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{1 6.226,2 38.763,3 10.34,4 1.991,5 4.304,6 3.255,7 3.026,8 8.169,9 8.962,10 10.238,11 11.219,12 12.407,13 13.475,14 14.632,15 15.743,16 16.892,17 18.025,18 5.399,19 5.255,20 4.304,21 3.255,22 5.586,23 3.853,24 1.053,25 -0.123,26 5.853,27 3.853,28 -0.023,29 -0.48,30 -0.036,31 27.44,32 1.065,33 2.118,34 1.115,35 4.685,36 57.782,37 0.773,38 0.73,39 1.004,40 -0.087,41 0.057,42 -0.114,43 -0.074,44 -0.018,45 20.818,46 2.877,47 1.035,48 1.284,49 12.235,50 130.906,51 7.974,52 0.615,53 4.143,54 4.221,55 3.781,56 3.804,57 5.294,58 3.784,59 4.65,60 4.75,61 4.173,62 4.217,63 5.791,64 4.182,65 4.963,66 5.117,67 4.302,68 4.379,69 6.016,70 4.329,71 5.048,72 5.201,73 4.297,74 4.378,75 6.238,76 4.323,77 5.084,78 5.261,79 4.25,80 4.379,81 6.191,82 4.314,83 5.037,84 5.218,85 4.229,86 4.326,87 6.208,88 4.258,89 4.924,90 5.104,91 4.115,92 4.252,93 6.035,94 4.181,95 4.882,96 5.069,97 3.98,98 4.17,99 5.96,100 4.086,101 0.021,102 0.61,103 9.555,104 5.161,105 5.999,106 0.132,107 1.037,108 17.074,109 8.786,110 22.388,111 10.404,112 0.136,113 1.483,114 27.216,115 12.639,116 33.448,117 15.293,118 0.477,119 1.609,120 31.031,121 13.539,122 78.889,123 15.67,124 0.372,125 1.702,126 33.934,127 14.398,128 73.15,129 16.821,130 0.587,131 1.629,132 32.668,133 13.841,134 79.83,135 16.828,136 0.226,137 1.455,138 28.225,139 12.413,140 52.761,141 15.045,142 0.299,143 1.402,144 27.923,145 11.923,146 57.192,147 14.234,148 5,149 56,150 0.206,151 0.486,152 0.613,153 0.775,154 0.867,155 0.881,156 3.561,157 0.873,158 -6.25,159 -6.09,160 -5.66,161 53.6,163 1,164 1,167 1,172 1,173 1,174 17,175 5,176 2,179 1,180 24,181 1,182 8,183 2,184 30,186 9,188 2,189 27,191 11,192 2,193 4,194 27,196 5,198 2,199 27,200 2,201 9,202 1,203 3,204 26,205 9,206 3,207 23,208 8,209 2,210 23,211 4,212 1,213 24,214 2072,215 23.637,216 23.637,217 23.637,218 23.637,219 23.637,220 20.406,221 19.828,222 13.91,223 23.862,224 19.286,225 19.286,226 19.286,227 19.286,228 19.286,229 14.509,230 6.611,231 19.684,232 4.523,233 2.781,234 0.978,235 0.406,236 0.321,237 4.285,239 1,240 941,241 2.449,243 513.726,246 270.638,249 1.779,250 33.328,251 0.75,252 0.67,253 0.83,254 0.5,255 0.5,256 0.83,257 1,258 0.73,259 72,260 416,261 4.628,262 7.013,263 3.325,264 4.187,265 1.674,266 11.946,267 4.323,268 3.457,269 6.506,270 3.989,271 3.024,272 3.916,273 1.151,274 10.179,275 2.926,276 4.237,277 3.054,278 6.18,279 3.866,280 2.87,281 3.853,282 0.68,283 9.157,284 2.85,285 3.926,286 2.987,287 6.068,288 3.618,289 2.633,290 3.381,292 8.773,293 2.59,294 3.868,295 2.814,296 5.952,297 3.455,298 2.468,299 3.331,301 8.231,302 2.43,303 3.366,304 2.642,305 5.181,306 2.98,307 2.037,308 2.682,309 6.015,310 1.914,311 3.348,312 2.219,313 5.057,314 2.91,315 1.918,316 2.511,317 5.524,318 1.885,319 3.109,320 1.977,321 4.628,322 2.789,323 1.816,324 2.273,325 4.943,326 1.76,327 2.949,328 1.697,329 4.335,330 2.534,331 1.567,332 2.111,333 4.064,334 1.504,335 2.869,336 1.591,337 3.951,338 2.4,339 1.411,340 2.022,341 3.065,342 1.39,343 2.75,344 1.408,345 3.778,346 2.336,347 1.345,348 1.841,349 2.992,350 1.331,351 2.609,352 1.331,353 3.629,354 1.116,355 1.61,356 2.804,357 2.5,358 1.108,359 3.582,360 2.035,361 1.043,362 1.5,363 2.621,364 1.029,365 2.5,366 1.033,367 3.488,368 2,369 1,370 1.5,371 2.275,372 1,373 2.491,374 1,375 3.414,376 2,377 1,378 1.472,379 2.207,380 1,381 16.333,382 0.48,383 7.398}
{0 CHEMBL297521,1 8.281,2 68.573,3 13.857,4 2.169,5 5.127,6 3.985,7 2.873,8 8.704,9 9.871,10 11.237,11 12.541,12 13.904,13 15.256,14 16.627,15 17.997,16 19.373,17 20.751,18 6.185,19 5.985,20 5.127,21 3.985,22 6.189,23 4.697,24 0.928,25 0.054,26 6.697,27 4.697,28 -0.042,29 -0.486,30 -0.013,31 17.109,32 0.986,33 2.013,34 1.01,35 4.67,36 54.897,37 0.718,38 0.706,39 0.787,40 -0.067,41 0.032,42 -0.005,43 -0.085,44 0.124,45 22.209,46 3.152,47 1.139,48 1.208,49 16.543,50 142.895,51 5.96,52 0.162,53 4.422,54 4.552,55 3.774,56 3.962,57 5.339,58 3.884,59 5.024,60 5.23,61 4.127,62 4.377,63 5.845,64 4.266,65 5.38,66 5.61,67 4.316,68 4.574,69 6.334,70 4.445,71 5.514,72 5.788,73 4.26,74 4.587,75 6.448,76 4.431,77 5.494,78 5.761,79 4.152,80 4.534,81 6.492,82 4.369,83 5.427,84 5.718,85 3.997,86 4.489,87 6.174,88 4.296,89 5.363,90 5.631,91 3.869,92 4.466,93 6.148,94 4.253,95 5.44,96 5.77,97 3.76,98 4.389,99 6.09,100 4.148,101 0.084,102 1.043,103 19.913,104 9.044,105 12.265,106 0.183,107 1.728,108 35.325,109 15.039,110 26.978,111 20.842,112 0.681,113 2.266,114 50.744,115 19.608,116 80.267,117 27.453,118 0.566,119 2.44,120 56.414,121 21.164,122 103.402,123 30.053,124 0.801,125 2.335,126 55.892,127 20.155,128 148.746,129 28.536,130 0.464,131 2.227,132 50.695,133 19.483,134 66.727,135 27.845,136 0.378,137 2.165,138 47.841,139 18.994,140 62.141,141 27.06,142 0.449,143 2.15,144 49.885,145 18.982,146 66.033,147 27.626,148 97,149 54,150 0.187,151 0.444,152 0.644,153 0.742,154 0.806,155 0.834,156 3.588,157 1.116,158 -5.95,159 -5.8,160 -5.4,161 38.3,162 6,163 9,164 3,167 1,169 2,171 1,172 1,174 4,175 2,178 2,180 24,182 3,183 1,184 27,185 2,186 8,187 1,188 1,189 22,191 9,192 1,193 4,194 21,195 1,196 8,197 1,198 3,199 22,201 4,203 3,204 27,205 4,206 2,207 21,208 3,209 2,210 20,211 4,212 1,213 18,214 2498,215 22.622,216 22.622,217 22.622,218 22.622,219 22.622,220 21.479,221 14.859,222 13.204,223 22.697,224 18.149,225 18.149,226 18.149,227 18.149,228 18.149,229 16.305,230 6.206,231 18.3,232 5.132,233 3.467,234 1.537,235 1.121,236 0.939,237 4.255,239 1,240 1215,241 5.745,242 54.431,243 220.311,244 120.124,246 186.29,247 200.445,249 2.465,250 41.626,251 0.75,252 0.5,253 0.83,254 1,255 1,256 0.83,257 0.5,258 0.77,259 74,260 579,261 5.222,262 9.013,263 4.171,264 4.423,265 1.682,266 19.215,267 4.213,268 3.637,269 6.881,270 3.873,271 2.874,272 3.7,273 1.413,274 10.398,275 2.863,276 3.91,277 3.271,278 6.564,279 3.673,280 2.67,281 3.136,282 0.765,283 9.947,284 2.674,285 3.726,286 2.881,287 5.498,288 3.452,289 2.451,290 2.964,291 0.68,292 6.611,293 2.453,294 3.437,295 2.449,296 5.084,297 3.381,298 2.379,299 2.437,300 0.591,301 6.2,302 2.382,303 3.322,304 2.394,305 5.006,306 3.289,307 2.288,308 2.323,309 5.973,310 2.288,311 3.173,312 2.303,313 4.929,314 3.171,315 2.171,316 2.22,317 5.134,318 2.171,319 3.034,320 2.255,321 4.641,322 2.729,323 1.751,324 2.173,325 5.046,326 1.701,327 2.86,328 2.171,329 4.574,330 2.527,331 1.52,332 1.906,333 3.409,334 1.525,335 2.526,336 1.472,337 4.323,338 2.299,339 1.3,340 1.497,341 3.119,342 1.298,343 2.367,344 1.35,345 4,346 2.128,347 1.136,348 1.299,349 2.716,350 1.124,351 2.31,352 1.305,353 3.59,354 1.016,355 1.101,356 2.184,357 2.094,358 1.259,359 3.53,360 1.802,361 0.797,362 1.059,363 1.924,364 0.798,365 1.837,366 1.075,367 3.384,368 1.788,369 0.725,370 0.814,371 1.658,372 0.762,373 1.646,374 0.822,375 3.229,376 1.417,377 0.424,378 0.492,379 1.132,380 0.413,381 16.833,382 0.481,383 4.485}
{0 CHEMBL299632,1 9.113,2 83.043,3 11.792,4 2.272,5 5.086,6 3.951,7 2.702,8 8.652,9 9.807,10 11.168,11 12.461,12 13.817,13 15.16,14 16.522,15 17.884,16 19.251,17 20.62,18 6.141,19 5.951,20 5.086,21 3.951,22 6.151,23 4.663,24 0.947,25 0.032,26 6.663,27 4.663,28 -0.053,29 -0.904,30 0.017,31 13.937,32 0.981,33 1.882,34 0.877,35 4.639,36 53.368,37 0.638,38 0.605,39 0.786,40 -0.039,41 0.024,42 -0.006,43 -0.084,44 0.125,45 21.776,46 3.149,47 1.132,48 1.167,49 16.559,50 141.688,51 5.835,52 0.167,53 4.402,54 4.537,55 3.742,56 3.958,57 5.281,58 3.871,59 5.01,60 5.223,61 4.083,62 4.37,63 5.782,64 4.248,65 5.358,66 5.596,67 4.237,68 4.562,69 6.246,70 4.417,71 5.484,72 5.768,73 4.135,74 4.568,75 6.303,76 4.387,77 5.45,78 5.738,79 4.04,80 4.506,81 6.3,82 4.316,83 5.366,84 5.661,85 3.911,86 4.457,87 6.037,88 4.251,89 5.326,90 5.602,91 3.8,92 4.445,93 6.049,94 4.219,95 5.409,96 5.744,97 3.69,98 4.37,99 6.01,100 4.116,101 0.08,102 1.03,103 19.703,104 8.997,105 12.333,106 0.176,107 1.716,108 34.745,109 15.011,110 21.267,111 20.919,112 0.561,113 2.243,114 49.034,115 19.511,116 67.162,117 27.367,118 0.412,119 2.407,120 53.498,121 21.02,122 71.149,123 29.831,124 0.548,125 2.288,126 51.698,127 19.976,128 100.469,129 28.387,130 0.36,131 2.149,132 46.779,133 18.91,134 47.299,135 26.959,136 0.304,137 2.124,138 45.29,139 18.73,140 47.751,141 26.672,142 0.372,143 2.121,144 47.239,145 18.766,146 52.174,147 27.125,148 80,149 52,150 0.181,151 0.418,152 0.627,153 0.734,154 0.799,155 0.828,156 3.559,157 1.137,158 -6.76,159 -6.57,160 -6.09,161 38.8,162 6,163 10,164 3,169 2,171 1,172 1,174 4,175 2,178 2,180 25,182 4,184 28,185 2,186 9,189 26,191 10,194 24,195 1,196 8,199 25,201 4,204 29,205 4,207 23,208 3,210 21,211 4,213 19,214 2326,215 22.097,216 22.097,217 22.097,218 22.097,219 22.097,220 20.902,221 12.669,222 12.971,223 22.146,224 17.666,225 17.666,226 17.666,227 17.666,228 17.666,229 15.814,230 6.116,231 17.76,232 5.155,233 3.62,234 1.581,235 1.16,236 0.975,237 4.228,239 1,240 1184,241 5.568,242 52.909,243 214.137,244 117.032,246 181.036,247 194.941,249 2.519,250 32.435,251 0.75,252 0.5,253 0.67,254 0.9,255 1,256 0.67,257 0.5,258 0.71,259 71,260 563,261 5.184,262 8.891,263 4.129,264 4.4,265 1.682,266 18.627,267 4.191,268 3.614,269 6.723,270 3.846,271 2.848,272 3.669,273 1.413,274 10.137,275 2.834,276 3.85,277 3.233,278 6.562,279 3.606,280 2.586,281 3.079,282 0.68,283 9.736,284 2.631,285 3.714,286 2.795,287 5.099,288 3.451,289 2.451,290 2.95,291 0.591,292 6.246,293 2.452,294 3.436,295 2.435,296 5.049,297 3.372,298 2.371,299 2.437,301 6.099,302 2.373,303 3.32,304 2.318,305 4.978,306 3.273,307 2.272,308 2.321,309 5.919,310 2.273,311 3.172,312 2.266,313 4.776,314 3.17,315 2.17,316 2.208,317 5.134,318 2.17,319 3.016,320 2.172,321 4.641,322 2.544,323 1.532,324 2.172,325 4.254,326 1.546,327 2.672,328 1.899,329 4.573,330 2.398,331 1.406,332 1.724,333 3.388,334 1.392,335 2.397,336 1.351,337 4,338 2.292,339 1.296,340 1.35,341 2.804,342 1.29,343 2.356,344 1.35,345 3.797,346 2.089,347 1.088,348 1.171,349 2.363,350 1.088,351 2.201,352 1.261,353 3.59,354 0.868,355 1.1,356 1.992,357 2.068,358 1.181,359 3.512,360 1.8,361 0.753,362 0.964,363 1.888,364 0.778,365 1.837,366 0.98,367 3.294,368 1.75,369 0.716,370 0.806,371 1.632,372 0.737,373 1.405,374 0.792,375 3.136,376 1.287,377 0.297,378 0.321,379 0.732,380 0.291,381 16.5,382 0.485,383 4.745}
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