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0.81,112 3.341,113 0.988,114 -4.92,115 -4.83,116 -4.53,119 48.8,124 1,141 10,142 3,143 2,144 2,145 1,151 1,160 1,171 10,175 4,178 1,180 2,183 9,187 8,192 5,195 5,200 8,205 4,208 6,213 1,216 1,218 2,221 14,224 1,225 1,233 18,237 1,238 3,241 1,246 12,250 4,258 4,262 4,273 1123,274 18.361,275 18.361,276 18.361,277 18.361,278 18.361,279 15.561,280 4.368,281 10.837,282 18.876,283 14.814,284 14.814,285 14.814,286 14.814,287 14.814,288 10.659,289 2.498,290 5.164,291 15.642,292 3.744,293 2.087,294 1.302,295 0.762,296 0.669,297 0.669,298 4.038,302 1,303 1,304 1,305 587,306 2.646,309 74.848,310 265.59,317 1.451,318 27.251,320 1,321 1,322 1,323 1,324 0.6,326 1,327 1,328 0.8,329 58,330 271,331 4.568,332 4.698,333 6.747,334 4.172,335 3.204,336 4.301,337 2.95,338 11.08,339 3.103,340 4.196,341 3.207,342 6.1,343 3.769,344 2.819,345 3.802,347 8.88,348 2.706,349 3.986,350 2.897,351 5.879,352 3.558,353 2.592,354 3.578,356 8.043,357 2.526,358 3.913,359 2.729,360 5.772,361 3.479,362 2.553,363 3.377,365 7.837,366 2.294,367 3.621,368 2.51,369 5.054,370 3.176,371 2.229,372 3.038,374 6.071,375 2.091,376 3.253,377 2.432,378 4.69,379 2.752,380 1.805,381 2.55,383 4.948,384 1.696,385 2.997,386 1.854,387 4.272,388 2.455,389 1.527,390 2.177,392 3.75,393 1.403,394 2.727,395 1.488,396 3.913,397 2.169,398 1.23,399 1.772,401 3.032,402 1.139,403 2.5,404 1.172,405 3.711,406 2,407 1,408 1.5,410 2.575,411 1,412 2.5,413 1,414 3.456,415 2,416 1,417 1.5,419 2.275,420 1,421 2.5,422 1,423 3.414,424 1.984,425 1,426 1.5,428 2.275,429 0.983,430 2.44,431 1,432 3.414,433 1.892,434 0.945,435 1.382,436 2.192,437 0.886,438 2.277,439 0.826,440 3.247,441 1.716,442 0.792,443 1.169,444 2.136,445 0.73,446 1.137,447 0.62,448 2.605,449 0.725,450 -0.188,451 -0.236,453 -0.422,454 -0.166,455 0.965,456 0.301,457 2.512,458 0.504,459 -0.453,460 -0.594,462 -1.096,463 -0.422,464 13.152,465 0.487,466 0.644,467 0.024,468 40.5,469 1.5,470 23.5,471 0.87,472 17,473 0.63,474 17.941,475 0.664,476 27.048,477 0.629,478 29.792,479 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{0 CHEMBL196700,1 1.744,2 11.529,3 3.351,4 11.226,5 126.054,6 8.044,7 0.553,8 4.222,9 4.327,10 3.979,11 3.737,12 5.294,13 3.721,14 4.792,15 4.965,16 4.338,17 4.14,18 6.013,19 4.117,20 5.001,21 5.172,22 4.441,23 4.322,24 6.153,25 4.269,26 5.139,27 5.337,28 4.391,29 4.325,30 6.32,31 4.264,32 5.045,33 5.246,34 4.364,35 4.257,36 6.206,37 4.21,38 5.011,39 5.191,40 4.371,41 4.25,42 6.323,43 4.197,44 5.004,45 5.195,46 4.316,47 4.21,48 6.132,49 4.158,50 4.983,51 5.149,52 4.285,53 4.168,54 6.302,55 4.126,56 0.141,57 0.969,58 14.336,59 5.516,60 19.854,61 6.623,62 0.637,63 1.557,64 25.794,65 8.871,66 59.808,67 11.253,68 0.565,69 1.866,70 37.301,71 12.621,72 53.173,73 14.89,74 0.95,75 1.919,76 44.341,77 13.591,78 107.667,79 16.742,80 0.717,81 1.78,82 36.856,83 11.761,84 82.318,85 15.401,86 1.046,87 1.767,88 35.427,89 11.612,90 102.454,91 14.573,92 0.649,93 1.7,94 36.62,95 11.713,96 76.739,97 14.535,98 1.054,99 1.661,100 36.371,101 10.591,102 123.866,103 12.381,104 39,105 57,106 0.279,107 0.612,108 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