
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{0 CHEMBL119622,1 1,2 3.723,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.311,9 2,10 2.521,11 3.523,12 2.76,13 3.778,14 2.782,15 2.782,16 16.255,17 18.616,18 20.677,19 22.862,20 24.658,21 26.46,22 28.267,23 3.333,24 3.898,25 5.152,26 0.294,27 0.597,28 6.293,29 10.492,30 7.256,31 10.605,32 12.299,33 4.01,34 6.285,35 8.404,36 9.626,37 11.617,38 3.46,39 3.46,40 3.46,41 244.36,42 19.292,43 21.073,44 16.789,45 34.009,46 10.291,47 11.821,48 14.365,49 14.021,50 8.42,51 15.763,52 9.669,53 17.521,54 10.509,55 11.649,56 12.593,57 13.685,58 14.685,59 15.758,60 22.964,61 25.11,62 27.366,63 6.699}
{0 CHEMBL11966,2 3.664,3 5.321,4 2.436,5 6.873,6 2.436,7 6.873,8 0.291,9 2,10 2.414,11 3.427,12 2.732,13 3.744,14 2.753,15 2.753,16 16.017,17 18.367,18 20.396,19 22.583,20 24.362,21 26.146,22 27.933,23 2.444,24 3.775,25 5.263,26 0.198,27 0.589,28 6.133,29 10.201,30 7.081,31 10.411,32 12.098,33 3.884,34 6.097,35 8.164,36 9.367,37 11.306,38 3.474,39 3.474,40 3.474,41 219.338,42 19.045,43 20.811,44 16.562,45 33.551,46 10.109,47 11.613,48 14.159,49 13.811,50 8.238,51 15.542,52 9.468,53 17.288,54 10.313,55 11.441,56 12.387,57 13.47,58 14.469,59 15.535,60 22.661,61 24.775,62 27.003,63 4.745}
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{0 CHEMBL129157,2 3.839,3 5.814,4 2.586,5 7.863,6 2.586,7 7.863,8 0.275,9 3,10 2.554,11 3.578,12 2.815,13 3.769,14 2.783,15 2.783,16 16.121,17 18.468,18 20.51,19 22.727,20 24.513,21 26.304,22 28.098,23 3.111,24 3.752,25 4.681,26 0.384,27 0.605,28 6.293,29 10.272,30 7.186,31 10.483,32 12.183,33 4.074,34 6.218,35 8.251,36 9.386,37 11.342,38 3.262,39 3.262,40 3.262,41 212.365,42 19.171,43 20.946,44 16.674,45 33.661,46 10.162,47 11.705,48 14.239,49 13.907,50 8.366,51 15.649,52 9.537,53 17.405,54 10.427,55 11.526,56 12.497,57 13.567,58 14.58,59 15.639,60 22.773,61 24.892,62 27.117,63 6.509}
{0 CHEMBL129831,1 1,2 4.214,3 6.121,4 2.784,5 8.685,6 2.784,7 8.685,8 0.346,9 3,10 2.758,11 3.779,12 3.133,13 3.979,14 2.974,15 2.974,16 17.519,17 20.038,18 22.308,19 23.97,20 25.847,21 27.73,22 29.619,23 5.778,24 3.981,25 5.421,26 0.765,27 0.622,28 6.889,29 11.014,30 7.917,31 11.157,32 12.934,33 4.394,34 6.696,35 8.862,36 10.051,37 12.141,38 4.401,39 4.401,40 4.401,41 269.69,42 20.243,43 22.102,44 18.205,45 36.848,46 11.011,47 12.756,48 15.422,49 14.736,50 9.127,51 16.558,52 10.347,53 18.394,54 11.36,55 12.526,56 13.616,57 14.77,58 15.899,59 17.055,60 24.774,61 27.13,62 29.579,63 9.824}
{0 CHEMBL130122,1 1,2 3.965,3 6.049,4 2.779,5 8.648,6 2.779,7 8.648,8 0.322,9 4,10 2.753,11 3.774,12 3.007,13 3.838,14 2.865,15 2.865,16 16.59,17 18.934,18 20.995,19 23.216,20 25.014,21 26.816,22 28.621,23 4.889,24 3.98,25 5.411,26 0.8,27 0.615,28 6.594,29 10.719,30 7.564,31 10.863,32 12.582,33 4.244,34 6.518,35 8.634,36 9.824,37 11.826,38 3.722,39 3.722,40 3.722,41 282.293,42 19.635,43 21.423,44 17.13,45 34.235,46 10.57,47 12.154,48 14.681,49 14.325,50 8.735,51 16.084,52 9.947,53 17.855,54 10.836,55 11.957,56 12.929,57 14.012,58 15.026,59 16.093,60 23.264,61 25.4,62 27.638,63 10.143}
{0 CHEMBL130146,1 1,2 3.889,3 6.054,4 2.784,5 8.684,6 2.784,7 8.684,8 0.32,9 5,10 2.757,11 3.778,12 3.074,13 3.926,14 2.96,15 2.96,16 16.827,17 19.183,18 21.256,19 23.393,20 25.19,21 26.991,22 28.797,23 5.333,24 3.981,25 5.251,26 1.058,27 0.611,28 6.77,29 10.879,30 7.771,31 11.092,32 12.797,33 4.401,34 6.686,35 8.802,36 10.028,37 12.004,38 3.937,39 3.937,40 3.937,41 344.318,42 19.818,43 21.602,44 17.359,45 34.585,46 10.814,47 12.376,48 14.917,49 14.529,50 8.923,51 16.279,52 10.18,53 18.043,54 11.033,55 12.18,56 13.135,57 14.233,58 15.242,59 16.321,60 23.537,61 25.689,62 27.94,63 9.495}
{0 CHEMBL130345,1 1,2 3.681,3 5.361,4 2.539,5 7.016,6 2.539,7 7.016,8 0.309,9 2,10 2.497,11 3.522,12 2.99,13 3.78,14 2.785,15 2.785,16 16.255,17 18.615,18 20.677,19 22.86,20 24.656,21 26.459,22 28.267,23 3.556,24 3.897,25 5.256,26 0.814,27 0.614,28 6.293,29 10.466,30 7.256,31 10.579,32 12.281,33 4.01,34 6.275,35 8.384,36 9.568,37 11.57,38 3.46,39 3.46,40 3.46,41 245.581,42 19.288,43 21.07,44 16.786,45 34.012,46 10.274,47 11.821,48 14.36,49 14.008,50 8.417,51 15.754,52 9.64,53 17.515,54 10.503,55 11.628,56 12.587,57 13.671,58 14.681,59 15.75,60 22.965,61 25.111,62 27.367,63 9.959}
{0 CHEMBL130359,1 1,2 3.979,3 6.054,4 2.785,5 8.685,6 2.785,7 8.685,8 0.336,9 6,10 2.758,11 3.779,12 3.07,13 3.978,14 2.974,15 2.974,16 17.043,17 19.449,18 21.607,19 23.53,20 25.357,21 27.188,22 29.024,23 5.111,24 3.981,25 5.383,26 0.86,27 0.625,28 6.723,29 10.857,30 7.756,31 11.007,32 12.748,33 4.309,34 6.606,35 8.746,36 9.936,37 11.971,38 4.118,39 4.118,40 4.118,41 296.844,42 19.895,43 21.71,44 17.579,45 35.374,46 10.799,47 12.465,48 15.04,49 14.512,50 8.912,51 16.294,52 10.134,53 18.09,54 11.07,55 12.21,56 13.229,57 14.338,58 15.398,59 16.498,60 23.948,61 26.182,62 28.499,63 9.658}
{0 CHEMBL130580,1 1,2 4.082,3 6.054,4 2.757,5 8.676,6 2.757,7 8.676,8 0.334,9 3,10 2.749,11 3.759,12 2.866,13 3.972,14 2.964,15 2.964,16 17.065,17 19.509,18 21.725,19 23.492,20 25.343,21 27.198,22 29.057,23 4,24 3.976,25 5.291,27 0.613,28 6.494,29 10.912,30 7.561,31 10.791,32 12.556,33 4.125,34 6.498,35 8.722,36 9.93,37 12.05,38 4.468,39 4.468,40 4.468,41 208.907,42 19.807,43 21.647,44 17.555,45 35.757,46 10.647,47 12.384,48 14.997,49 14.346,50 8.731,51 16.154,52 9.963,53 17.976,54 10.934,55 12.088,56 13.135,57 14.259,58 15.341,59 16.456,60 24.105,61 26.39,62 28.748,63 9.658}
{0 CHEMBL130599,1 1,2 3.886,3 6.026,4 2.77,5 8.574,6 2.77,7 8.574,8 0.323,9 4,10 2.736,11 3.763,12 3.002,13 3.806,14 2.828,15 2.828,16 16.487,17 18.837,18 20.897,19 23.099,20 24.895,21 26.696,22 28.501,23 4.444,24 3.979,25 5.458,26 0.814,27 0.612,28 6.509,29 10.647,30 7.483,31 10.789,32 12.499,33 4.17,34 6.446,35 8.562,36 9.759,37 11.759,38 3.685,39 3.685,40 3.685,41 269.799,42 19.525,43 21.308,44 17.024,45 34.169,46 10.491,47 12.056,48 14.587,49 14.233,50 8.643,51 15.985,52 9.864,53 17.75,54 10.738,55 11.863,56 12.827,57 13.911,58 14.921,59 15.989,60 23.173,61 25.311,62 27.556,63 9.921}
{0 CHEMBL130629,1 1,2 4.136,3 6.056,4 2.796,5 8.692,6 2.796,7 8.692,8 0.32,9 3,10 2.759,11 3.784,12 3.159,13 3.981,14 2.976,15 2.976,16 17.577,17 20.038,18 22.376,19 24.029,20 25.932,21 27.843,22 29.761,23 5.111,24 3.985,25 5.466,26 0.814,27 0.613,28 6.899,29 10.878,30 7.958,31 11.079,32 12.864,33 4.341,34 6.625,35 8.766,36 9.953,37 11.99,38 3.887,39 3.887,40 3.887,41 274.428,42 20.249,43 22.134,44 18.306,45 36.954,46 10.924,47 12.804,48 15.376,49 14.68,50 9.163,51 16.519,52 10.39,53 18.377,54 11.418,55 12.592,56 13.692,57 14.852,58 15.988,59 17.15,60 24.812,61 27.21,62 29.646,63 9.959}
{0 CHEMBL130722,1 1,2 3.875,3 5.903,4 2.635,5 8.157,6 2.635,7 8.157,8 0.322,9 2,10 2.647,11 3.643,12 2.359,13 3.859,14 2.853,15 2.853,16 16.374,17 18.75,18 20.836,19 22.969,20 24.783,21 26.599,22 28.418,23 3.333,24 3.897,25 5.181,27 0.611,28 6.217,29 10.55,30 7.204,31 10.489,32 12.227,33 3.921,34 6.247,35 8.417,36 9.597,37 11.658,38 3.677,39 3.677,40 3.677,41 182.226,42 19.355,43 21.159,44 16.907,45 34.192,46 10.243,47 11.87,48 14.431,49 13.988,50 8.389,51 15.767,52 9.598,53 17.556,54 10.522,55 11.647,56 12.648,57 13.739,58 14.775,59 15.853,60 23.131,61 25.288,62 27.547,63 9.056}
{0 CHEMBL131002,1 1,2 3.884,3 6.027,4 2.774,5 8.587,6 2.774,7 8.587,8 0.319,9 4,10 2.74,11 3.768,12 3.036,13 3.812,14 2.839,15 2.839,16 16.557,17 18.905,18 20.954,19 23.161,20 24.952,21 26.748,22 28.549,23 4.444,24 3.981,25 5.409,26 0.814,27 0.61,28 6.594,29 10.698,30 7.57,31 10.896,32 12.597,33 4.242,34 6.51,35 8.621,36 9.838,37 11.819,38 3.714,39 3.714,40 3.714,41 292.21,42 19.597,43 21.375,44 17.096,45 34.194,46 10.599,47 12.137,48 14.673,49 14.324,50 8.731,51 16.069,52 9.973,53 17.828,54 10.824,55 11.961,56 12.91,57 13.999,58 14.999,59 16.068,60 23.225,61 25.355,62 27.595,63 9.678}
{0 CHEMBL131257,1 1,2 3.917,3 5.906,4 2.643,5 8.166,6 2.643,7 8.166,8 0.324,9 3,10 2.66,11 3.653,12 2.361,13 3.865,14 2.857,15 2.857,16 16.378,17 18.752,18 20.839,19 22.971,20 24.785,21 26.601,22 28.421,23 3.333,24 3.9,25 5.105,27 0.615,28 6.236,29 10.573,30 7.204,31 10.482,32 12.223,33 3.921,34 6.268,35 8.44,36 9.609,37 11.677,38 3.704,39 3.704,40 3.704,41 173.076,42 19.356,43 21.161,44 16.922,45 34.195,46 10.24,47 11.875,48 14.432,49 13.987,50 8.408,51 15.766,52 9.596,53 17.557,54 10.539,55 11.652,56 12.663,57 13.748,58 14.79,59 15.865,60 23.134,61 25.29,62 27.549,63 8.921}
{0 CHEMBL131540,1 1,2 3.976,3 6.053,4 2.782,5 8.682,6 2.782,7 8.682,8 0.326,9 2,10 2.758,11 3.778,12 3.013,13 3.978,14 2.973,15 2.973,16 16.918,17 19.319,18 21.494,19 23.382,20 25.212,21 27.048,22 28.887,23 4.222,24 3.98,25 5.535,26 0.294,27 0.618,28 6.567,29 10.879,30 7.588,31 10.867,32 12.598,33 4.198,34 6.539,35 8.725,36 9.944,37 12.014,38 4.473,39 4.473,40 4.473,41 268.134,42 19.74,43 21.557,44 17.451,45 35.262,46 10.653,47 12.322,48 14.896,49 14.358,50 8.77,51 16.138,52 10.016,53 17.933,54 10.939,55 12.091,56 13.103,57 14.218,58 15.273,59 16.375,60 23.831,61 26.074,62 28.388,63 10.509}
{0 CHEMBL131639,1 1,2 4.004,3 6.05,4 2.807,5 8.676,6 2.807,7 8.676,8 0.325,9 4,10 2.751,11 3.776,12 3.198,13 3.844,14 2.891,15 2.891,16 16.704,17 19.061,18 21.103,19 23.319,20 25.111,21 26.907,22 28.708,23 5.111,24 4.128,25 5.735,26 0.814,27 0.617,28 6.746,29 10.739,30 7.708,31 11.023,32 12.734,33 4.309,34 6.559,35 8.663,36 9.874,37 11.857,38 3.889,39 3.889,40 3.889,41 308.777,42 19.753,43 21.533,44 17.297,45 34.328,46 10.737,47 12.279,48 14.825,49 14.468,50 8.889,51 16.218,52 10.113,53 17.981,54 10.993,55 12.122,56 13.09,57 14.177,58 15.19,59 16.26,60 23.378,61 25.502,62 27.742,63 10}
{0 CHEMBL131707,1 1,2 4.068,3 6.075,4 2.774,5 8.762,6 2.774,7 8.762,8 0.331,9 3,10 2.76,11 3.774,12 2.862,13 3.948,14 2.949,15 2.949,16 16.708,17 19.09,18 21.192,19 23.254,20 25.07,21 26.888,22 28.709,23 4,24 4.037,25 5.324,27 0.613,28 6.463,29 10.772,30 7.483,31 10.746,32 12.49,33 4.115,34 6.453,35 8.632,36 9.827,37 11.89,38 4.352,39 4.352,40 4.352,41 207.007,42 19.634,43 21.442,44 17.267,45 34.603,46 10.536,47 12.179,48 14.749,49 14.257,50 8.66,51 16.039,52 9.881,53 17.833,54 10.817,55 11.953,56 12.965,57 14.066,58 15.114,59 16.202,60 23.493,61 25.663,62 27.928,63 10.018}
{0 CHEMBL131779,1 1,2 3.96,3 6.04,4 2.74,5 8.625,6 2.74,7 8.625,8 0.327,9 2,10 2.735,11 3.743,12 2.936,13 3.97,14 2.961,15 2.961,16 17.166,17 19.624,18 21.883,19 23.543,20 25.405,21 27.272,22 29.143,23 3.778,24 3.94,25 4.97,26 0.264,27 0.588,28 6.494,29 10.964,30 7.573,31 10.808,32 12.57,33 4.134,34 6.519,35 8.756,36 9.987,37 12.119,38 3.802,39 3.802,40 3.802,41 223.432,42 19.838,43 21.687,44 17.577,45 36.102,46 10.674,47 12.434,48 15.058,49 14.361,50 8.731,51 16.172,52 9.976,53 17.999,54 10.937,55 12.099,56 13.143,57 14.273,58 15.356,59 16.476,60 24.284,61 26.609,62 28.993,63 9.26}
{0 CHEMBL131866,1 1,2 3.792,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.318,9 2,10 2.497,11 3.522,12 2.76,13 3.776,14 2.779,15 2.779,16 16.183,17 18.551,18 20.626,19 22.79,20 24.594,21 26.403,22 28.217,23 3.111,24 3.896,25 5.065,26 0.294,27 0.607,28 6.176,29 10.387,30 7.135,31 10.439,32 12.153,33 3.895,34 6.166,35 8.289,36 9.469,37 11.493,38 3.456,39 3.456,40 3.456,41 190.752,42 19.2,43 20.991,44 16.723,45 33.979,46 10.146,47 11.722,48 14.269,49 13.891,50 8.306,51 15.648,52 9.514,53 17.419,54 10.404,55 11.525,56 12.501,57 13.587,58 14.607,59 15.679,60 22.918,61 25.071,62 27.33,63 9.481}
{0 CHEMBL132526,1 1,2 3.994,3 6.043,4 2.79,5 8.638,6 2.79,7 8.638,8 0.33,9 3,10 2.743,11 3.772,12 3,13 3.974,14 2.966,15 2.966,16 17.267,17 19.712,18 21.954,19 23.672,20 25.525,21 27.384,22 29.248,23 4.667,24 4.043,25 4.99,26 0.765,27 0.591,28 6.673,29 11.087,30 7.743,31 10.996,32 12.75,33 4.294,34 6.672,35 8.895,36 10.135,37 12.242,38 3.802,39 3.802,40 3.802,41 269.089,42 19.985,43 21.824,44 17.683,45 36.122,46 10.836,47 12.57,48 15.181,49 14.532,50 8.901,51 16.335,52 10.152,53 18.154,54 11.093,55 12.254,56 13.282,57 14.408,58 15.478,59 16.592,60 24.343,61 26.656,62 29.032,63 9.77}
{0 CHEMBL132566,1 1,2 3.929,3 6.054,4 2.789,5 8.697,6 2.789,7 8.697,8 0.314,9 3,10 2.759,11 3.782,12 3.574,13 4.001,14 2.996,15 2.996,16 17.05,17 19.461,18 21.637,19 23.494,20 25.319,21 27.15,22 28.987,23 4.667,24 3.981,25 5.788,26 1.38,27 0.63,28 6.781,29 10.923,30 7.763,31 11.076,32 12.788,33 4.412,34 6.694,35 8.823,36 10.036,37 12.047,38 3.526,39 3.526,40 3.526,41 353.274,42 19.87,43 21.677,44 17.677,45 35.489,46 10.84,47 12.462,48 15.046,49 14.529,50 8.969,51 16.293,52 10.225,53 18.074,54 11.131,55 12.291,56 13.298,57 14.421,58 15.48,59 16.591,60 23.986,61 26.24,62 28.568,63 9.638}
{0 CHEMBL132611,1 1,2 3.905,3 6.054,4 2.789,5 8.697,6 2.789,7 8.697,8 0.318,9 2,10 2.759,11 3.782,12 3.045,13 3.993,14 2.996,15 2.996,16 16.95,17 19.355,18 21.51,19 23.421,20 25.245,21 27.074,22 28.909,23 4.222,24 3.981,25 5.639,26 0.814,27 0.617,28 6.635,29 10.859,30 7.667,31 10.975,32 12.693,33 4.262,34 6.574,35 8.734,36 9.98,37 12.002,38 3.526,39 3.526,40 3.526,41 321.786,42 19.795,43 21.604,44 17.444,45 35.239,46 10.751,47 12.375,48 14.96,49 14.441,50 8.825,51 16.21,52 10.098,53 17.996,54 10.979,55 12.143,56 13.127,57 14.244,58 15.282,59 16.38,60 23.846,61 26.076,62 28.387,63 9.854}
{0 CHEMBL132732,1 1,2 3.962,3 6.05,4 2.787,5 8.659,6 2.787,7 8.659,8 0.318,9 4,10 2.755,11 3.779,12 3.034,13 3.838,14 2.865,15 2.865,16 16.665,17 19.017,18 21.074,19 23.274,20 25.069,21 26.869,22 28.672,23 4.889,24 3.981,25 5.333,26 0.8,27 0.614,28 6.673,29 10.807,30 7.644,31 10.962,32 12.673,33 4.327,34 6.602,35 8.722,36 9.937,37 11.929,38 3.722,39 3.722,40 3.722,41 307.749,42 19.702,43 21.485,44 17.215,45 34.359,46 10.672,47 12.23,48 14.768,49 14.408,50 8.815,51 16.161,52 10.048,53 17.926,54 10.916,55 12.049,56 13.01,57 14.099,58 15.108,59 16.18,60 23.35,61 25.489,62 27.735,63 9.509}
{0 CHEMBL132987,1 1,2 4.009,3 6.054,4 2.782,5 8.683,6 2.782,7 8.683,8 0.329,9 3,10 2.758,11 3.778,12 3.012,13 3.978,14 2.973,15 2.973,16 17.099,17 19.53,18 21.735,19 23.541,20 25.383,21 27.23,22 29.082,23 4.667,24 3.981,25 5.445,26 0.765,27 0.606,28 6.648,29 10.982,30 7.692,31 10.957,32 12.698,33 4.276,34 6.618,35 8.813,36 10.041,37 12.127,38 4.446,39 4.446,40 4.446,41 274,42 19.879,43 21.706,44 17.583,45 35.735,46 10.766,47 12.456,48 15.054,49 14.467,50 8.854,51 16.257,52 10.1,53 18.062,54 11.029,55 12.185,56 13.204,57 14.324,58 15.388,59 16.497,60 24.107,61 26.385,62 28.738,63 10.201}
{0 CHEMBL133243,1 1,2 3.82,3 6.015,4 2.754,5 8.53,6 2.754,7 8.53,8 0.313,9 3,10 2.709,11 3.742,12 2.999,13 3.792,14 2.807,15 2.807,16 16.453,17 18.814,18 20.882,19 23.055,20 24.856,21 26.662,22 28.472,23 4,24 3.977,25 5.267,26 0.765,27 0.601,28 6.415,29 10.605,30 7.387,31 10.714,32 12.425,33 4.093,34 6.377,35 8.508,36 9.72,37 11.725,38 3.541,39 3.541,40 3.541,41 258,42 19.47,43 21.259,44 16.975,45 34.189,46 10.428,47 11.995,48 14.543,49 14.162,50 8.561,51 15.918,52 9.798,53 17.689,54 10.667,55 11.802,56 12.765,57 13.855,58 14.866,59 15.939,60 23.165,61 25.31,62 27.561,63 8.469}
{0 CHEMBL133521,1 1,2 3.867,3 6.026,4 2.771,5 8.577,6 2.771,7 8.577,8 0.319,9 4,10 2.737,11 3.765,12 3.008,13 3.808,14 2.831,15 2.831,16 16.54,17 18.884,18 20.933,19 23.152,20 24.942,21 26.738,22 28.538,23 4.667,24 3.98,25 5.312,26 0.814,27 0.608,28 6.594,29 10.72,30 7.57,31 10.899,32 12.598,33 4.259,34 6.534,35 8.645,36 9.862,37 11.841,38 3.689,39 3.689,40 3.689,41 299.131,42 19.591,43 21.367,44 17.074,45 34.178,46 10.591,47 12.129,48 14.657,49 14.323,50 8.726,51 16.066,52 9.97,53 17.823,54 10.814,55 11.95,56 12.894,57 13.983,58 14.98,59 16.048,60 23.203,61 25.335,62 27.575,63 9.959}
{0 CHEMBL133707,1 1,2 3.997,3 6.051,4 2.807,5 8.693,6 2.807,7 8.693,8 0.321,9 4,10 2.753,11 3.78,12 3.199,13 3.845,14 2.892,15 2.892,16 16.772,17 19.133,18 21.175,19 23.372,20 25.162,21 26.956,22 28.754,23 5.111,24 4.129,25 5.636,26 0.814,27 0.615,28 6.815,29 10.825,30 7.779,31 11.108,32 12.813,33 4.386,34 6.641,35 8.748,36 9.981,37 11.957,38 3.889,39 3.889,40 3.889,41 330.043,42 19.812,43 21.589,44 17.37,45 34.44,46 10.824,47 12.347,48 14.901,49 14.541,50 8.958,51 16.286,52 10.199,53 18.044,54 11.062,55 12.201,56 13.159,57 14.252,58 15.261,59 16.334,60 23.455,61 25.583,62 27.83,63 9.194}
{0 CHEMBL133749,1 1,2 3.817,3 5.408,4 2.538,5 7.053,6 2.538,7 7.053,8 0.312,9 2,10 2.498,11 3.522,12 2.76,13 3.781,14 2.787,15 2.787,16 16.294,17 18.67,18 20.739,19 22.878,20 24.677,21 26.482,22 28.292,23 3.111,24 3.896,25 4.972,26 0.294,27 0.606,28 6.293,29 10.508,30 7.256,31 10.588,32 12.289,33 4.01,34 6.285,35 8.41,36 9.626,37 11.634,38 3.524,39 3.524,40 3.524,41 218.993,42 19.301,43 21.086,44 16.849,45 34.135,46 10.298,47 11.838,48 14.398,49 14.017,50 8.426,51 15.765,52 9.666,53 17.527,54 10.525,55 11.664,56 12.623,57 13.718,58 14.73,59 15.808,60 23.037,61 25.193,62 27.459,63 9.244}
{0 CHEMBL133806,1 1,2 3.894,3 6.055,4 2.79,5 8.699,6 2.79,7 8.699,8 0.316,9 5,10 2.759,11 3.782,12 3.084,13 3.928,14 2.967,15 2.967,16 16.887,17 19.248,18 21.318,19 23.442,20 25.237,21 27.036,22 28.84,23 5.333,24 3.982,25 5.135,26 1.058,27 0.61,28 6.836,29 10.955,30 7.837,31 11.172,32 12.871,33 4.472,34 6.758,35 8.876,36 10.121,37 12.09,38 3.937,39 3.937,40 3.937,41 362.339,42 19.874,43 21.654,44 17.428,45 34.673,46 10.894,47 12.437,48 14.987,49 14.597,50 8.99,51 16.343,52 10.261,53 18.103,54 11.099,55 12.255,56 13.201,57 14.304,58 15.309,59 16.39,60 23.603,61 25.757,62 28.013,63 7.699}
{0 CHEMBL133936,1 1,2 3.89,3 6.028,4 2.783,5 8.593,6 2.783,7 8.593,8 0.315,9 4,10 2.742,11 3.773,12 3.049,13 3.812,14 2.839,15 2.839,16 16.634,17 18.99,18 21.036,19 23.222,20 25.011,21 26.805,22 28.604,23 4.444,24 3.981,25 5.304,26 0.814,27 0.609,28 6.673,29 10.788,30 7.65,31 10.992,32 12.687,33 4.325,34 6.596,35 8.709,36 9.949,37 11.923,38 3.714,39 3.714,40 3.714,41 311.596,42 19.666,43 21.44,44 17.185,45 34.322,46 10.698,47 12.215,48 14.761,49 14.408,50 8.811,51 16.147,52 10.071,53 17.901,54 10.905,55 12.053,56 12.992,57 14.087,58 15.084,59 16.157,60 23.314,61 25.448,62 27.696,63 8.678}
{0 CHEMBL133970,1 1,2 3.957,3 6.054,4 2.782,5 8.683,6 2.782,7 8.683,8 0.323,9 2,10 2.758,11 3.778,12 2.947,13 3.899,14 2.92,15 2.92,16 16.618,17 18.986,18 21.067,19 23.172,20 24.974,21 26.782,22 28.593,23 4,24 3.981,25 5.477,26 0.473,27 0.618,28 6.524,29 10.731,30 7.522,31 10.827,32 12.539,33 4.189,34 6.484,35 8.624,36 9.84,37 11.856,38 4.336,39 4.336,40 4.336,41 255.424,42 19.585,43 21.375,44 17.168,45 34.418,46 10.566,47 12.142,48 14.696,49 14.277,50 8.684,51 16.034,52 9.929,53 17.804,54 10.807,55 11.95,56 12.923,57 14.021,58 15.042,59 16.123,60 23.357,61 25.514,62 27.77,63 9.347}
{0 CHEMBL134092,1 1,2 4.119,3 6.072,4 2.864,5 8.804,6 2.864,7 8.804,8 0.32,9 4,10 2.778,11 3.833,12 3.214,13 3.982,14 2.978,15 2.978,16 17.621,17 20.075,18 22.399,19 24.075,20 25.971,21 27.875,22 29.787,23 5.333,24 4.157,25 5.602,26 0.86,27 0.617,28 7.013,29 10.956,30 8.065,31 11.213,32 12.983,33 4.459,34 6.73,35 8.858,36 10.056,37 12.071,38 3.882,39 3.882,40 3.882,41 318.574,42 20.315,43 22.189,44 18.345,45 36.95,46 11.044,47 12.877,48 15.447,49 14.784,50 9.263,51 16.609,52 10.498,53 18.454,54 11.503,55 12.675,56 13.76,57 14.916,58 16.04,59 17.197,60 24.829,61 27.22,62 29.651,63 9.523}
{0 CHEMBL273817,1 1,2 3.929,3 6.053,4 2.782,5 8.682,6 2.782,7 8.682,8 0.318,9 3,10 2.758,11 3.778,12 3.574,13 3.979,14 2.974,15 2.974,16 17,17 19.409,18 21.593,19 23.447,20 25.276,21 27.11,22 28.95,23 4.667,24 3.98,25 5.859,26 1.38,27 0.633,28 6.711,29 10.845,30 7.692,31 10.987,32 12.707,33 4.337,34 6.617,35 8.744,36 9.935,37 11.956,38 3.459,39 3.459,40 3.459,41 318.571,42 19.814,43 21.626,44 17.624,45 35.451,46 10.755,47 12.402,48 14.98,49 14.456,50 8.901,51 16.226,52 10.141,53 18.013,54 11.066,55 12.219,56 13.238,57 14.359,58 15.424,59 16.535,60 23.941,61 26.199,62 28.527,63 9.18}
{0 CHEMBL274606,2 3.741,3 5.372,4 2.448,5 6.958,6 2.448,7 6.958,8 0.292,9 2,10 2.398,11 3.429,12 2.814,13 3.755,14 2.764,15 2.764,16 16.314,17 18.7,18 20.826,19 22.843,20 24.658,21 26.48,22 28.306,23 3.111,24 3.662,25 5.105,26 0.363,27 0.6,28 6.236,29 10.299,30 7.182,31 10.456,32 12.169,33 3.971,34 6.165,35 8.237,36 9.389,37 11.387,38 3.286,39 3.286,40 3.286,41 204.825,42 19.234,43 21.034,44 16.816,45 34.397,46 10.178,47 11.791,48 14.349,49 13.909,50 8.343,51 15.669,52 9.527,53 17.445,54 10.439,55 11.553,56 12.549,57 13.636,58 14.675,59 15.755,60 23.141,61 25.342,62 27.629,63 6.824}
{0 CHEMBL275570,2 3.791,3 5.306,4 2.411,5 6.805,6 2.411,7 6.805,8 0.286,9 2,10 2.367,11 3.394,12 2.814,13 3.772,14 2.782,15 2.782,16 16.223,17 18.595,18 20.702,19 22.785,20 24.596,21 26.412,22 28.233,23 2.889,24 3.661,25 4.845,26 0.363,27 0.603,28 6.217,29 10.256,30 7.144,31 10.423,32 12.134,33 3.971,34 6.144,35 8.204,36 9.349,37 11.338,38 3.275,39 3.275,40 3.275,41 198.177,42 19.185,43 20.981,44 16.743,45 34.146,46 10.13,47 11.729,48 14.276,49 13.87,50 8.313,51 15.627,52 9.491,53 17.4,54 10.4,55 11.509,56 12.5,57 13.582,58 14.615,59 15.689,60 22.999,61 25.179,62 27.445,63 4}
{0 CHEMBL311735,2 4.065,3 5.389,4 2.542,5 7.032,6 2.542,7 7.032,8 0.329,10 2.498,11 3.524,12 2.677,13 3.787,14 2.807,15 2.807,16 17.049,17 19.525,18 21.793,19 23.421,20 25.288,21 27.162,22 29.041,23 3.111,24 3.902,25 4.806,26 0.217,27 0.633,28 6.399,29 10.581,30 7.455,31 10.709,32 12.461,33 3.948,34 6.267,35 8.437,36 9.66,37 11.72,38 3.493,39 3.493,40 3.493,41 203.324,42 19.712,43 21.562,44 17.606,45 36.113,46 10.561,47 12.306,48 14.939,49 14.243,50 8.643,51 16.049,52 9.903,53 17.873,54 10.864,55 12.04,56 13.094,57 14.241,58 15.341,59 16.482,60 24.216,61 26.554,62 28.959,63 6.921}
{0 CHEMBL324834,2 3.813,3 5.426,4 2.547,5 7.133,6 2.547,7 7.133,8 0.309,9 1,10 2.51,11 3.531,12 2.761,13 3.781,14 2.792,15 2.792,16 16.36,17 18.729,18 20.786,19 22.944,20 24.737,21 26.536,22 28.34,23 3.333,24 3.907,25 4.74,26 0.636,27 0.603,28 6.399,29 10.552,30 7.365,31 10.721,32 12.41,33 4.101,34 6.366,35 8.476,36 9.713,37 11.684,38 3.532,39 3.532,40 3.532,41 240.409,42 19.383,43 21.16,44 16.913,45 34.164,46 10.418,47 11.926,48 14.483,49 14.127,50 8.528,51 15.865,52 9.794,53 17.618,54 10.619,55 11.77,56 12.707,57 13.806,58 14.803,59 15.881,60 23.081,61 25.229,62 27.494,63 4.347}
{0 CHEMBL325147,1 1,2 3.764,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.312,9 2,10 2.497,11 3.522,12 2.76,13 3.778,14 2.781,15 2.781,16 16.192,17 18.564,18 20.638,19 22.794,20 24.599,21 26.409,22 28.222,23 3.111,24 3.897,25 5.144,26 0.294,27 0.603,28 6.176,29 10.392,30 7.135,31 10.448,32 12.16,33 3.895,34 6.166,35 8.292,36 9.476,37 11.5,38 3.459,39 3.459,40 3.459,41 197.642,42 19.205,43 20.996,44 16.733,45 34.001,46 10.159,47 11.728,48 14.28,49 13.897,50 8.309,51 15.653,52 9.524,53 17.424,54 10.41,55 11.534,56 12.509,57 13.596,58 14.616,59 15.689,60 22.933,61 25.086,62 27.347,63 5.62}
{0 CHEMBL325223,1 1,2 3.553,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.3,9 2,10 2.497,11 3.522,12 2.76,13 3.778,14 2.782,15 2.782,16 16.192,17 18.566,18 20.639,19 22.797,20 24.601,21 26.41,22 28.223,23 3.111,24 3.897,25 5.237,26 0.294,27 0.586,28 6.176,29 10.392,30 7.135,31 10.491,32 12.189,33 3.895,34 6.166,35 8.292,36 9.506,37 11.515,38 3.459,39 3.459,40 3.459,41 236.007,42 19.211,43 21,44 16.735,45 34.002,46 10.181,47 11.728,48 14.286,49 13.916,50 8.309,51 15.666,52 9.555,53 17.432,54 10.41,55 11.55,56 12.51,57 13.605,58 14.618,59 15.694,60 22.934,61 25.087,62 27.348,63 5.585}
{0 CHEMBL325401,1 1,2 3.842,3 5.36,4 2.537,5 7.014,6 2.537,7 7.014,8 0.311,9 2,10 2.497,11 3.521,12 2.76,13 3.765,14 2.765,15 2.765,16 16.105,17 18.463,18 20.526,19 22.733,20 24.533,21 26.339,22 28.148,23 2.889,24 3.895,25 4.995,26 0.294,27 0.602,28 6.155,29 10.35,30 7.096,31 10.406,32 12.117,33 3.895,34 6.148,35 8.26,36 9.436,37 11.453,38 3.448,39 3.448,40 3.448,41 185.731,42 19.152,43 20.939,44 16.659,45 33.8,46 10.099,47 11.664,48 14.203,49 13.852,50 8.274,51 15.606,52 9.478,53 17.373,54 10.364,55 11.482,56 12.454,57 13.536,58 14.552,59 15.62,60 22.805,61 24.945,62 27.191,63 5.469}
{0 CHEMBL326290,1 1,2 3.876,3 6.053,4 2.778,5 8.681,6 2.778,7 8.681,8 0.32,9 2,10 2.757,11 3.775,12 3.007,13 3.962,14 2.959,15 2.959,16 16.891,17 19.292,18 21.452,19 23.368,20 25.195,21 27.027,22 28.864,23 4.222,24 3.979,25 4.99,26 0.68,27 0.598,28 6.553,29 10.871,30 7.588,31 10.881,32 12.607,33 4.207,34 6.544,35 8.725,36 9.962,37 12.014,38 3.728,39 3.728,40 3.728,41 265.289,42 19.734,43 21.547,44 17.332,45 35.173,46 10.66,47 12.309,48 14.887,49 14.362,50 8.74,51 16.138,52 9.998,53 17.93,54 10.888,55 12.043,56 13.031,57 14.141,58 15.178,59 16.271,60 23.786,61 26.017,62 28.326,63 5.523}
{0 CHEMBL331383,2 3.837,3 5.927,4 2.677,5 8.277,6 2.677,7 8.277,8 0.323,9 2,10 2.599,11 3.653,12 2.873,13 3.849,14 2.867,15 2.867,16 16.441,17 18.813,18 20.891,19 23.032,20 24.84,21 26.652,22 28.467,23 3.556,24 3.916,25 5.122,26 0.295,27 0.597,28 6.33,29 10.486,30 7.318,31 10.603,32 12.333,33 3.976,34 6.263,35 8.391,36 9.566,37 11.586,38 3.473,39 3.473,40 3.473,41 205.488,42 19.43,43 21.228,44 16.977,45 34.233,46 10.35,47 11.957,48 14.512,49 14.087,50 8.491,51 15.857,52 9.701,53 17.639,54 10.614,55 11.737,56 12.73,57 13.818,58 14.85,59 15.925,60 23.184,61 25.335,62 27.593,63 4.854}
{0 CHEMBL331850,1 1,2 3.779,3 5.414,4 2.539,5 7.082,6 2.539,7 7.082,8 0.308,9 2,10 2.524,11 3.529,12 2.761,13 3.783,14 2.79,15 2.79,16 16.359,17 18.728,18 20.785,19 22.944,20 24.736,21 26.535,22 28.339,23 3.333,24 3.901,25 4.945,26 0.294,27 0.6,28 6.399,29 10.601,30 7.365,31 10.727,32 12.414,33 4.113,34 6.391,35 8.513,36 9.757,37 11.739,38 3.526,39 3.526,40 3.526,41 256.361,42 19.384,43 21.16,44 16.908,45 34.161,46 10.421,47 11.926,48 14.483,49 14.13,50 8.528,51 15.866,52 9.797,53 17.619,54 10.619,55 11.771,56 12.705,57 13.804,58 14.8,59 15.877,60 23.079,61 25.227,62 27.491,63 5.032}
{0 CHEMBL332924,2 3.769,3 5.487,4 2.628,5 7.399,6 2.628,7 7.399,8 0.31,9 1,10 2.629,11 3.628,12 2.8,13 3.78,14 2.781,15 2.781,16 16.234,17 18.605,18 20.669,19 22.839,20 24.638,21 26.444,22 28.254,23 3.333,24 3.926,25 5.204,26 0.057,27 0.578,28 6.275,29 10.468,30 7.217,31 10.537,32 12.243,33 4.02,34 6.279,35 8.388,36 9.576,37 11.574,38 3.458,39 3.458,40 3.458,41 215.886,42 19.261,43 21.046,44 16.784,45 34.011,46 10.239,47 11.785,48 14.338,49 13.973,50 8.395,51 15.722,52 9.607,53 17.485,54 10.485,55 11.607,56 12.576,57 13.659,58 14.674,59 15.744,60 22.961,61 25.108,62 27.366,63 4.62}
{0 CHEMBL333388,2 3.684,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.306,9 1,10 2.497,11 3.522,12 2.761,13 3.774,14 2.782,15 2.782,16 16.192,17 18.565,18 20.639,19 22.796,20 24.6,21 26.409,22 28.223,23 3.111,24 3.897,25 5.164,26 0.294,27 0.597,28 6.176,29 10.341,30 7.135,31 10.463,32 12.17,33 3.88,34 6.14,35 8.254,36 9.441,37 11.448,38 3.459,39 3.459,40 3.459,41 207.853,42 19.207,43 20.998,44 16.735,45 34.002,46 10.167,47 11.728,48 14.283,49 13.904,50 8.309,51 15.658,52 9.535,53 17.427,54 10.41,55 11.541,56 12.51,57 13.6,58 14.618,59 15.692,60 22.934,61 25.087,62 27.348,63 5.398}
{0 CHEMBL334744,1 1,2 3.742,3 5.361,4 2.539,5 7.016,6 2.539,7 7.016,8 0.319,9 2,10 2.497,11 3.522,12 2.977,13 3.78,14 2.785,15 2.785,16 16.241,17 18.601,18 20.666,19 22.852,20 24.649,21 26.452,22 28.261,23 3.556,24 3.897,25 5.197,26 0.814,27 0.621,28 6.293,29 10.46,30 7.256,31 10.564,32 12.268,33 4.01,34 6.275,35 8.38,36 9.557,37 11.561,38 3.46,39 3.46,40 3.46,41 232.082,42 19.279,43 21.061,44 16.777,45 34.008,46 10.252,47 11.809,48 14.342,49 13.997,50 8.411,51 15.745,52 9.621,53 17.506,54 10.493,55 11.612,56 12.576,57 13.658,58 14.67,59 15.738,60 22.955,61 25.103,62 27.361,63 9.721}
{0 CHEMBL335706,1 1,2 3.764,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.312,9 2,10 2.543,11 3.541,12 2.698,13 3.784,14 2.781,15 2.781,16 16.192,17 18.564,18 20.638,19 22.794,20 24.599,21 26.409,22 28.222,23 3.111,24 3.897,25 5.151,26 0.057,27 0.586,28 6.176,29 10.439,30 7.135,31 10.448,32 12.16,33 3.921,34 6.206,35 8.338,36 9.531,37 11.552,38 3.459,39 3.459,40 3.459,41 196.335,42 19.205,43 20.996,44 16.733,45 34.001,46 10.159,47 11.728,48 14.28,49 13.897,50 8.309,51 15.653,52 9.524,53 17.424,54 10.41,55 11.534,56 12.509,57 13.596,58 14.616,59 15.689,60 22.933,61 25.086,62 27.347,63 9.658}
{0 CHEMBL337462,1 1,2 3.875,3 5.903,4 2.635,5 8.157,6 2.635,7 8.157,8 0.322,9 3,10 2.615,11 3.631,12 2.359,13 3.85,14 2.853,15 2.853,16 16.374,17 18.75,18 20.836,19 22.969,20 24.783,21 26.599,22 28.418,23 3.333,24 3.897,25 5.106,27 0.63,28 6.217,29 10.509,30 7.204,31 10.489,32 12.227,33 3.909,34 6.225,35 8.385,36 9.555,37 11.611,38 3.677,39 3.677,40 3.677,41 175.506,42 19.355,43 21.159,44 16.907,45 34.192,46 10.243,47 11.87,48 14.431,49 13.988,50 8.389,51 15.767,52 9.598,53 17.556,54 10.522,55 11.647,56 12.648,57 13.739,58 14.775,59 15.853,60 23.131,61 25.288,62 27.547,63 9.456}
{0 CHEMBL337608,1 1,2 4.352,3 6.285,4 2.794,5 9.105,6 2.794,7 9.105,8 0.349,9 4,10 2.759,11 3.781,12 3.412,13 3.98,14 2.975,15 2.975,16 17.788,17 20.332,18 22.662,19 24.14,20 26.029,21 27.925,22 29.828,23 5.778,24 4.029,25 5.528,26 1.081,27 0.673,28 6.986,29 11.21,30 8.04,31 11.259,32 13.044,33 4.496,34 6.833,35 9.026,36 10.213,37 12.345,38 4.353,39 4.353,40 4.353,41 291.369,42 20.39,43 22.26,44 18.521,45 37.481,46 11.158,47 12.948,48 15.633,49 14.855,50 9.261,51 16.685,52 10.497,53 18.531,54 11.534,55 12.719,56 13.834,57 15.01,58 16.164,59 17.345,60 25.161,61 27.576,62 30.064,63 8.77}
{0 CHEMBL337635,1 1,2 3.9,3 6.053,4 2.782,5 8.682,6 2.782,7 8.682,8 0.323,9 2,10 2.758,11 3.778,12 3.015,13 3.978,14 2.974,15 2.974,16 16.894,17 19.297,18 21.459,19 23.371,20 25.198,21 27.031,22 28.869,23 4.222,24 3.98,25 5.714,26 0.814,27 0.619,28 6.553,29 10.775,30 7.588,31 10.876,32 12.604,33 4.173,34 6.486,35 8.648,36 9.872,37 11.907,38 3.459,39 3.459,40 3.459,41 289.432,42 19.735,43 21.549,44 17.376,45 35.19,46 10.657,47 12.309,48 14.888,49 14.36,50 8.746,51 16.137,52 10.002,53 17.93,54 10.904,55 12.059,56 13.056,57 14.169,58 15.213,59 16.309,60 23.795,61 26.027,62 28.338,63 10.027}
{0 CHEMBL337684,1 1,2 3.887,3 6.051,4 2.786,5 8.691,6 2.786,7 8.691,8 0.315,9 4,10 2.753,11 3.778,12 3.047,13 3.837,14 2.867,15 2.867,16 16.655,17 19.017,18 21.067,19 23.233,20 25.022,21 26.818,22 28.618,23 4.222,24 3.981,25 5.368,26 0.814,27 0.609,28 6.673,29 10.796,30 7.65,31 10.993,32 12.689,33 4.325,34 6.596,35 8.713,36 9.954,37 11.932,38 3.748,39 3.748,40 3.748,41 311.596,42 19.673,43 21.449,44 17.212,45 34.368,46 10.708,47 12.225,48 14.78,49 14.411,50 8.815,51 16.151,52 10.077,53 17.907,54 10.915,55 12.064,56 13.007,57 14.105,58 15.105,59 16.181,60 23.349,61 25.487,62 27.737,63 9.194}
{0 CHEMBL337830,1 1,2 3.875,3 6.027,4 2.78,5 8.582,6 2.78,7 8.582,8 0.315,9 4,10 2.74,11 3.771,12 3.034,13 3.808,14 2.831,15 2.831,16 16.619,17 18.97,18 21.017,19 23.214,20 25.002,21 26.795,22 28.594,23 4.667,24 3.981,25 5.194,26 0.814,27 0.607,28 6.673,29 10.808,30 7.65,31 10.995,32 12.688,33 4.34,34 6.618,35 8.732,36 9.971,37 11.942,38 3.689,39 3.689,40 3.689,41 318.798,42 19.66,43 21.433,44 17.164,45 34.308,46 10.691,47 12.207,48 14.746,49 14.407,50 8.807,51 16.144,52 10.069,53 17.896,54 10.896,55 12.043,56 12.978,57 14.073,58 15.066,59 16.139,60 23.294,61 25.43,62 27.678,63 9.42}
{0 CHEMBL338957,1 1,2 3.875,3 5.903,4 2.635,5 8.157,6 2.635,7 8.157,8 0.322,9 2,10 2.533,11 3.607,12 2.567,13 3.833,14 2.853,15 2.853,16 16.374,17 18.75,18 20.836,19 22.969,20 24.783,21 26.599,22 28.418,23 3.333,24 3.814,25 4.984,26 0.569,27 0.639,28 6.217,29 10.429,30 7.204,31 10.489,32 12.227,33 3.875,34 6.172,35 8.317,36 9.478,37 11.526,38 3.459,39 3.459,40 3.459,41 169.93,42 19.355,43 21.159,44 16.907,45 34.192,46 10.243,47 11.87,48 14.431,49 13.988,50 8.389,51 15.767,52 9.598,53 17.556,54 10.522,55 11.647,56 12.648,57 13.739,58 14.775,59 15.853,60 23.131,61 25.288,62 27.547,63 8.367}
{0 CHEMBL339174,1 1,2 4.18,3 6.121,4 2.791,5 8.7,6 2.791,7 8.7,8 0.339,9 3,10 2.759,11 3.783,12 3.135,13 4.001,14 2.996,15 2.996,16 17.549,17 20.066,18 22.33,19 23.998,20 25.871,21 27.751,22 29.638,23 5.778,24 3.982,25 5.34,26 0.765,27 0.62,28 6.948,29 11.08,30 7.974,31 11.232,32 12.999,33 4.465,34 6.768,35 8.932,36 10.142,37 12.217,38 4.401,39 4.401,40 4.401,41 299.28,42 20.279,43 22.134,44 18.235,45 36.857,46 11.078,47 12.799,48 15.465,49 14.792,50 9.182,51 16.606,52 10.416,53 18.436,54 11.408,55 12.58,56 13.657,57 14.812,58 15.934,59 17.089,60 24.793,61 27.146,62 29.593,63 9.678}
{0 CHEMBL339869,1 1,2 3.987,3 6.043,4 2.79,5 8.648,6 2.79,7 8.648,8 0.324,9 3,10 2.743,11 3.772,12 3.027,13 3.996,14 2.989,15 2.989,16 17.306,17 19.75,18 21.985,19 23.709,20 25.559,21 27.415,22 29.275,23 4.667,24 4.044,25 4.851,26 0.765,27 0.592,28 6.746,29 11.149,30 7.811,31 11.084,32 12.827,33 4.372,34 6.745,35 8.963,36 10.219,37 12.311,38 3.802,39 3.802,40 3.802,41 286.662,42 20.032,43 21.867,44 17.733,45 36.141,46 10.915,47 12.622,48 15.235,49 14.601,50 8.969,51 16.396,52 10.236,53 18.208,54 11.156,55 12.324,56 13.34,57 14.468,58 15.531,59 16.645,60 24.373,61 26.683,62 29.057,63 9.62}
{0 CHEMBL341219,1 1,2 3.88,3 6.05,4 2.778,5 8.675,6 2.778,7 8.675,8 0.319,9 4,10 2.75,11 3.773,12 3.026,13 3.836,14 2.867,15 2.867,16 16.579,17 18.935,18 20.987,19 23.171,20 24.964,21 26.762,22 28.565,23 4.222,24 3.98,25 5.477,26 0.814,27 0.61,28 6.594,29 10.706,30 7.57,31 10.897,32 12.6,33 4.242,34 6.51,35 8.625,36 9.844,37 11.829,38 3.748,39 3.748,40 3.748,41 292.21,42 19.605,43 21.384,44 17.126,45 34.246,46 10.61,47 12.147,48 14.694,49 14.327,50 8.735,51 16.074,52 9.979,53 17.834,54 10.835,55 11.973,56 12.926,57 14.018,58 15.022,59 16.094,60 23.263,61 25.397,62 27.641,63 9.921}
{0 CHEMBL413308,1 1,2 4.099,3 6.072,4 2.864,5 8.804,6 2.864,7 8.804,8 0.317,9 4,10 2.778,11 3.834,12 3.215,13 4.003,14 2.999,15 2.999,16 17.649,17 20.102,18 22.42,19 24.1,20 25.993,21 27.894,22 29.803,23 5.333,24 4.161,25 5.504,26 0.86,27 0.615,28 7.066,29 11.026,30 8.115,31 11.284,32 13.045,33 4.526,34 6.799,35 8.929,36 10.147,37 12.152,38 3.882,39 3.882,40 3.882,41 338.727,42 20.349,43 22.218,44 18.371,45 36.959,46 11.109,47 12.915,48 15.488,49 14.838,50 9.311,51 16.656,52 10.558,53 18.494,54 11.545,55 12.721,56 13.796,57 14.952,58 16.071,59 17.227,60 24.848,61 27.235,62 29.665,63 9.921}
{0 CHEMBL417071,2 3.764,3 5.357,4 2.45,5 6.933,6 2.45,7 6.933,8 0.297,9 2,10 2.416,11 3.435,12 2.814,13 3.775,14 2.783,15 2.783,16 16.289,17 18.658,18 20.758,19 22.844,20 24.65,21 26.462,22 28.279,23 2.889,24 3.778,25 5.169,26 0.363,27 0.609,28 6.256,29 10.334,30 7.213,31 10.517,32 12.221,33 3.971,34 6.186,35 8.27,36 9.462,37 11.441,38 3.475,39 3.475,40 3.475,41 231.656,42 19.253,43 21.044,44 16.81,45 34.209,46 10.228,47 11.806,48 14.355,49 13.953,50 8.373,51 15.705,52 9.59,53 17.473,54 10.468,55 11.596,56 12.569,57 13.66,58 14.683,59 15.761,60 23.054,61 25.233,62 27.5,63 7.409}
{0 CHEMBL419590,1 1,2 3.813,3 5.426,4 2.547,5 7.133,6 2.547,7 7.133,8 0.309,9 2,10 2.527,11 3.538,12 2.761,13 3.784,14 2.792,15 2.792,16 16.36,17 18.729,18 20.786,19 22.944,20 24.737,21 26.536,22 28.34,23 3.333,24 3.907,25 4.915,26 0.473,27 0.603,28 6.399,29 10.598,30 7.365,31 10.721,32 12.41,33 4.113,34 6.389,35 8.51,36 9.75,37 11.734,38 3.532,39 3.532,40 3.532,41 246.541,42 19.383,43 21.16,44 16.913,45 34.164,46 10.418,47 11.926,48 14.483,49 14.127,50 8.528,51 15.865,52 9.794,53 17.618,54 10.619,55 11.77,56 12.707,57 13.806,58 14.803,59 15.881,60 23.081,61 25.229,62 27.494,63 5.337}
{0 CHEMBL420872,1 1,2 3.793,3 5.412,4 2.538,5 7.073,6 2.538,7 7.073,8 0.307,9 2,10 2.499,11 3.522,12 2.76,13 3.782,14 2.789,15 2.789,16 16.302,17 18.681,18 20.75,19 22.883,20 24.682,21 26.487,22 28.298,23 3.111,24 3.897,25 5.055,26 0.294,27 0.603,28 6.293,29 10.512,30 7.256,31 10.595,32 12.295,33 4.01,34 6.285,35 8.413,36 9.632,37 11.64,38 3.525,39 3.525,40 3.525,41 227.286,42 19.306,43 21.09,44 16.858,45 34.154,46 10.309,47 11.843,48 14.408,49 14.023,50 8.429,51 15.769,52 9.675,53 17.532,54 10.531,55 11.672,56 12.63,57 13.726,58 14.738,59 15.817,60 23.051,61 25.206,62 27.475,63 5.222}
{0 CHEMBL421910,1 1,2 3.997,3 6.054,4 2.784,5 8.684,6 2.784,7 8.684,8 0.326,9 3,10 2.758,11 3.779,12 3.006,13 3.96,14 2.961,15 2.961,16 16.757,17 19.124,18 21.212,19 23.315,20 25.121,21 26.932,22 28.745,23 4.667,24 3.981,25 5.496,26 0.765,27 0.606,28 6.621,29 10.875,30 7.624,31 10.919,32 12.641,33 4.276,34 6.591,35 8.75,36 9.968,37 12.005,38 4.342,39 4.342,40 4.342,41 274,42 19.719,43 21.514,44 17.307,45 34.575,46 10.668,47 12.267,48 14.822,49 14.389,50 8.792,51 16.154,52 10.029,53 17.931,54 10.923,55 12.063,56 13.046,57 14.145,58 15.173,59 16.256,60 23.502,61 25.663,62 27.919,63 10.201}
{0 CHEMBL432433,2 3.852,3 5.772,4 2.617,5 7.936,6 2.617,7 7.936,8 0.317,9 1,10 2.58,11 3.604,12 2.764,13 3.826,14 2.846,15 2.846,16 16.674,17 19.084,18 21.193,19 23.215,20 25.031,21 26.853,22 28.681,23 3.556,24 3.917,25 4.89,26 0.577,27 0.604,28 6.524,29 10.718,30 7.519,31 10.843,32 12.552,33 4.182,34 6.474,35 8.611,36 9.844,37 11.855,38 3.589,39 3.589,40 3.589,41 262.93,42 19.61,43 21.408,44 17.234,45 34.876,46 10.589,47 12.156,48 14.743,49 14.29,50 8.684,51 16.048,52 9.943,53 17.822,54 10.811,55 11.965,56 12.938,57 14.048,58 15.078,59 16.173,60 23.535,61 25.734,62 28.049,63 4.509}
{0 CHEMBL432443,1 1,2 3.725,3 5.412,4 2.538,5 7.075,6 2.538,7 7.075,8 0.302,9 2,10 2.499,11 3.522,12 2.761,13 3.782,14 2.789,15 2.789,16 16.303,17 18.682,18 20.75,19 22.884,20 24.683,21 26.488,22 28.298,23 3.111,24 3.897,25 5.207,26 0.294,27 0.597,28 6.293,29 10.512,30 7.256,31 10.608,32 12.304,33 4.01,34 6.285,35 8.413,36 9.64,37 11.644,38 3.526,39 3.526,40 3.526,41 244.36,42 19.308,43 21.091,44 16.86,45 34.155,46 10.316,47 11.843,48 14.41,49 14.028,50 8.429,51 15.773,52 9.685,53 17.534,54 10.531,55 11.678,56 12.631,57 13.73,58 14.739,59 15.819,60 23.052,61 25.207,62 27.476,63 5.523}
{0 CHEMBL433112,2 3.859,3 6.069,4 2.817,5 8.756,6 2.817,7 8.756,8 0.309,9 2,10 2.748,11 3.794,12 2.97,13 3.935,14 2.967,15 2.967,16 16.954,17 19.347,18 21.466,19 23.516,20 25.334,21 27.159,22 28.99,23 5.556,24 4.105,25 5.761,26 1.276,27 0.611,28 6.815,29 10.83,30 7.801,31 11.114,32 12.827,33 4.419,34 6.667,35 8.763,36 9.991,37 11.955,38 4.13,39 4.13,40 4.13,41 406.247,42 19.901,43 21.704,44 17.513,45 35.089,46 10.841,47 12.436,48 15.001,49 14.568,50 8.967,51 16.331,52 10.21,53 18.109,54 11.091,55 12.238,56 13.219,57 14.326,58 15.359,59 16.452,60 23.793,61 25.993,62 28.294,63 3.889}
{0 CHEMBL435203,1 1,2 4.111,3 6.056,4 2.799,5 8.704,6 2.799,7 8.704,8 0.315,9 3,10 2.76,11 3.787,12 3.162,13 4.002,14 2.998,15 2.998,16 17.606,17 20.066,18 22.396,19 24.055,20 25.955,21 27.863,22 29.778,23 5.111,24 3.985,25 5.359,26 0.814,27 0.611,28 6.957,29 10.953,30 8.013,31 11.16,32 12.933,33 4.417,34 6.701,35 8.843,36 10.053,37 12.078,38 3.887,39 3.887,40 3.887,41 297.599,42 20.286,43 22.165,44 18.333,45 36.963,46 10.997,47 12.844,48 15.42,49 14.739,50 9.216,51 16.57,52 10.456,53 18.42,54 11.464,55 12.642,56 13.73,57 14.891,58 16.02,59 17.181,60 24.831,61 27.225,62 29.659,63 9.854}
{0 CHEMBL441280,1 1,2 3.826,3 5.414,4 2.538,5 7.08,6 2.538,7 7.08,8 0.3,9 2,10 2.501,11 3.522,12 2.761,13 3.783,14 2.79,15 2.79,16 16.31,17 18.688,18 20.753,19 22.895,20 24.692,21 26.495,22 28.304,23 3.333,24 3.897,25 4.922,26 0.294,27 0.597,28 6.365,29 10.542,30 7.306,31 10.646,32 12.339,33 4.113,34 6.355,35 8.458,36 9.669,37 11.665,38 3.526,39 3.526,40 3.526,41 243.87,42 19.326,43 21.106,44 16.872,45 34.156,46 10.34,47 11.862,48 14.423,49 14.059,50 8.477,51 15.8,52 9.715,53 17.556,54 10.563,55 11.701,56 12.653,57 13.747,58 14.756,59 15.833,60 23.055,61 25.209,62 27.478,63 5.398}
{0 CHEMBL444594,1 1,2 3.684,3 5.36,4 2.538,5 7.015,6 2.538,7 7.015,8 0.306,9 2,10 2.497,11 3.522,12 2.76,13 3.778,14 2.782,15 2.782,16 16.192,17 18.565,18 20.639,19 22.796,20 24.6,21 26.409,22 28.223,23 3.111,24 3.897,25 5.199,26 0.294,27 0.597,28 6.176,29 10.392,30 7.135,31 10.463,32 12.17,33 3.895,34 6.166,35 8.292,36 9.485,37 11.505,38 3.459,39 3.459,40 3.459,41 211.819,42 19.207,43 20.998,44 16.735,45 34.002,46 10.167,47 11.728,48 14.283,49 13.904,50 8.309,51 15.658,52 9.535,53 17.427,54 10.41,55 11.541,56 12.51,57 13.6,58 14.618,59 15.692,60 22.934,61 25.087,62 27.348,63 4.886}
{0 CHEMBL48605,2 3.794,3 5.868,4 2.611,5 8.063,6 2.611,7 8.063,8 0.282,9 2,10 2.621,11 3.618,12 2.815,13 3.798,14 2.8,15 2.8,16 16.194,17 18.545,18 20.596,19 22.781,20 24.572,21 26.366,22 28.163,23 3.333,24 3.794,25 4.722,26 0.363,27 0.602,28 6.312,29 10.392,30 7.222,31 10.515,32 12.217,33 4.098,34 6.282,35 8.345,36 9.491,37 11.471,38 3.281,39 3.281,40 3.281,41 216.317,42 19.218,43 20.997,44 16.727,45 33.772,46 10.206,47 11.762,48 14.301,49 13.944,50 8.395,51 15.689,52 9.571,53 17.448,54 10.464,55 11.566,56 12.54,57 13.612,58 14.628,59 15.689,60 22.863,61 24.988,62 27.217,63 5.903}
{0 CHEMBL48837,2 3.702,3 5.464,4 2.58,5 7.272,6 2.58,7 7.272,8 0.311,9 1,10 2.524,11 3.556,12 2.765,13 3.754,14 2.76,15 2.76,16 16.162,17 18.486,18 20.491,19 22.739,20 24.504,21 26.273,22 28.048,23 3.111,24 3.913,25 5.179,26 0.294,27 0.603,28 6.312,29 10.404,30 7.298,31 10.661,32 12.336,33 3.979,34 6.255,35 8.354,36 9.609,37 11.538,38 3.647,39 3.647,40 3.647,41 245.709,42 19.23,43 20.981,44 16.701,45 33.561,46 10.342,47 11.811,48 14.334,49 14.037,50 8.435,51 15.755,52 9.716,53 17.487,54 10.507,55 11.66,56 12.567,57 13.658,58 14.629,59 15.694,60 22.735,61 24.832,62 27.044,63 6.67}
{0 CHEMBL48945,2 3.544,3 4.676,4 2.23,5 5.183,6 2.23,7 5.183,8 0.275,9 2,10 2.114,11 3.138,12 2.815,13 3.658,14 2.65,15 2.65,16 15.733,17 18.058,18 20.102,19 22.352,20 24.135,21 25.923,22 27.715,23 2.667,24 3.658,25 4.495,26 0.303,27 0.63,28 5.943,29 9.958,30 6.843,31 10.172,32 11.854,33 3.706,34 5.871,35 7.921,36 9.085,37 11.043,38 3.252,39 3.252,40 3.252,41 179.269,42 18.804,43 20.574,44 16.22,45 33.188,46 9.804,47 11.34,48 13.846,49 13.565,50 8.001,51 15.296,52 9.192,53 17.044,54 10.041,55 11.145,56 12.089,57 13.155,58 14.148,59 15.2,60 22.348,61 24.463,62 26.675,63 6.194}
{0 CHEMBL51128,2 3.709,3 5.353,4 2.522,5 6.998,6 2.522,7 6.998,8 0.308,9 1,10 2.493,11 3.512,12 2.758,13 3.745,14 2.734,15 2.734,16 16.333,17 18.705,18 20.825,19 22.867,20 24.677,21 26.494,22 28.315,23 3.111,24 3.897,25 5.119,26 0.15,27 0.606,28 6.196,29 10.433,30 7.195,31 10.524,32 12.226,33 3.876,34 6.177,35 8.323,36 9.564,37 11.571,38 3.512,39 3.512,40 3.512,41 225.482,42 19.269,43 21.063,44 16.806,45 34.377,46 10.24,47 11.829,48 14.378,49 13.958,50 8.343,51 15.713,52 9.603,53 17.484,54 10.453,55 11.603,56 12.56,57 13.663,58 14.677,59 15.761,60 23.131,61 25.329,62 27.611,63 7.398}