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{0 CHEMBL446309,1 4.196,2 4.087,3 3.875,4 1.205,5 1.103,6 12.052,7 13.463,8 -1.421,9 1.465,10 0.82,11 0.05,12 11.882,13 12.89,14 14.323,15 15.417,16 16.803,17 17.953,18 19.308,19 20.496,20 2.921,21 18,22 -0.187,23 168.488,24 3.972,25 2.984,26 10.007,27 2.947,28 6.459,29 3.156,30 3.031,31 5.182,32 8.554,33 11.603,34 11.557,35 7.378,36 13.688,37 7.238,38 13.407,39 8.766,40 16.376,41 8.584,42 15.29,43 9.76,44 18.76,45 9.535,46 17.197,47 11.019,48 21.354,49 10.754,50 19.123,51 12.148,52 23.853,53 11.836,54 21.063,55 13.374,56 26.426,57 13.019,58 2.984,59 23.015,60 14.56,61 28.971,62 14.158,63 10.007,64 24.976,65 15.782,66 31.543,67 15.336,68 26.945,69 16.994,70 34.109,71 16.501,72 28.92,73 18.221,74 36.687,75 17.681,76 30.901,77 3.156,78 19.446,79 39.264,80 18.859,81 1.049,82 0.288,83 5.701,84 0.35,85 2.276,86 278.071,87 7.269,88 10.659,89 9.509,90 22.076,91 3.589,92 3.553,93 7.839,94 10.37,95 282,96 16.364,97 17.043,98 2.703,99 3.5,100 6.63,101 7.944,102 9.286,103 0.833,104 1.03,105 1.128,106 5.49,107 5.642,108 0.846,109 235.124,110 202.904,111 235.124,112 235.124,113 1.541,114 14.755,115 4.086,116 16.697,117 190.325,118 6.824,119 0.235,120 4.67,121 4.804,122 4.154,123 4.179,124 5.727,125 4.121,126 5.248,127 5.443,128 4.569,129 4.602,130 6.252,131 4.513,132 5.584,133 5.786,134 4.683,135 4.803,136 6.685,137 4.692,138 5.803,139 6.066,140 4.794,141 4.818,142 6.877,143 4.734,144 5.749,145 5.962,146 4.864,147 4.834,148 7.085,149 4.781,150 5.801,151 6,152 4.888,153 4.953,154 7.036,155 4.873,156 5.939,157 6.17,158 4.939,159 5.088,160 7.012,161 4.978,162 6.033,163 6.267,164 4.946,165 5.15,166 7.153,167 5.016,168 6.981}
{0 CHEMBL446908,1 4.193,2 4.087,3 3.875,4 1.197,5 1.093,6 12.044,7 13.455,8 -1.419,9 1.475,10 0.83,11 0.044,12 11.874,13 12.882,14 14.317,15 15.411,16 16.798,17 17.948,18 19.304,19 20.493,20 2.898,21 15,22 -0.178,23 168.488,24 3.969,25 2.981,26 10.006,27 2.944,28 6.457,29 3.156,30 3.031,31 5.182,32 8.547,33 11.597,34 11.547,35 7.372,36 13.684,37 7.23,38 13.398,39 8.757,40 16.374,41 8.573,42 15.283,43 9.754,44 18.759,45 9.528,46 17.191,47 11.014,48 21.353,49 10.746,50 19.118,51 12.144,52 23.852,53 11.83,54 21.06,55 13.37,56 26.425,57 13.014,58 2.981,59 23.012,60 14.557,61 28.97,62 14.154,63 10.006,64 24.974,65 15.78,66 31.543,67 15.332,68 26.944,69 16.992,70 34.109,71 16.498,72 28.919,73 18.219,74 36.686,75 17.679,76 30.9,77 3.156,78 19.445,79 39.263,80 18.857,81 1.037,82 0.282,83 5.649,84 0.346,85 2.276,86 275.537,87 7.259,88 10.651,89 9.5,90 21.552,91 3.583,92 3.543,93 7.831,94 10.361,95 273,96 15.736,97 16.415,98 2.684,99 3.453,100 6.621,101 7.935,102 9.278,103 0.83,104 1.041,105 1.131,106 5.432,107 5.588,108 0.843,109 232.589,110 200.37,111 232.589,112 232.589,113 1.553,114 14.667,115 3.419,116 11.692,117 185.698,118 6.889,119 0.24,120 4.643,121 4.775,122 4.136,123 4.152,124 5.71,125 4.096,126 5.218,127 5.411,128 4.555,129 4.574,130 6.24,131 4.489,132 5.553,133 5.749,134 4.658,135 4.781,136 6.661,137 4.671,138 5.782,139 6.046,140 4.781,141 4.801,142 6.847,143 4.715,144 5.731,145 5.943,146 4.847,147 4.81,148 7.081,149 4.758,150 5.775,151 5.973,152 4.853,153 4.92,154 7.016,155 4.839,156 5.904,157 6.138,158 4.909,159 5.049,160 6.971,161 4.939,162 5.992,163 6.223,164 4.919,165 5.107,166 7.134,167 4.977,168 6.97}
{0 CHEMBL448822,1 4.411,2 4.156,3 4.087,4 1.17,5 1.073,6 12.198,7 13.623,8 -2.18,9 1.48,10 0.812,11 0.102,12 12.021,13 13.071,14 14.483,15 15.608,16 16.978,17 18.15,18 19.493,19 20.697,20 3.156,21 26,22 -0.257,23 186.139,24 4.353,25 3.351,26 12.097,27 3.299,28 6.524,29 3.445,30 3.039,31 5.308,32 8.774,33 11.792,34 11.726,35 7.576,36 13.925,37 7.465,38 13.597,39 8.948,40 16.596,41 8.803,42 15.499,43 9.981,44 18.992,45 9.811,46 17.421,47 11.238,48 21.573,49 11.036,50 19.359,51 12.384,52 24.067,53 12.154,54 21.309,55 13.609,56 26.627,57 13.35,58 3.351,59 23.268,60 14.802,61 29.162,62 14.512,63 12.097,64 25.234,65 16.023,66 31.722,67 15.702,68 27.206,69 17.236,70 34.276,71 16.883,72 29.183,73 18.46,74 36.842,75 18.075,76 31.163,77 3.445,78 19.683,79 39.407,80 19.266,81 1.06,82 0.296,83 5.744,84 0.353,85 2.278,86 295.722,87 7.35,88 10.788,89 9.62,90 24.42,91 3.595,92 3.57,93 7.985,94 10.536,95 309,96 17.864,97 18.543,98 2.85,99 3.529,100 6.71,101 8.039,102 9.398,103 0.826,104 1.104,105 1.126,106 5.55,107 5.69,108 0.837,109 252.774,110 220.555,111 252.774,112 252.774,113 1.505,114 15.519,115 5.422,116 29.396,117 204.001,118 6.65,119 0.222,120 4.748,121 4.884,122 4.208,123 4.257,124 5.786,125 4.193,126 5.333,127 5.534,128 4.635,129 4.69,130 6.306,131 4.597,132 5.677,133 5.877,134 4.768,135 4.908,136 6.764,137 4.792,138 5.937,139 6.207,140 4.85,141 4.922,142 6.992,143 4.824,144 5.853,145 6.082,146 4.91,147 4.917,148 7.139,149 4.851,150 5.868,151 6.069,152 4.971,153 5.037,154 7.083,155 4.956,156 6.026,157 6.251,158 5.027,159 5.186,160 7.113,161 5.079,162 6.139,163 6.375,164 5.026,165 5.263,166 7.234,167 5.124,168 7.095}
{0 CHEMBL449755,1 4.206,2 4.087,3 3.875,4 1.207,5 1.112,6 12.089,7 13.499,8 -1.433,9 1.468,10 0.82,11 0.048,12 11.909,13 12.922,14 14.348,15 15.445,16 16.826,17 17.977,18 19.328,19 20.516,20 3.069,21 25,22 -0.2,23 177.314,24 3.991,25 3.001,26 10.028,27 2.966,28 6.47,29 3.156,30 3.035,31 5.215,32 8.588,33 11.638,34 11.604,35 7.421,36 13.71,37 7.288,38 13.452,39 8.808,40 16.395,41 8.636,42 15.331,43 9.797,44 18.772,45 9.584,46 17.234,47 11.054,48 21.363,49 10.8,50 19.156,51 12.177,52 23.858,53 11.878,54 21.092,55 13.4,56 26.43,57 13.058,58 3.001,59 23.04,60 14.582,61 28.973,62 14.193,63 10.028,64 24.997,65 15.801,66 31.545,67 15.367,68 26.963,69 17.01,70 34.111,71 16.528,72 28.935,73 18.234,74 36.688,75 17.705,76 30.913,77 3.156,78 19.457,79 39.264,80 18.88,81 1.07,82 0.299,83 5.841,84 0.357,85 2.277,86 289.431,87 7.299,88 10.696,89 9.538,90 24.129,91 3.593,92 3.566,93 7.874,94 10.405,95 324,96 17.352,97 18.031,98 2.815,99 3.525,100 6.673,101 7.984,102 9.324,103 0.84,104 1.007,105 1.139,106 5.647,107 5.787,108 0.852,109 246.483,110 214.264,111 246.483,112 246.483,113 1.505,114 16.077,115 5.461,116 29.824,117 204.101,118 6.65,119 0.222,120 4.748,121 4.884,122 4.208,123 4.257,124 5.781,125 4.193,126 5.333,127 5.533,128 4.619,129 4.682,130 6.304,131 4.586,132 5.675,133 5.884,134 4.742,135 4.887,136 6.741,137 4.769,138 5.896,139 6.163,140 4.85,141 4.903,142 6.949,143 4.81,144 5.839,145 6.058,146 4.916,147 4.915,148 7.143,149 4.853,150 5.886,151 6.094,152 4.95,153 5.029,154 7.093,155 4.945,156 6.008,157 6.237,158 5.015,159 5.169,160 7.077,161 5.061,162 6.121,163 6.354,164 5.032,165 5.25,166 7.227,167 5.115,168 7.075}
{0 CHEMBL451848,1 4.197,2 4.087,3 3.875,4 1.207,5 1.112,6 12.078,7 13.485,8 -1.432,9 1.465,10 0.844,11 0.078,12 11.891,13 12.899,14 14.33,15 15.424,16 16.808,17 17.958,18 19.312,19 20.5,20 2.945,21 24,22 -0.186,23 177.314,24 3.975,25 2.986,26 10.007,27 2.95,28 6.46,29 3.156,30 3.035,31 5.215,32 8.574,33 11.622,34 11.587,35 7.409,36 13.696,37 7.273,38 13.431,39 8.796,40 16.383,41 8.62,42 15.309,43 9.78,44 18.763,45 9.562,46 17.212,47 11.038,48 21.356,49 10.779,50 19.134,51 12.161,52 23.854,53 11.855,54 21.072,55 13.385,56 26.426,57 13.036,58 2.986,59 23.022,60 14.568,61 28.971,62 14.171,63 10.007,64 24.981,65 15.789,66 31.544,67 15.347,68 26.949,69 16.999,70 34.109,71 16.509,72 28.923,73 18.225,74 36.687,75 17.688,76 30.903,77 3.156,78 19.449,79 39.264,80 18.865,81 1.068,82 0.298,83 5.841,84 0.356,85 2.277,86 289.431,87 7.294,88 10.688,89 9.524,90 23.576,91 3.592,92 3.563,93 7.858,94 10.383,95 322,96 17.169,97 17.848,98 2.758,99 3.521,100 6.673,101 7.982,102 9.32,103 0.84,104 1.007,105 1.143,106 5.573,107 5.787,108 0.852,109 246.483,110 214.264,111 246.483,112 246.483,113 1.505,114 16.096,115 5.25,116 27.567,117 204.075,118 6.65,119 0.222,120 4.748,121 4.884,122 4.208,123 4.257,124 5.781,125 4.193,126 5.333,127 5.533,128 4.619,129 4.682,130 6.305,131 4.586,132 5.675,133 5.884,134 4.731,135 4.891,136 6.733,137 4.769,138 5.899,139 6.169,140 4.851,141 4.904,142 6.94,143 4.808,144 5.842,145 6.065,146 4.908,147 4.897,148 7.155,149 4.839,150 5.856,151 6.056,152 4.932,153 5.01,154 7.072,155 4.928,156 5.997,157 6.228,158 5.018,159 5.161,160 7.058,161 5.053,162 6.113,163 6.341,164 5.034,165 5.243,166 7.239,167 5.114,168 7.055}
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