"molecule_id","GATS2p","GATS2v","GATS7p","MATS2p","MATS2v","AAC","AECC","ALOGP","ALOGP2","AMR","AMW","ARR","ATS1e","ATS1i","ATS1m","ATS1p","ATS1s","ATS1v","ATS2e","ATS2i","ATS2m","ATS2p","ATS2s","ATS2v","ATS3e","ATS3i","ATS3m","ATS3p","ATS3s","ATS3v","ATS4e","ATS4i","ATS4m","ATS4p","ATS4s","ATS4v","ATS5e","ATS5i","ATS5m","ATS5p","ATS5s","ATS5v","ATS6e","ATS6i","ATS6m","ATS6p","ATS6s","ATS6v","ATS7e","ATS7i","ATS7m","ATS7p","ATS7s","ATS7v","ATS8e","ATS8i","ATS8m","ATS8p","ATS8s","ATS8v","ATSC1e","ATSC1i","ATSC1m","ATSC1p","ATSC1s","ATSC1v","ATSC2e","ATSC2i","ATSC2m","ATSC2p","ATSC2s","ATSC2v","ATSC3e","ATSC3i","ATSC3m","ATSC3p","ATSC3s","ATSC3v","ATSC4e","ATSC4i","ATSC4m","ATSC4p","ATSC4s","ATSC4v","ATSC5e","ATSC5i","ATSC5m","ATSC5p","ATSC5s","ATSC5v","ATSC6e","ATSC6i","ATSC6m","ATSC6p","ATSC6s","ATSC6v","ATSC7e","ATSC7i","ATSC7m","ATSC7p","ATSC7s","ATSC7v","ATSC8e","ATSC8i","ATSC8m","ATSC8p","ATSC8s","ATSC8v","B.112","BAC","BBI","BIC0","BIC1","BIC2","BIC3","BIC4","pXC50"
{1 0.966,2 0.909,3 0.899,4 -0.012,5 0.015,6 2.365,7 7.316,8 3.259,9 10.62,10 70.926,11 12.594,12 0.5,13 3.445,14 3.46,15 3.647,16 3.233,17 4.686,18 3.359,19 3.921,20 3.949,21 4.074,22 3.636,23 5.599,24 3.657,25 4.157,26 4.218,27 4.215,28 3.727,29 5.63,30 3.674,31 4.117,32 4.21,33 4.086,34 3.589,35 5.526,36 3.653,37 3.846,38 3.893,39 4.02,40 3.363,41 5.749,42 3.629,43 3.817,44 3.873,45 3.84,46 3.082,47 5.722,48 3.56,49 3.53,50 3.642,51 2.919,52 2.862,53 4.908,54 3.463,55 3.325,56 3.481,57 2.728,58 2.821,59 4.558,60 3.332,61 0.313,62 0.449,63 2.544,64 3.309,65 44.077,66 2.85,67 0.566,68 0.744,69 7.347,70 5.849,71 76.6,72 5.066,73 0.662,74 0.785,75 20.834,76 8.339,77 102.633,78 5.359,79 0.777,80 0.742,81 21.142,82 7.616,83 119.54,84 4.976,85 0.621,86 0.576,87 24.42,88 6.647,89 120.865,90 5.062,91 0.662,92 0.526,93 11.172,94 5.196,95 94.294,96 6.704,97 0.43,98 0.395,99 9.302,100 3.666,101 64.445,102 7.264,103 0.394,104 0.331,105 12.167,106 3.668,107 41.063,108 5.271,109 1,110 41,111 30,112 0.461,113 0.772,114 0.806,115 0.855,116 0.869,117 6.244}
{0 CHEMBL1795563,1 1.201,2 0.842,3 1.036,4 -0.045,5 0.092,6 2.206,7 11.667,8 0.494,9 0.244,10 95.086,11 10.334,12 0.393,13 3.825,14 3.911,15 3.822,16 3.395,17 5.205,18 3.364,19 4.282,20 4.385,21 4.113,22 3.691,23 5.859,24 3.666,25 4.455,26 4.579,27 4.086,28 3.729,29 5.993,30 3.701,31 4.442,32 4.563,33 4.184,34 3.697,35 6.113,36 3.678,37 4.467,38 4.593,39 4.117,40 3.665,41 6.151,42 3.644,43 4.504,44 4.662,45 4.047,46 3.684,47 6.159,48 3.584,49 4.449,50 4.639,51 3.983,52 3.567,53 5.924,54 3.496,55 4.278,56 4.443,57 3.736,58 3.383,59 5.952,60 3.376,61 0.404,62 0.695,63 6.167,64 4.374,65 47.457,66 2.85,67 0.811,68 1.014,69 14.475,70 6.685,71 89.701,72 5.066,73 0.98,74 1.134,75 18.062,76 7.699,77 115.639,78 5.164,79 1.043,80 1.082,81 16.531,82 7.749,83 140.015,84 5.089,85 1.126,86 1.016,87 16.775,88 7.731,89 168.587,90 5.467,91 1.177,92 1.022,93 25.194,94 9.18,95 169.121,96 6.758,97 1.131,98 0.96,99 22.371,100 7.65,101 127.222,102 6.444,103 0.873,104 0.78,105 18.558,106 6.411,107 142.639,108 5.204,110 55,111 39,112 0.388,113 0.808,114 0.876,115 0.897,116 0.897,117 4.301}
{0 CHEMBL1795564,1 1.065,2 0.779,3 1.035,4 0.011,5 0.103,6 2.405,7 13.939,8 2.039,9 4.159,10 118.983,11 12.416,12 0.324,13 3.951,14 4.013,15 4.059,16 3.566,17 5.335,18 3.539,19 4.444,20 4.514,21 4.617,22 3.924,23 6.099,24 3.89,25 4.607,26 4.705,27 4.474,28 3.893,29 6.287,30 3.89,31 4.581,32 4.682,33 4.454,34 3.912,35 6.259,36 3.882,37 4.609,38 4.704,39 4.615,40 3.937,41 6.317,42 3.891,43 4.631,44 4.764,45 4.375,46 3.917,47 6.261,48 3.83,49 4.587,50 4.748,51 4.274,52 3.781,53 6.103,54 3.732,55 4.493,56 4.61,57 4.276,58 3.669,59 6.299,60 3.699,61 0.552,62 0.729,63 2.712,64 4.653,65 61.18,66 2.571,67 1.122,68 1.073,69 22.151,70 7.96,71 115.325,72 5.005,73 1.395,74 1.222,75 15.492,76 8.803,77 164.848,78 4.802,79 1.327,80 1.208,81 17.643,82 9.492,83 171.491,84 5.372,85 1.361,86 1.126,87 21.541,88 9.759,89 195.767,90 5.504,91 1.427,92 1.129,93 22.378,94 10.703,95 194.419,96 7.093,97 1.422,98 1.089,99 25.186,100 9.577,101 157.261,102 7.264,103 1.29,104 0.904,105 18.17,106 7.976,107 179.573,108 5.271,110 115,111 49,112 0.411,113 0.814,114 0.878,115 0.896,116 0.896,117 4.713}
{0 CHEMBL1795565,1 1.201,2 0.909,3 1.114,4 -0.068,5 0.015,6 2.13,7 11.038,8 1.905,9 3.631,10 92.717,11 10.188,12 0.407,13 3.785,14 3.858,15 3.788,16 3.409,17 5.131,18 3.359,19 4.254,20 4.349,21 4.031,22 3.705,23 5.803,24 3.657,25 4.443,26 4.573,27 4.041,28 3.715,29 5.953,30 3.674,31 4.399,32 4.515,33 4.156,34 3.675,35 6.075,36 3.653,37 4.436,38 4.553,39 4.067,40 3.658,41 6.1,42 3.629,43 4.484,44 4.64,45 3.965,46 3.681,47 6.075,48 3.56,49 4.377,50 4.565,51 3.921,52 3.585,53 5.814,54 3.463,55 4.248,56 4.432,57 3.635,58 3.357,59 5.867,60 3.332,61 0.35,62 0.638,63 6.169,64 4.533,65 39.688,66 3.115,67 0.742,68 0.952,69 14.596,70 7.206,71 81.642,72 5.413,73 0.923,74 1.109,75 17.967,76 7.896,77 111.105,78 5.623,79 0.97,80 1.068,81 17.015,82 7.775,83 130.951,84 4.976,85 1.016,86 1.017,87 16.2,88 7.738,89 155.021,90 5.062,91 1.161,92 1.03,93 26.204,94 9.584,95 165.801,96 6.704,97 0.916,98 0.968,99 21.048,100 8.521,101 102.258,102 7.827,103 0.789,104 0.767,105 23.547,106 7.899,107 132.266,108 6.453,110 42,111 37,112 0.376,113 0.759,114 0.851,115 0.904,116 0.904,117 4.301}
{0 CHEMBL1795566,1 1.201,2 0.909,3 1.114,4 -0.068,5 0.015,6 2.13,7 11.038,8 1.905,9 3.631,10 92.717,11 10.188,12 0.407,13 3.785,14 3.858,15 3.788,16 3.409,17 5.131,18 3.359,19 4.254,20 4.349,21 4.031,22 3.705,23 5.803,24 3.657,25 4.443,26 4.573,27 4.041,28 3.715,29 5.953,30 3.674,31 4.399,32 4.515,33 4.156,34 3.675,35 6.075,36 3.653,37 4.436,38 4.553,39 4.067,40 3.658,41 6.1,42 3.629,43 4.484,44 4.64,45 3.965,46 3.681,47 6.075,48 3.56,49 4.377,50 4.565,51 3.921,52 3.585,53 5.814,54 3.463,55 4.248,56 4.432,57 3.635,58 3.357,59 5.867,60 3.332,61 0.35,62 0.638,63 6.169,64 4.533,65 39.688,66 3.115,67 0.742,68 0.952,69 14.596,70 7.206,71 81.642,72 5.413,73 0.923,74 1.109,75 17.967,76 7.896,77 111.105,78 5.623,79 0.97,80 1.068,81 17.015,82 7.775,83 130.951,84 4.976,85 1.016,86 1.017,87 16.2,88 7.738,89 155.021,90 5.062,91 1.161,92 1.03,93 26.204,94 9.584,95 165.801,96 6.704,97 0.916,98 0.968,99 21.048,100 8.521,101 102.258,102 7.827,103 0.789,104 0.767,105 23.547,106 7.899,107 132.266,108 6.453,110 42,111 37,112 0.376,113 0.759,114 0.851,115 0.904,116 0.904,117 4.903}
{0 CHEMBL1795567,1 1.201,2 0.909,3 1.114,4 -0.068,5 0.015,6 2.13,7 11.038,8 1.905,9 3.631,10 92.717,11 10.188,12 0.407,13 3.785,14 3.858,15 3.788,16 3.409,17 5.131,18 3.359,19 4.254,20 4.349,21 4.031,22 3.705,23 5.803,24 3.657,25 4.443,26 4.573,27 4.041,28 3.715,29 5.953,30 3.674,31 4.399,32 4.515,33 4.156,34 3.675,35 6.075,36 3.653,37 4.436,38 4.553,39 4.067,40 3.658,41 6.1,42 3.629,43 4.484,44 4.64,45 3.965,46 3.681,47 6.075,48 3.56,49 4.377,50 4.565,51 3.921,52 3.585,53 5.814,54 3.463,55 4.248,56 4.432,57 3.635,58 3.357,59 5.867,60 3.332,61 0.35,62 0.638,63 6.169,64 4.533,65 39.688,66 3.115,67 0.742,68 0.952,69 14.596,70 7.206,71 81.642,72 5.413,73 0.923,74 1.109,75 17.967,76 7.896,77 111.105,78 5.623,79 0.97,80 1.068,81 17.015,82 7.775,83 130.951,84 4.976,85 1.016,86 1.017,87 16.2,88 7.738,89 155.021,90 5.062,91 1.161,92 1.03,93 26.204,94 9.584,95 165.801,96 6.704,97 0.916,98 0.968,99 21.048,100 8.521,101 102.258,102 7.827,103 0.789,104 0.767,105 23.547,106 7.899,107 132.266,108 6.453,110 42,111 37,112 0.376,113 0.759,114 0.851,115 0.904,116 0.904,117 4.658}
{0 CHEMBL1795568,1 1.287,2 1.007,3 1.184,4 -0.154,5 -0.112,6 2.178,7 10.92,8 1.7,9 2.888,10 87.82,11 10.648,12 0.423,13 3.717,14 3.784,15 3.754,16 3.361,17 5.134,18 3.312,19 4.157,20 4.232,21 4.006,22 3.671,23 5.765,24 3.622,25 4.403,26 4.526,27 4.019,28 3.682,29 5.947,30 3.64,31 4.362,32 4.479,33 4.123,34 3.613,35 6.131,36 3.593,37 4.363,38 4.484,39 3.956,40 3.532,41 6.09,42 3.509,43 4.323,44 4.485,45 3.876,46 3.5,47 5.99,48 3.39,49 4.182,50 4.352,51 3.849,52 3.386,53 5.855,54 3.314,55 4.035,56 4.158,57 3.512,58 3.168,59 5.795,60 3.204,61 0.38,62 0.601,63 5.113,64 4.205,65 50.531,66 2.49,67 0.662,68 0.904,69 10.818,70 6.541,71 82.627,72 4.563,73 0.952,74 1.065,75 16.231,76 7.851,77 128.096,78 5.359,79 1.008,80 1.028,81 15.481,82 7.615,83 157.961,84 4.43,85 1.066,86 0.93,87 15.881,88 7.373,89 180.816,90 4.135,91 1.077,92 0.869,93 20.212,94 8.174,95 176.723,96 5.684,97 0.881,98 0.817,99 19.012,100 7.274,101 129.257,102 5.821,103 0.716,104 0.635,105 13.061,106 5.283,107 132.201,108 3.415,110 41,111 36,112 0.391,113 0.773,114 0.86,115 0.918,116 0.918,117 4.569}
{0 CHEMBL1795569,1 1.322,2 0.955,3 1.169,4 -0.122,5 0.01,6 2.105,7 6.647,8 -0.351,9 0.123,10 62.503,11 9.938,12 0.294,13 3.451,14 3.531,15 3.495,16 3.038,17 4.725,18 2.946,19 3.911,20 4.017,21 3.65,22 3.293,23 5.612,24 3.21,25 4.048,26 4.195,27 3.486,28 3.194,29 5.53,30 3.132,31 3.936,32 4.075,33 3.655,34 3.131,35 5.394,36 3.128,37 3.953,38 4.061,39 3.608,40 3.17,41 5.748,42 3.142,43 3.993,44 4.137,45 3.447,46 3.241,47 5.399,48 3.048,49 3.892,50 4.083,51 3.433,52 3.097,53 5.302,54 2.875,55 3.728,56 3.966,57 2.732,58 2.654,59 5.128,60 2.501,61 0.313,62 0.417,63 6.289,64 3.619,65 38.481,66 2.554,67 0.635,68 0.594,69 14.646,70 5.514,71 89.934,72 4.326,73 0.697,74 0.594,75 15.077,76 4.915,77 94.267,78 4.166,79 0.576,80 0.544,81 12.27,82 4.172,83 73.189,84 3.591,85 0.635,86 0.551,87 9.844,88 4.252,89 99.246,90 3.681,91 0.661,92 0.561,93 19.666,94 6.462,95 78.802,96 4.441,97 0.569,98 0.475,99 14.748,100 5.798,101 54.752,102 5.379,103 0.526,104 0.329,105 21.006,106 5.53,107 63.83,108 4.491,110 37,111 23,112 0.416,113 0.791,114 0.859,115 0.873,116 0.873,117 4.301}
{0 CHEMBL1795570,1 1.322,2 0.955,3 1.169,4 -0.122,5 0.01,6 2.105,7 6.647,8 -0.351,9 0.123,10 62.503,11 9.938,12 0.294,13 3.451,14 3.531,15 3.495,16 3.038,17 4.725,18 2.946,19 3.911,20 4.017,21 3.65,22 3.293,23 5.612,24 3.21,25 4.048,26 4.195,27 3.486,28 3.194,29 5.53,30 3.132,31 3.936,32 4.075,33 3.655,34 3.131,35 5.394,36 3.128,37 3.953,38 4.061,39 3.608,40 3.17,41 5.748,42 3.142,43 3.993,44 4.137,45 3.447,46 3.241,47 5.399,48 3.048,49 3.892,50 4.083,51 3.433,52 3.097,53 5.302,54 2.875,55 3.728,56 3.966,57 2.732,58 2.654,59 5.128,60 2.501,61 0.313,62 0.417,63 6.289,64 3.619,65 38.481,66 2.554,67 0.635,68 0.594,69 14.646,70 5.514,71 89.934,72 4.326,73 0.697,74 0.594,75 15.077,76 4.915,77 94.267,78 4.166,79 0.576,80 0.544,81 12.27,82 4.172,83 73.189,84 3.591,85 0.635,86 0.551,87 9.844,88 4.252,89 99.246,90 3.681,91 0.661,92 0.561,93 19.666,94 6.462,95 78.802,96 4.441,97 0.569,98 0.475,99 14.748,100 5.798,101 54.752,102 5.379,103 0.526,104 0.329,105 21.006,106 5.53,107 63.83,108 4.491,110 37,111 23,112 0.416,113 0.791,114 0.859,115 0.873,116 0.873,117 4.301}
{0 CHEMBL1795571,1 1.206,2 1.024,3 1.128,4 -0.122,5 -0.097,6 1.964,7 15.088,8 2.568,9 6.595,10 125.211,11 9.155,12 0.472,13 4.112,14 4.203,15 3.995,16 3.717,17 5.356,18 3.667,19 4.609,20 4.732,21 4.245,22 4.04,23 5.998,24 3.98,25 4.861,26 5.042,27 4.246,28 4.079,29 6.169,30 4.007,31 4.811,32 4.987,33 4.312,34 4.014,35 6.257,36 3.952,37 4.784,38 4.948,39 4.248,40 3.984,41 6.253,42 3.927,43 4.816,44 4.994,45 4.235,46 4.013,47 6.251,48 3.903,49 4.767,50 4.954,51 4.243,52 3.994,53 6.102,54 3.89,55 4.723,56 4.905,57 4.097,58 3.933,59 6.148,60 3.866,61 0.302,62 0.873,63 10.691,64 5.986,65 34.208,66 5.281,67 0.714,68 1.344,69 21.084,70 9.526,71 72.614,72 8.895,73 1,74 1.598,75 31.388,76 11.727,77 107.783,78 11.337,79 1.12,80 1.517,81 31.068,82 11.219,83 127.311,84 10.301,85 1.023,86 1.413,87 28.076,88 10.85,89 149.012,90 9.959,91 1.2,92 1.43,93 35.546,94 12.505,95 164.261,96 11.139,97 1.023,98 1.447,99 32.682,100 11.651,101 106.014,102 11.182,103 0.849,104 1.328,105 32.304,106 11.207,107 130.525,108 10.498,110 27,111 48,112 0.32,113 0.681,114 0.829,115 0.894,116 0.894,117 4.301}