"molecule_id","FCFP4_1024b1","FCFP4_1024b10","FCFP4_1024b100","FCFP4_1024b1000","FCFP4_1024b1001","FCFP4_1024b1002","FCFP4_1024b1003","FCFP4_1024b1004","FCFP4_1024b1005","FCFP4_1024b1006","FCFP4_1024b1007","FCFP4_1024b1008","FCFP4_1024b1009","FCFP4_1024b101","FCFP4_1024b1010","FCFP4_1024b1011","FCFP4_1024b1012","FCFP4_1024b1013","FCFP4_1024b1014","FCFP4_1024b1015","FCFP4_1024b1016","FCFP4_1024b1017","FCFP4_1024b1018","FCFP4_1024b1019","FCFP4_1024b102","FCFP4_1024b1020","FCFP4_1024b1021","FCFP4_1024b1022","FCFP4_1024b1023","FCFP4_1024b1024","FCFP4_1024b103","FCFP4_1024b104","FCFP4_1024b105","FCFP4_1024b106","FCFP4_1024b107","FCFP4_1024b108","FCFP4_1024b109","FCFP4_1024b11","FCFP4_1024b110","FCFP4_1024b111","FCFP4_1024b112","FCFP4_1024b113","FCFP4_1024b114","FCFP4_1024b115","FCFP4_1024b116","FCFP4_1024b117","FCFP4_1024b118","FCFP4_1024b119","FCFP4_1024b12","FCFP4_1024b120","FCFP4_1024b121","pXC50"
{16 1,26 1,52 4.588}
{0 CHEMBL1299640,1 1,35 1,52 4.436}
{0 CHEMBL1301616,1 1,35 1,50 1,52 4.397}
{0 CHEMBL1304456,1 1,52 4.779}
{0 CHEMBL1305400,1 1,35 1,52 4.612}
{0 CHEMBL1307057,1 1,35 1,52 4.889}
{0 CHEMBL1307246,1 1,6 1,26 1,35 1,49 1,52 4.981}
{0 CHEMBL1310024,1 1,31 1,35 1,43 1,52 4.403}
{0 CHEMBL1310231,1 1,4 1,52 4.841}
{0 CHEMBL1321912,1 1,50 1,52 4.288}
{0 CHEMBL1322260,1 1,35 1,52 4.496}
{0 CHEMBL1332538,1 1,50 1,52 4.829}
{0 CHEMBL1334259,1 1,35 1,52 4.853}
{0 CHEMBL1337374,1 1,35 1,38 1,52 4.64}
{0 CHEMBL1337797,1 1,52 4.959}
{0 CHEMBL1344597,1 1,23 1,52 4.866}
{0 CHEMBL1351458,1 1,35 1,52 4.403}
{0 CHEMBL1354089,1 1,52 4.841}
{0 CHEMBL1374864,1 1,35 1,52 4.944}
{0 CHEMBL1375795,1 1,52 4.546}
{0 CHEMBL1376370,1 1,35 1,43 1,52 4.269}
{0 CHEMBL1386412,1 1,35 1,52 4.285}
{0 CHEMBL1387750,1 1,35 1,43 1,52 4.929}
{0 CHEMBL1390602,1 1,11 1,31 1,52 4.76}
{0 CHEMBL1392169,1 1,35 1,52 4.629}
{0 CHEMBL1392636,1 1,11 1,31 1,52 4.459}
{0 CHEMBL1393761,1 1,2 1,50 1,52 4.301}
{0 CHEMBL1399684,1 1,11 1,31 1,43 1,52 4.403}
{0 CHEMBL1401778,1 1,45 1,49 1,52 4.841}
{0 CHEMBL1402544,1 1,35 1,52 4.808}
{0 CHEMBL1404549,1 1,52 4.873}
{0 CHEMBL1406534,1 1,10 1,35 1,52 4.49}
{0 CHEMBL1408240,1 1,35 1,52 4.495}
{0 CHEMBL1408604,1 1,6 1,24 1,26 1,49 1,52 4.802}
{0 CHEMBL1414694,1 1,23 1,52 4.479}
{0 CHEMBL1419230,1 1,11 1,31 1,35 1,52 4.428}
{0 CHEMBL1420871,1 1,8 1,31 1,35 1,52 4.667}
{0 CHEMBL1425607,1 1,35 1,50 1,52 4.69}
{0 CHEMBL1427233,1 1,35 1,52 4.718}
{0 CHEMBL1429280,1 1,52 4.132}
{0 CHEMBL1429491,1 1,2 1,33 1,52 4.672}
{0 CHEMBL1430465,1 1,39 1,52 4.56}
{0 CHEMBL1435034,1 1,2 1,24 1,35 1,52 4.985}
{0 CHEMBL1435151,1 1,3 1,35 1,52 4.01}
{0 CHEMBL1442583,1 1,4 1,6 1,24 1,50 1,52 4.276}
{0 CHEMBL1450679,1 1,35 1,52 4.61}
{0 CHEMBL1453042,1 1,31 1,35 1,52 4.837}
{0 CHEMBL1453868,1 1,35 1,52 4.705}
{0 CHEMBL1456198,1 1,26 1,50 1,52 4.434}
{0 CHEMBL1462524,1 1,14 1,15 1,35 1,36 1,52 4.279}
{0 CHEMBL1468788,1 1,52 4.908}
{0 CHEMBL1473388,1 1,17 1,35 1,52 4.17}
{0 CHEMBL1477049,1 1,19 1,31 1,46 1,52 4.651}
{0 CHEMBL1480806,1 1,35 1,52 4.809}
{0 CHEMBL1489593,1 1,11 1,52 4.085}
{0 CHEMBL1490499,1 1,23 1,35 1,52 4.783}
{0 CHEMBL1493657,1 1,24 1,35 1,39 1,52 4.477}
{0 CHEMBL1499342,1 1,52 4.379}
{0 CHEMBL1501383,1 1,35 1,45 1,52 4.408}
{0 CHEMBL1505267,1 1,35 1,52 4.358}
{0 CHEMBL1505477,1 1,52 4.431}
{0 CHEMBL1506966,1 1,2 1,42 1,43 1,52 4.238}
{0 CHEMBL1507685,1 1,2 1,35 1,52 4.316}
{0 CHEMBL1510208,1 1,2 1,18 1,31 1,52 4.501}
{0 CHEMBL1511796,1 1,35 1,52 4.932}
{0 CHEMBL1516409,1 1,35 1,52 4.522}
{0 CHEMBL1517625,1 1,35 1,52 4.862}
{0 CHEMBL1521754,1 1,35 1,39 1,52 4.914}
{0 CHEMBL1527964,1 1,35 1,52 4.283}
{0 CHEMBL1531043,1 1,35 1,43 1,52 4.727}
{0 CHEMBL1534918,1 1,35 1,52 4.304}
{0 CHEMBL1543206,1 1,14 1,15 1,35 1,36 1,52 4.735}
{0 CHEMBL1547526,1 1,35 1,52 4.695}
{0 CHEMBL1548139,1 1,2 1,18 1,39 1,43 1,52 4.914}
{0 CHEMBL1548540,1 1,35 1,52 4.868}
{0 CHEMBL1559,1 1,50 1,52 4.918}
{0 CHEMBL1561800,1 1,17 1,35 1,36 1,42 1,52 4.612}
{0 CHEMBL1563531,1 1,31 1,35 1,38 1,52 4.056}
{0 CHEMBL1564510,1 1,2 1,26 1,35 1,52 4.603}
{0 CHEMBL1571530,1 1,35 1,52 4.794}
{0 CHEMBL1571768,1 1,2 1,35 1,52 4.586}
{0 CHEMBL1573024,1 1,23 1,35 1,52 4.593}
{0 CHEMBL1576749,1 1,31 1,52 4.083}
{0 CHEMBL1585220,1 1,35 1,52 4.33}
{0 CHEMBL1585840,1 1,11 1,35 1,52 4.778}
{0 CHEMBL1586704,1 1,24 1,35 1,43 1,52 4.785}
{0 CHEMBL1589389,1 1,35 1,43 1,52 4.759}
{0 CHEMBL1596456,1 1,35 1,52 4.352}
{0 CHEMBL1597054,1 1,35 1,52 4.954}
{0 CHEMBL1601180,1 1,31 1,52 4.55}
{0 CHEMBL1601445,1 1,47 1,52 4.666}
{0 CHEMBL1604118,1 1,2 1,18 1,35 1,52 4.57}
{0 CHEMBL1607007,1 1,35 1,52 4.747}
{0 CHEMBL1609696,1 1,35 1,43 1,52 4.882}
{0 CHEMBL1613237,1 1,35 1,43 1,52 4.945}
{0 CHEMBL1613664,1 1,8 1,52 4.807}
{0 CHEMBL1699206,1 1,35 1,52 4.766}
{0 CHEMBL1704528,1 1,15 1,26 1,52 4.904}
{0 CHEMBL1717951,1 1,52 4.708}
{0 CHEMBL1720465,1 1,2 1,18 1,35 1,49 1,52 4.698}
{0 CHEMBL1722377,1 1,2 1,43 1,52 4.359}
{0 CHEMBL1735542,1 1,2 1,5 1,35 1,52 4.635}
{0 CHEMBL1863802,1 1,52 4.814}
{0 CHEMBL1864123,1 1,6 1,49 1,52 4.658}
{0 CHEMBL1878837,1 1,52 4.977}
{0 CHEMBL1881623,1 1,5 1,35 1,52 4.783}
{0 CHEMBL1887158,1 1,52 4.618}
{0 CHEMBL1887425,1 1,7 1,24 1,27 1,52 4.298}
{0 CHEMBL1888226,1 1,35 1,50 1,52 4.768}
{0 CHEMBL1891426,1 1,2 1,26 1,35 1,50 1,52 4.828}
{0 CHEMBL1893648,1 1,52 4.822}
{0 CHEMBL1894665,1 1,52 4.988}
{0 CHEMBL1895142,1 1,11 1,31 1,52 4.428}
{0 CHEMBL1895166,1 1,2 1,18 1,52 4.738}
{0 CHEMBL1900755,1 1,6 1,16 1,26 1,35 1,52 4.727}
{0 CHEMBL1901922,1 1,52 4.848}
{0 CHEMBL1978037,1 1,24 1,39 1,52 4.795}
{0 CHEMBL1981667,1 1,31 1,39 1,50 1,52 4.6}
{0 CHEMBL1985345,1 1,50 1,52 4.765}
{0 CHEMBL2002487,1 1,28 1,31 1,39 1,43 1,52 4.712}
{0 CHEMBL2131743,1 1,7 1,24 1,52 4.663}
{0 CHEMBL2138701,1 1,52 4.914}
{0 CHEMBL2143436,1 1,31 1,52 4.748}
{0 CHEMBL512649,1 1,4 1,52 4.429}
{0 CHEMBL582471,1 1,26 1,52 4.661}
{0 CHEMBL582997,1 1,24 1,31 1,39 1,52 4.625}
{0 CHEMBL597857,1 1,2 1,35 1,52 4.945}
{0 CHEMBL91,1 1,50 1,52 4.911}