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A.ed.","SM05_AEA.ri.","SM05_EA","SM05_EA.bo.","SM05_EA.dm.","SM05_EA.ed.","SM05_EA.ri.","SM06_AEA.bo.","SM06_AEA.dm.","SM06_AEA.ed.","SM06_AEA.ri.","SM06_EA","SM06_EA.bo.","SM06_EA.dm.","SM06_EA.ed.","SM06_EA.ri.","SM07_AEA.bo.","SM07_AEA.dm.","SM07_AEA.ed.","SM07_AEA.ri.","SM07_EA","SM07_EA.bo.","SM07_EA.dm.","SM07_EA.ed.","SM07_EA.ri.","SM08_AEA.bo.","SM08_AEA.dm.","SM08_AEA.ed.","SM08_AEA.ri.","SM08_EA","SM08_EA.bo.","SM08_EA.dm.","SM08_EA.ed.","SM08_EA.ri.","SM09_AEA.bo.","SM09_AEA.dm.","SM09_AEA.ed.","SM09_AEA.ri.","SM09_EA","SM09_EA.bo.","SM09_EA.dm.","SM09_EA.ed.","SM09_EA.ri.","SM10_AEA.bo.","SM10_AEA.dm.","SM10_AEA.ed.","SM10_AEA.ri.","SM10_EA","SM10_EA.bo.","SM10_EA.dm.","SM10_EA.ed.","SM10_EA.ri.","SM11_AEA.bo.","SM11_AEA.dm.","SM11_AEA.ed.","SM11_AEA.ri.","SM11_EA","SM11_EA.bo.","SM11_EA.dm.","SM11_EA.ed.","SM11_EA.ri.","SM12_AEA.bo.","SM12_AEA.dm.","SM12_AEA.ed.","SM12_AEA.ri.","SM12_EA","SM12_EA.bo.","SM12_EA.dm.","SM12_EA.ed.","SM12_EA.ri.","SM13_AEA.bo.","SM13_AEA.dm.","SM13_AEA.ed.","SM13_AEA.ri.","SM13_EA","SM13_EA.bo.","SM13_EA.dm.","SM13_EA.ed.","SM13_EA.ri.","SM14_AEA.bo.","SM14_AEA.dm.","SM14_AEA.ed.","SM14_AEA.ri.","SM14_EA","SM14_EA.bo.","SM14_EA.dm.","SM14_EA.ed.","SM14_EA.ri.","SM15_AEA.bo.","SM15_AEA.dm.","SM15_AEA.ed.","SM15_AEA.ri.","SM15_EA","SM15_EA.bo.","SM15_EA.dm.","SM15_EA.ed.","SM15_EA.ri.","SMTI","SMTIV","SNar","Sp","SpAD_AEA.bo.","SpAD_AEA.dm.","SpAD_AEA.ed.","SpAD_AEA.ri.","SpAD_EA","SpAD_EA.bo.","SpAD_EA.dm.","SpAD_EA.ed.","SpAD_EA.ri.","SpDiam_AEA.bo.","SpDiam_AEA.dm.","SpDiam_AEA.ed.","SpDiam_AEA.ri.","SpDiam_EA","SpDiam_EA.bo.","SpDiam_EA.dm.","SpDiam_EA.ed.","SpDiam_EA.ri.","SPI","SpMAD_AEA.bo.","SpMAD_AEA.dm.","SpMAD_AEA.ed.","SpMAD_AEA.ri.","SpMAD_EA","SpMAD_EA.bo.","SpMAD_EA.dm.","SpMAD_EA.ed.","SpMAD_EA.ri.","SpMax1_Bh.e.","SpMax1_Bh.i.","SpMax1_Bh.m.","SpMax1_Bh.p.","SpMax1_Bh.s.","SpMax1_Bh.v.","SpMax2_Bh.e.","SpMax2_Bh.i.","SpMax2_Bh.m.","SpMax2_Bh.p.","SpMax2_Bh.s.","SpMax2_Bh.v.","SpMax3_Bh.e.","SpMax3_Bh.i.","SpMax3_Bh.m.","SpMax3_Bh.p.","SpMax3_Bh.s.","SpMax3_Bh.v.","SpMax4_Bh.e.","SpMax4_Bh.i.","SpMax4_Bh.m.","SpMax4_Bh.p.","SpMax4_Bh.s.","SpMax4_Bh.v.","SpMax5_Bh.e.","SpMax5_Bh.i.","SpMax5_Bh.m.","SpMax5_Bh.p.","SpMax5_Bh.s.","SpMax5_Bh.v.","SpMax6_Bh.e.","SpMax6_Bh.i.","SpMax6_Bh.m.","SpMax6_Bh.p.","SpMax6_Bh.s.","SpMax6_Bh.v.","SpMax7_Bh.e.","SpMax7_Bh.i.","SpMax7_Bh.m.","SpMax7_Bh.p.","SpMax7_Bh.s.","SpMax7_Bh.v.","SpMax8_Bh.e.","SpMax8_Bh.i.","SpMax8_Bh.m.","SpMax8_Bh.p.","SpMax8_Bh.s.","SpMax8_Bh.v.","SpMaxA_AEA.bo.","SpMaxA_AEA.dm.","SpMaxA_AEA.ed.","SpMaxA_AEA.ri.","SpMaxA_EA","SpMax_AEA.bo.","SpMaxA_EA.bo.","SpMax_AEA.dm.","SpMaxA_EA.dm.","SpMax_AEA.ed.","SpMaxA_EA.ed.","SpMax_AEA.ri.","SpMaxA_EA.ri.","SpMax_EA","SpMax_EA.bo.","SpMax_EA.dm.","SpMax_EA.ed.","SpMax_EA.ri.","SpMin1_Bh.e.","SpMin1_Bh.i.","SpMin1_Bh.m.","SpMin1_Bh.p.","SpMin1_Bh.s.","SpMin1_Bh.v.","SpMin2_Bh.e.","SpMin2_Bh.i.","SpMin2_Bh.m.","SpMin2_Bh.p.","SpMin2_Bh.s.","SpMin2_Bh.v.","SpMin3_Bh.e.","SpMin3_Bh.i.","SpMin3_Bh.m.","SpMin3_Bh.p.","SpMin3_Bh.s.","SpMin3_Bh.v.","SpMin4_Bh.e.","SpMin4_Bh.i.","SpMin4_Bh.m.","SpMin4_Bh.p.","SpMin4_Bh.s.","SpMin4_Bh.v.","SpMin5_Bh.e.","SpMin5_Bh.i.","SpMin5_Bh.m.","SpMin5_Bh.p.","SpMin5_Bh.s.","SpMin5_Bh.v.","SpMin6_Bh.e.","SpMin6_Bh.i.","SpMin6_Bh.m.","SpMin6_Bh.p.","SpMin6_Bh.s.","SpMin6_Bh.v.","SpMin7_Bh.e.","SpMin7_Bh.i.","SpMin7_Bh.m.","SpMin7_Bh.p.","SpMin7_Bh.s.","SpMin7_Bh.v.","SpMin8_Bh.e.","SpMin8_Bh.i.","SpMin8_Bh.m.","SpMin8_Bh.p.","SpMin8_Bh.s.","SpMin8_Bh.v.","SRW02","SRW03","SRW04","SRW05","SRW06","SRW07","SRW08","SRW09","SRW10","SsBr","SsCH3","SsCl","SsF","SsNH2","SsOH","SssCH2","SssNH","SssO","SssS","SsssCH","SsssN","SssssC","SssssSi","StN","StsC","Sv","TIC0","TIC1","TIC2","TIC3","TIC4","TIC5","TIE","TPC","TPSA.NO.","TPSA.Tot.","TRS","TWC","Uc","Ui","Uindex","UNIP","VAR","Vindex","VvdwMG","VvdwZAZ","Vx","Wap","X.","X0","X0A","X0Av","X0sol","X0v","X1","X1A","X1Av","X1Kup","X1Mad","X1MulPer","X1Per","X1sol","X1v","X2","X2A","X2Av","X2sol","X2v","X3","X3A","X3Av","X3sol","X3v","X4","X4A","X4Av","X4sol","X4v","X5","X5A","X5Av","X5sol","X5v","Xindex","XMOD","Xt","Xu","Yindex","ZM1","ZM1Kup","ZM1Mad","ZM1MulPer","ZM1Per","ZM1V","ZM2","ZM2Kup","ZM2Mad","ZM2MulPer","ZM2Per","ZM2V","pXC50"
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0.807,111 0.839,112 3.441,113 0.99,114 -5,115 -4.9,116 -4.59,118 39.3,119 4,120 2,121 2,124 1,125 2,135 6,136 4,137 2,146 1,155 1,158 1,159 15,160 1,162 3,164 1,165 4,167 21,171 5,173 1,176 1,178 20,179 1,183 6,186 1,187 2,188 2,191 19,197 4,200 1,202 2,203 1,205 22,209 2,210 1,212 1,213 1,214 4,217 22,220 1,223 1,225 7,228 15,237 7,240 7,241 2,244 2,249 9,252 7,253 4,256 1716,257 19.068,258 19.068,259 19.068,260 19.068,261 19.068,262 17.473,263 19.812,264 11.197,265 19.324,266 15.266,267 15.266,268 15.266,269 15.266,270 15.266,271 12.741,272 16.929,273 5.314,274 15.735,275 4.512,276 2.49,277 1.419,278 1.131,279 1,280 0.804,281 4.099,285 1,286 1,287 663,288 4.69,291 212.551,296 1.467,297 45.639,299 1,300 0.83,301 0.83,302 1,303 1,304 1,305 1,306 0.95,307 66.5,308 330,309 4.548,310 3.613,311 6.797,312 4.193,313 3.209,314 4.246,315 2.341,316 11.208,317 3.159,318 4.015,319 3.413,320 6.001,321 3.657,322 2.665,323 3.585,324 0.86,325 8.419,326 2.646,327 3.772,328 2.924,329 5.866,330 3.574,331 2.604,332 3.053,334 7.962,335 2.547,336 3.689,337 2.887,338 5.375,339 3.54,340 2.554,341 2.927,343 7.035,344 2.485,345 3.602,346 2.764,347 5.138,348 3.241,349 2.288,350 2.808,352 6.191,353 2.164,354 3.379,355 2.643,356 4.894,357 3.171,358 2.206,359 2.417,361 5.652,362 2.108,363 3.043,364 2.353,365 4.793,366 2.755,367 1.806,368 2.176,370 5.026,371 1.695,372 2.819,373 2.068,374 4.187,375 2.609,376 1.654,377 1.818,379 3.997,380 1.559,381 2.5,382 1.461,383 4.047,384 2.258,385 1.28,386 1.5,388 3.214,389 1.247,390 2.488,391 1.153,392 3.845,393 2.092,394 1.1,395 1.485,397 2.851,398 1.089,399 2.398,400 1.027,401 3.414,402 2,403 1,404 1.378,406 2.275,407 1,408 1.78,409 1,410 3.249,411 1.564,412 0.666,413 0.722,415 1.591,416 0.591,417 1.207,418 0.74,419 2.802,420 0.897,421 -0.046,422 -0.054,424 -0.115,425 -0.043,426 0.972,427 0.407,428 2.607,429 0.701,430 -0.259,431 -0.29,433 -0.661,434 -0.242,435 0.835,436 0.095,437 2.361,438 0.55,439 -0.394,440 -0.445,442 -0.986,443 -0.36,444 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{0 CHEMBL101831,1 1.53,2 16.694,3 8.959,4 80.269,5 195.452,6 7.645,7 0.462,8 4.597,9 4.695,10 4.204,11 4.195,12 5.743,13 4.133,14 5.128,15 5.28,16 4.686,17 4.627,18 6.276,19 4.527,20 5.442,21 5.608,22 4.709,23 4.805,24 6.567,25 4.682,26 5.546,27 5.747,28 4.804,29 4.848,30 6.691,31 4.732,32 5.6,33 5.77,34 4.882,35 4.963,36 6.662,37 4.822,38 5.681,39 5.88,40 4.896,41 5.044,42 6.696,43 4.877,44 5.74,45 5.929,46 4.974,47 5.083,48 6.853,49 4.93,50 5.895,51 6.121,52 4.845,53 5.114,54 6.859,55 4.92,56 0.112,57 1.303,58 20.135,59 10.307,60 31.114,61 11.963,62 0.326,63 2.186,64 42.493,65 18.554,66 77.564,67 21.098,68 0.741,69 2.931,70 67.616,71 25.512,72 127.091,73 28.005,74 0.972,75 2.999,76 63.752,77 25.613,78 175.269,79 30.844,80 0.97,81 3.155,82 73.309,83 28.563,84 141.946,85 32.518,86 0.764,87 3.59,88 85.844,89 33.416,90 135.014,91 39.007,92 1.089,93 3.845,94 83.206,95 33.512,96 172.954,97 39.744,98 0.999,99 4.394,100 107.337,101 39.48,102 159.224,103 47.063,104 185,105 75,106 0.226,107 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