@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL5122

@attribute molecule_id {CHEMBL10,CHEMBL101253,CHEMBL103667,CHEMBL105442,CHEMBL1173655,CHEMBL119385,CHEMBL1230020,CHEMBL1236107,CHEMBL1240703,CHEMBL1241674,CHEMBL124660,CHEMBL1287853,CHEMBL1289926,CHEMBL1336,CHEMBL1421,CHEMBL14762,CHEMBL1614701,CHEMBL162,CHEMBL1688860,CHEMBL1688861,CHEMBL1721885,CHEMBL1789941,CHEMBL180022,CHEMBL1908391,CHEMBL1908392,CHEMBL1908393,CHEMBL1908394,CHEMBL1908395,CHEMBL1908396,CHEMBL1908397,CHEMBL191003,CHEMBL1929238,CHEMBL215152,CHEMBL2171124,CHEMBL221959,CHEMBL223360,CHEMBL230011,CHEMBL2309006,CHEMBL2309609,CHEMBL2311806,CHEMBL2311807,CHEMBL2311808,CHEMBL2331602,CHEMBL2333365,CHEMBL2336005,CHEMBL2336006,CHEMBL2336007,CHEMBL2336008,CHEMBL2336009,CHEMBL2336010,CHEMBL2336011,CHEMBL2336012,CHEMBL2336013,CHEMBL2336014,CHEMBL2336015,CHEMBL2336016,CHEMBL2336017,CHEMBL2336018,CHEMBL2336019,CHEMBL2336020,CHEMBL2336021,CHEMBL2336022,CHEMBL2336023,CHEMBL2336024,CHEMBL2336025,CHEMBL2336026,CHEMBL2336027,CHEMBL2336028,CHEMBL2336029,CHEMBL2336030,CHEMBL2336031,CHEMBL2336032,CHEMBL2336033,CHEMBL2336034,CHEMBL2336035,CHEMBL2336036,CHEMBL2336037,CHEMBL2336038,CHEMBL2336039,CHEMBL2336040,CHEMBL24828,CHEMBL249697,CHEMBL255863,CHEMBL259084,CHEMBL261849,CHEMBL278041,CHEMBL288441,CHEMBL296468,CHEMBL300138,CHEMBL31965,CHEMBL377300,CHEMBL379218,CHEMBL384304,CHEMBL386051,CHEMBL428690,CHEMBL440084,CHEMBL445813,CHEMBL450786,CHEMBL464552,CHEMBL475251,CHEMBL477772,CHEMBL483321,CHEMBL491473,CHEMBL494089,CHEMBL509032,CHEMBL513909,CHEMBL518051,CHEMBL521851,CHEMBL522892,CHEMBL525191,CHEMBL535,CHEMBL553,CHEMBL554,CHEMBL558752,CHEMBL572878,CHEMBL572881,CHEMBL573339,CHEMBL574738,CHEMBL576982,CHEMBL601719,CHEMBL607707,CHEMBL608154,CHEMBL91829,CHEMBL939,CHEMBL941}
@attribute Eta_betaS_A numeric
@attribute ATSC7e numeric
@attribute ATSC5e numeric
@attribute ATSC4e numeric
@attribute DECC numeric
@attribute ATSC6e numeric
@attribute StsC numeric
@attribute P_VSA_LogP_6 numeric
@attribute GATS4s numeric
@attribute SpDiam_AEA.ed. numeric
@attribute MATS5m numeric
@attribute Yindex numeric
@attribute SM11_EA.ed. numeric
@attribute SpDiam_AEA.bo. numeric
@attribute Eig01_AEA.ed. numeric
@attribute Eig01_EA.ed. numeric
@attribute SM10_AEA.dm. numeric
@attribute SM12_EA.ed. numeric
@attribute SM13_EA.ed. numeric
@attribute SM14_EA.ed. numeric
@attribute SM15_EA.ed. numeric
@attribute SpMax_AEA.ed. numeric
@attribute SpMax_EA.ed. numeric
@attribute ATSC2e numeric
@attribute C.022 numeric
@attribute Eig01_AEA.bo. numeric
@attribute Eig01_EA numeric
@attribute nR.C. numeric
@attribute NtsC numeric
@attribute SM09_AEA.bo. numeric
@attribute SpDiam_AEA.ri. numeric
@attribute SpDiam_EA numeric
@attribute SpMax_AEA.bo. numeric
@attribute SpMax_EA numeric
@attribute BLTA96 numeric
@attribute MLOGP2 numeric
@attribute SpDiam_EA.ed. numeric
@attribute SpMax3_Bh.e. numeric
@attribute Eig01_EA.ri. numeric
@attribute SpMax_EA.ri. numeric
@attribute Eig08_EA.bo. numeric
@attribute SpMin3_Bh.i. numeric
@attribute Eig01_AEA.ri. numeric
@attribute SpMax_AEA.ri. numeric
@attribute SM10_EA.ed. numeric
@attribute SpMax3_Bh.v. numeric
@attribute BLTD48 numeric
@attribute BLTF96 numeric
@attribute MLOGP numeric
@attribute nCsp numeric
@attribute SpDiam_EA.ri. numeric
@attribute ATSC3e numeric
@attribute PCR numeric
@attribute SpMax3_Bh.i. numeric
@attribute Chi0_EA.dm. numeric
@attribute Eig05_AEA.bo. numeric
@attribute CATS2D_09_DA numeric
@attribute Eig05_EA.bo. numeric
@attribute SM15_AEA.ri. numeric
@attribute Eig15_EA numeric
@attribute Eig15_EA.ed. numeric
@attribute SM09_AEA.dm. numeric
@attribute SM10_AEA.ri. numeric
@attribute C. numeric
@attribute ATS5m numeric
@attribute pXC50 numeric

@data
{1 0.63,2 0.242,3 0.302,4 0.275,5 1.451,6 0.252,8 17.717,9 0.909,10 6.549,11 0.04,12 0.579,13 26.576,14 5.267,15 6.747,16 11.08,17 11.08,18 28.972,19 31.342,20 33.738,21 36.124,22 6.747,23 11.08,24 0.115,26 4.568,27 3.204,30 3.204,31 5.207,32 5.204,33 4.568,34 3.204,35 -4.92,36 13.619,37 18.235,38 3.833,39 3.103,40 3.103,41 1.772,42 1.782,43 4.172,44 4.172,45 24.24,46 3.748,47 -4.83,48 -4.53,49 3.69,51 5.103,52 0.247,53 1.461,54 3.867,55 4.368,56 3.621,58 3.038,59 3.038,60 -0.453,61 -1.096,62 -0.453,63 -1.096,64 48.8,65 3.857,66 5.301}
{0 CHEMBL101253,1 0.63,2 0.139,3 0.206,4 0.152,5 1.856,6 0.186,8 2.328,9 1.031,10 6.509,11 0.077,12 0.551,13 26.315,14 5.378,15 6.707,16 10.902,17 10.902,18 28.712,19 31.076,20 33.468,21 35.845,22 6.707,23 10.902,24 0.051,26 4.596,27 3.153,30 3.153,31 5.178,32 5.153,33 4.596,34 3.153,35 -5.43,36 17.604,37 18.155,38 3.846,39 3.096,40 3.096,41 1.913,42 1.793,43 4.135,44 4.135,45 23.98,46 3.758,47 -5.31,48 -4.96,49 4.196,51 5.096,52 0.15,53 1.535,54 3.882,55 18.364,56 3.404,57 1,58 2.76,59 2.76,60 -0.583,61 -1.455,62 -0.583,63 -1.455,64 50,65 3.759,66 5}
{0 CHEMBL103667,1 0.647,2 0.461,3 0.653,4 0.467,5 2.479,6 0.568,8 4.276,9 0.789,10 6.941,11 0.066,12 0.379,13 27.64,14 5.594,15 7.139,16 11.836,17 11.836,18 30.083,19 32.509,20 34.951,21 37.389,22 7.139,23 11.836,24 0.407,26 4.594,27 3.366,30 3.366,31 5.453,32 5.366,33 4.594,34 3.366,35 -5.07,36 14.725,37 19.07,38 3.82,39 3.316,40 3.316,41 2.516,42 1.737,43 4.35,44 4.35,45 25.235,46 3.734,47 -4.97,48 -4.65,49 3.837,51 5.316,52 0.522,53 1.479,54 3.869,55 36.989,56 3.751,58 3.142,59 3.142,60 1,61 2.275,62 1,63 2.275,64 40.8,65 4.298,66 7.352}
{0 CHEMBL105442,1 0.63,2 0.91,3 0.793,4 0.789,5 1.485,6 0.863,8 29.92,9 1.133,10 6.296,11 0.009,12 0.661,13 26.348,14 5.489,15 6.732,16 10.87,17 10.87,18 28.735,19 31.082,20 33.464,21 35.83,22 6.732,23 10.87,24 0.379,26 4.52,27 3.167,30 3.167,31 5.183,32 5.167,33 4.52,34 3.167,35 -5.59,36 18.986,37 18.175,38 3.841,39 3.063,40 3.063,41 1.946,42 1.379,43 4.133,44 4.133,45 24.038,46 3.775,47 -5.46,48 -5.09,49 4.357,51 5.063,52 0.857,53 1.356,54 3.858,55 16.843,56 3.475,58 2.658,59 2.658,60 -0.742,61 -1.619,62 -0.742,63 -1.619,64 43.6,65 4.097,66 5}
{0 CHEMBL1173655,1 0.676,2 0.913,3 0.694,4 0.744,5 1.841,6 0.675,8 17.288,9 0.79,10 6.204,11 -0.015,12 0.507,13 26.144,14 5.517,15 6.591,16 10.562,17 10.562,18 28.49,19 30.797,20 33.139,21 35.467,22 6.591,23 10.562,24 0.505,26 4.58,27 3.146,30 3.146,31 5.231,32 5.146,33 4.58,34 3.146,35 -4.06,36 8.01,37 17.503,38 3.784,39 3.041,40 3.041,41 2.235,42 1.646,43 4.113,44 4.113,45 23.878,46 3.61,47 -4.01,48 -3.8,49 2.83,51 5.041,52 0.846,53 1.446,54 3.824,55 32.664,56 3.566,57 1,58 2.875,59 2.875,60 0.424,61 1.106,62 0.424,63 1.106,64 40.7,65 4.213,66 5}
{0 CHEMBL119385,1 0.643,2 0.581,3 0.753,4 0.817,5 1.745,6 0.674,8 29.92,9 0.92,10 6.59,11 -0.011,12 0.554,13 27.478,14 5.486,15 7.045,16 12.073,17 12.073,18 29.962,19 32.428,20 34.912,21 37.391,22 7.045,23 12.073,24 0.385,26 4.659,27 3.3,30 3.3,31 5.404,32 5.3,33 4.659,34 3.3,35 -6.72,36 30.19,37 19.503,38 3.771,39 3.195,40 3.195,41 2.222,42 1.69,43 4.27,44 4.27,45 25.039,46 3.668,47 -6.54,48 -6.06,49 5.495,51 5.195,52 0.661,53 1.445,54 3.805,55 19.118,56 3.456,58 2.745,59 2.745,60 -0.347,61 -0.757,62 -0.347,63 -0.757,64 51.4,65 4.383,66 5}
{0 CHEMBL1230020,1 0.639,2 1.18,3 1.187,4 1.292,5 1.556,6 0.968,8 41.691,9 1.161,10 6.676,11 -0.026,12 0.705,13 27.595,14 5.574,15 6.959,16 11.67,17 11.67,18 30.033,19 32.448,20 34.881,21 37.306,22 6.959,23 11.67,24 0.571,26 4.724,27 3.307,30 3.307,31 5.326,32 5.307,33 4.724,34 3.307,35 -3.76,36 6.381,37 19.344,38 3.836,39 3.247,40 3.247,41 1.885,42 1.747,43 4.283,44 4.283,45 25.202,46 3.723,47 -3.72,48 -3.54,49 2.526,51 5.247,52 0.941,53 1.454,54 3.833,55 9.931,56 3.556,57 2,58 2.938,59 2.938,60 -0.494,61 -0.931,62 -0.494,63 -0.931,64 41.5,65 4.176,66 5.387}
{0 CHEMBL1236107,1 0.673,2 0.321,3 0.239,4 0.225,5 1.675,6 0.197,8 11.771,9 1.052,10 6.262,11 0.028,12 0.465,13 26.203,14 5.351,15 6.574,16 10.474,17 10.474,18 28.531,19 30.827,20 33.151,21 35.464,22 6.574,23 10.474,24 0.186,26 4.578,27 3.134,30 3.134,31 5.224,32 5.134,33 4.578,34 3.134,35 -4.86,36 13.178,37 17.234,38 3.863,39 2.934,40 2.934,41 2.084,42 1.446,43 4.062,44 4.062,45 23.938,46 3.678,47 -4.77,48 -4.48,49 3.63,51 4.934,52 0.242,53 1.628,54 3.934,55 6.656,56 3.56,58 2.971,59 2.971,60 -0.485,61 -1.219,62 -0.485,63 -1.219,64 46.2,65 3.827,66 5}
{0 CHEMBL1240703,1 0.693,2 1.207,3 1.043,4 0.778,5 1.508,6 1.038,8 32.119,9 0.963,10 7.826,11 -0.084,12 0.473,13 30.47,14 6.138,15 8.024,16 15.536,17 15.536,18 33.178,19 35.883,20 38.599,21 41.316,22 8.024,23 15.536,24 0.531,26 5.138,27 3.793,30 3.793,31 5.871,32 5.793,33 5.138,34 3.793,35 -4.59,36 11.275,37 24.424,38 3.943,39 3.613,40 3.613,41 2.882,42 1.882,43 4.739,44 4.739,45 27.788,46 3.858,47 -4.51,48 -4.24,49 3.358,51 5.613,52 0.695,53 1.54,54 3.972,55 30.107,56 4.182,57 2,58 3.608,59 3.608,60 1.336,61 3.097,62 1.336,63 3.097,64 47.3,65 5.019,66 5}
{0 CHEMBL1241674,1 0.685,2 0.372,3 0.359,4 0.4,5 1.18,6 0.224,8 7.229,9 0.813,10 6.57,11 -0.18,12 0.703,13 27.524,14 5.46,15 7.042,16 12.1,17 12.1,18 30.009,19 32.475,20 34.96,21 37.439,22 7.042,23 12.1,24 0.171,26 4.771,27 3.347,30 3.347,31 5.382,32 5.347,33 4.771,34 3.347,35 -4.06,36 7.994,37 19.606,38 3.578,39 3.22,40 3.22,41 2.066,42 1.615,43 4.309,44 4.309,45 25.084,46 3.404,47 -4.01,48 -3.79,49 2.827,51 5.22,52 0.28,53 1.54,54 3.655,55 11.643,56 3.449,57 2,58 2.816,59 2.816,60 -0.876,61 -2.119,62 -0.876,63 -2.119,64 41,65 3.686,66 5.215}
{0 CHEMBL124660,1 0.683,2 0.884,3 0.805,4 0.658,5 3.243,6 0.566,8 6.604,9 1.244,10 6.527,11 -0.017,12 0.32,13 26.558,14 5.597,15 6.725,16 10.984,17 10.984,18 28.936,19 31.285,20 33.664,21 36.034,22 6.725,23 10.984,24 0.525,26 4.597,27 3.185,30 3.185,31 5.225,32 5.185,33 4.597,34 3.185,35 -4.15,36 8.526,37 18.176,38 3.859,39 3.055,40 3.055,41 2.334,42 1.77,43 4.143,44 4.143,45 24.249,46 3.696,47 -4.09,48 -3.87,49 2.92,51 5.055,52 0.686,53 1.377,54 3.928,55 40.814,56 3.607,57 1,58 2.934,59 2.934,60 1,61 2.275,62 1,63 2.275,64 37.3,65 4.34,66 5}
{0 CHEMBL1287853,1 0.649,2 0.467,3 0.859,4 0.609,5 2.793,6 0.37,8 4.227,9 1.11,10 7.013,11 -0.094,12 0.374,13 28.084,14 5.834,15 7.355,16 12.764,17 12.764,18 30.617,19 33.145,20 35.684,21 38.221,22 7.355,23 12.764,24 0.49,26 4.875,27 3.462,30 3.462,31 5.484,32 5.462,33 4.875,34 3.462,35 -4.36,36 9.82,37 20.441,38 3.856,39 3.215,40 3.215,41 2.526,42 1.735,43 4.393,44 4.393,45 25.577,46 3.71,47 -4.3,48 -4.05,49 3.134,51 5.215,52 0.453,53 1.437,54 3.921,55 38.907,56 3.829,57 4,58 3.019,59 3.019,60 0.618,61 1.372,62 0.618,63 1.372,64 37,65 4.201,66 6.022}
{0 CHEMBL1289926,1 0.616,2 0.162,3 0.169,4 0.237,5 2.265,6 0.138,8 2.757,9 1.576,10 6.344,11 -0.055,12 0.457,13 26.212,14 5.353,15 6.542,16 10.339,17 10.339,18 28.547,19 30.851,20 33.179,21 35.493,22 6.542,23 10.339,24 0.109,26 4.558,27 3.099,30 3.099,31 5.207,32 5.099,33 4.558,34 3.099,35 -4.38,36 9.92,37 17.118,38 3.863,39 3.022,40 3.022,41 2.071,42 1.798,43 4.073,44 4.073,45 23.933,46 3.77,47 -4.31,48 -4.07,49 3.15,51 5.022,52 0.116,53 1.631,54 3.903,55 7.851,56 3.413,57 1,58 2.665,59 2.665,64 47.8,65 3.866,66 5.276}
{0 CHEMBL1336,1 0.656,2 1.184,3 1.117,4 1.323,5 2.451,6 1.027,8 4.276,9 1.047,10 6.794,11 -0.036,12 0.452,13 27.535,14 5.419,15 7.24,16 12.181,17 12.181,18 30.03,19 32.516,20 35.013,21 37.507,22 7.24,23 12.181,24 1.055,26 4.547,27 3.377,30 3.377,31 5.319,32 5.377,33 4.547,34 3.377,35 -3.51,36 5.192,37 19.593,38 3.837,39 2.944,40 2.944,41 2.359,42 1.77,43 4.244,44 4.244,45 25.07,46 3.741,47 -3.48,48 -3.33,49 2.279,51 4.944,52 0.943,53 1.441,54 3.871,55 27.261,56 3.704,57 1,58 3.009,59 3.009,60 0.136,61 0.249,62 0.136,63 0.249,64 43.8,65 4.034,66 8.18}
{0 CHEMBL1421,1 0.689,2 0.533,3 0.76,4 0.546,5 2.349,6 0.671,8 6.014,9 0.784,10 6.197,11 0.046,12 0.419,13 25.769,14 5.372,15 6.427,16 9.81,17 9.81,18 28.043,19 30.267,20 32.531,21 34.773,22 6.427,23 9.81,24 0.43,26 4.372,27 3.025,30 3.025,31 5.109,32 5.025,33 4.372,34 3.025,35 -4.5,36 10.678,37 16.37,38 3.818,39 2.855,40 2.855,41 2.446,42 1.628,43 3.97,44 3.97,45 23.582,46 3.706,47 -4.42,48 -4.17,49 3.268,51 4.855,52 0.6,53 1.4,54 3.859,55 32.957,56 3.573,57 2,58 2.8,59 2.8,60 0.302,61 0.714,62 0.302,63 0.714,64 37.3,65 4.247,66 7.932}
{0 CHEMBL14762,1 0.673,2 0.429,3 0.557,4 0.425,5 1.462,6 0.263,8 4.227,9 1.088,10 6.607,11 -0.066,12 0.678,13 26.644,14 5.503,15 6.805,16 11.227,17 11.227,18 29.066,19 31.461,20 33.879,21 36.287,22 6.805,23 11.227,24 0.304,26 4.656,27 3.226,30 3.226,31 5.24,32 5.226,33 4.656,34 3.226,35 -4.72,36 12.167,37 18.537,38 3.724,39 3.01,40 3.01,41 1.595,42 1.625,43 4.159,44 4.159,45 24.277,46 3.548,47 -4.63,48 -4.35,49 3.488,51 5.01,52 0.365,53 1.418,54 3.791,55 24.833,56 3.239,58 2.306,59 2.306,60 -0.52,61 -1.136,62 -0.52,63 -1.136,64 36.5,65 3.806,66 5}
{0 CHEMBL1614701,1 0.667,2 0.901,3 0.944,4 0.832,5 1.317,6 1.045,8 17.104,9 1.089,10 6.817,11 0.039,12 0.728,13 27.047,14 5.603,15 6.907,16 11.539,17 11.539,18 29.486,19 31.892,20 34.328,21 36.751,22 6.907,23 11.539,24 0.538,26 4.714,27 3.294,30 3.294,31 5.307,32 5.294,33 4.714,34 3.294,35 -4.17,36 8.656,37 19.207,38 3.624,39 3.175,40 3.175,41 1.925,42 1.426,43 4.258,44 4.258,45 24.675,46 3.42,47 -4.11,48 -3.89,49 2.942,51 5.175,52 0.872,53 1.449,54 3.663,55 18.997,56 3.45,57 1,58 2.765,59 2.765,60 -0.44,61 -0.847,62 -0.44,63 -0.847,64 40.5,65 4.164,66 5}
{0 CHEMBL162,1 0.707,2 0.67,3 0.654,4 0.443,5 0.986,6 0.548,8 20.348,9 0.838,10 7.696,11 -0.099,12 0.616,13 30.416,14 6.131,15 8.018,16 15.502,17 15.502,18 33.125,19 35.831,20 38.547,21 41.264,22 8.018,23 15.502,24 0.37,26 5.131,27 3.785,30 3.785,31 5.862,32 5.785,33 5.131,34 3.785,35 -3.69,36 6.07,37 24.331,38 3.852,39 3.602,40 3.602,41 2.62,42 1.856,43 4.73,44 4.73,45 27.73,46 3.707,47 -3.66,48 -3.48,49 2.464,51 5.602,52 0.571,53 1.503,54 3.888,55 28.268,56 3.861,57 1,58 3.412,59 3.412,60 0.939,61 2.394,62 0.939,63 2.394,64 45.9,65 4.778,66 7.377}
{0 CHEMBL1688860,1 0.654,2 0.665,3 0.672,4 1.159,5 2.347,6 1.872,8 2.328,9 0.876,10 6.651,11 -0.012,12 0.373,13 27.408,14 5.45,15 7.124,16 11.741,17 11.741,18 29.837,19 32.254,20 34.688,21 37.12,22 7.124,23 11.741,24 1.016,26 4.504,27 3.337,30 3.337,31 5.286,32 5.337,33 4.504,34 3.337,35 -5.31,36 16.686,37 18.836,38 3.931,39 3.027,40 3.027,41 2.4,42 1.862,43 4.214,44 4.214,45 25.021,46 3.834,47 -5.2,48 -4.86,49 4.085,51 5.027,52 0.608,53 1.403,54 3.967,55 36.191,56 3.724,58 2.982,59 2.982,60 0.959,61 2.247,62 0.959,63 2.247,64 42.6,65 4.366,66 8.585}
{0 CHEMBL1688861,1 0.641,2 1.69,3 0.759,4 1.15,5 2.379,6 1.603,8 2.328,9 0.866,10 6.713,11 0.131,12 0.379,13 27.95,14 5.527,15 7.186,16 11.979,17 11.979,18 30.401,19 32.84,20 35.293,21 37.743,22 7.186,23 11.979,24 0.943,26 4.581,27 3.403,30 3.403,31 5.427,32 5.403,33 4.581,34 3.403,35 -5.31,36 16.686,37 19.285,38 3.932,39 3.295,40 3.295,41 2.452,42 1.862,43 4.355,44 4.355,45 25.532,46 3.834,47 -5.2,48 -4.86,49 4.085,51 5.295,52 0.671,53 1.403,54 3.969,55 36.27,56 4.029,58 3.31,59 3.31,60 0.959,61 2.247,62 0.959,63 2.247,64 42.6,65 4.387,66 8.155}
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{0 CHEMBL2336029,1 0.62,2 0.191,3 0.171,4 0.201,5 1.939,6 0.08,7 6.235,8 45.832,9 1.548,10 6.109,11 0.106,12 0.54,13 25.199,14 5.333,15 6.199,16 9.262,17 9.262,18 27.435,19 29.621,20 31.845,21 34.047,22 6.199,23 9.262,24 0.168,25 2,26 4.457,27 2.961,28 2,29 2,30 2.961,31 5.022,32 4.961,33 4.457,34 2.961,35 -4.43,36 10.25,37 15.543,38 3.695,39 2.953,40 2.953,41 1.677,42 1.625,43 3.953,44 3.953,45 23.044,46 3.53,47 -4.36,48 -4.11,49 3.202,50 2,51 4.953,52 0.179,53 1.599,54 3.765,55 11.347,56 3.225,57 2,58 2.301,59 2.301,60 -0.567,61 -1.495,62 -0.567,63 -1.495,64 44.4,65 3.501,66 6}
{0 CHEMBL2336030,1 0.62,2 0.133,3 0.122,4 0.264,5 1.814,6 0.141,7 6.23,8 45.832,9 1.453,10 5.713,11 0.14,12 0.549,13 25.2,14 5.324,15 6.199,16 9.262,17 9.262,18 27.437,19 29.623,20 31.847,21 34.049,22 6.199,23 9.262,24 0.17,25 2,26 4.457,27 2.961,28 2,29 2,30 2.961,31 5.023,32 4.961,33 4.457,34 2.961,35 -4.43,36 10.25,37 15.546,38 3.714,39 2.954,40 2.954,41 1.821,42 1.647,43 3.954,44 3.954,45 23.046,46 3.558,47 -4.36,48 -4.11,49 3.202,50 2,51 4.954,52 0.155,53 1.599,54 3.782,55 11.347,56 3.238,57 2,58 2.301,59 2.301,60 -0.831,61 -2,62 -0.831,63 -2,64 44.4,65 3.533,66 6}
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