"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","FCFP4_1024b122","FCFP4_1024b123","FCFP4_1024b124","FCFP4_1024b125","FCFP4_1024b126","FCFP4_1024b127","FCFP4_1024b128","FCFP4_1024b129","FCFP4_1024b13","FCFP4_1024b130","FCFP4_1024b131","FCFP4_1024b132","FCFP4_1024b133","FCFP4_1024b134","FCFP4_1024b135","FCFP4_1024b136","FCFP4_1024b137","FCFP4_1024b138","FCFP4_1024b139","FCFP4_1024b14","FCFP4_1024b140","FCFP4_1024b141","FCFP4_1024b142","FCFP4_1024b143","FCFP4_1024b144","FCFP4_1024b145","FCFP4_1024b146","FCFP4_1024b147","FCFP4_1024b148","FCFP4_1024b149","FCFP4_1024b15","FCFP4_1024b150","FCFP4_1024b151","FCFP4_1024b152","FCFP4_1024b153","FCFP4_1024b154","FCFP4_1024b155","FCFP4_1024b156","FCFP4_1024b157","FCFP4_1024b158","FCFP4_1024b159","FCFP4_1024b16","FCFP4_1024b160","FCFP4_1024b161","FCFP4_1024b162","FCFP4_1024b163","FCFP4_1024b164","FCFP4_1024b165","FCFP4_1024b166","FCFP4_1024b167","FCFP4_1024b168","FCFP4_1024b169","FCFP4_1024b17","FCFP4_1024b170","FCFP4_1024b171","FCFP4_1024b172","FCFP4_1024b173","FCFP4_1024b174","FCFP4_1024b175","FCFP4_1024b176","FCFP4_1024b177","FCFP4_1024b178","FCFP4_1024b179","FCFP4_1024b18","FCFP4_1024b180","FCFP4_1024b181","FCFP4_1024b182","FCFP4_1024b183","FCFP4_1024b184","FCFP4_1024b185","FCFP4_1024b186","FCFP4_1024b187","FCFP4_1024b188","FCFP4_1024b189","FCFP4_1024b19","FCFP4_1024b190","FCFP4_1024b191","FCFP4_1024b192","FCFP4_1024b193","FCFP4_1024b194","FCFP4_1024b195","FCFP4_1024b196","FCFP4_1024b197","FCFP4_1024b198","FCFP4_1024b199","FCFP4_1024b2","FCFP4_1024b20","FCFP4_1024b200","FCFP4_1024b201","FCFP4_1024b202","FCFP4_1024b203","FCFP4_1024b204","FCFP4_1024b205","FCFP4_1024b206","FCFP4_1024b207","FCFP4_1024b208","FCFP4_1024b209","FCFP4_1024b21","FCFP4_1024b210","FCFP4_1024b211","FCFP4_1024b212","FCFP4_1024b213","FCFP4_1024b214","pXC50"
{1 1,2 1,35 1,42 1,85 1,100 1,104 1,105 1,106 1,108 1,115 1,137 1,155 7.959}
{0 CHEMBL193583,1 1,2 1,31 1,35 1,85 1,104 1,105 1,115 1,137 1,155 5.742}
{0 CHEMBL195319,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 6.75}
{0 CHEMBL195896,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL195914,1 1,2 1,42 1,51 1,100 1,104 1,105 1,115 1,121 1,137 1,155 6.184}
{0 CHEMBL196115,1 1,2 1,35 1,42 1,62 1,100 1,104 1,105 1,115 1,137 1,138 1,155 5.929}
{0 CHEMBL196332,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL196388,1 1,23 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 6.124}
{0 CHEMBL196390,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL196599,1 1,23 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 6.833}
{0 CHEMBL196781,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL196839,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 6.203}
{0 CHEMBL196991,1 1,2 1,35 1,42 1,70 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL197054,1 1,2 1,35 1,42 1,83 1,85 1,100 1,104 1,105 1,115 1,137 1,155 6.767}
{0 CHEMBL197210,1 1,35 1,42 1,52 1,62 1,100 1,104 1,105 1,115 1,137 1,155 6.561}
{0 CHEMBL197571,1 1,2 1,35 1,42 1,62 1,83 1,85 1,100 1,104 1,105 1,115 1,137 1,155 5.541}
{0 CHEMBL214021,1 1,2 1,70 1,85 1,88 1,104 1,105 1,137 1,155 7.538}
{0 CHEMBL214585,1 1,2 1,26 1,70 1,85 1,88 1,104 1,105 1,137 1,155 7.634}
{0 CHEMBL214731,1 1,2 1,70 1,85 1,88 1,104 1,105 1,137 1,155 7.602}
{0 CHEMBL215457,1 1,2 1,70 1,85 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL215661,1 1,2 1,26 1,35 1,70 1,85 1,104 1,105 1,137 1,155 7.419}
{0 CHEMBL216104,1 1,2 1,64 1,70 1,85 1,104 1,105 1,115 1,137 1,155 7.244}
{0 CHEMBL216180,1 1,2 1,43 1,53 1,64 1,70 1,85 1,104 1,105 1,129 1,136 1,137 1,138 1,155 6.959}
{0 CHEMBL216323,1 1,2 1,7 1,70 1,85 1,104 1,105 1,121 1,137 1,139 1,155 5.253}
{0 CHEMBL216482,1 1,2 1,35 1,36 1,70 1,85 1,104 1,105 1,137 1,155 6.79}
{0 CHEMBL216524,1 1,2 1,70 1,85 1,104 1,105 1,115 1,137 1,155 6.975}
{0 CHEMBL216554,1 1,2 1,64 1,70 1,85 1,104 1,105 1,115 1,137 1,155 7.456}
{0 CHEMBL216680,1 1,2 1,35 1,70 1,85 1,104 1,105 1,137 1,155 5}
{0 CHEMBL217233,1 1,2 1,35 1,70 1,85 1,104 1,105 1,137 1,155 6.633}
{0 CHEMBL217435,1 1,2 1,35 1,70 1,85 1,104 1,105 1,137 1,141 1,155 6.245}
{0 CHEMBL266725,1 1,2 1,5 1,36 1,47 1,70 1,85 1,104 1,105 1,137 1,155 7.357}
{0 CHEMBL269352,1 1,2 1,35 1,70 1,85 1,104 1,105 1,137 1,155 6.259}
{0 CHEMBL274168,1 1,2 1,43 1,70 1,85 1,104 1,105 1,129 1,136 1,137 1,138 1,155 7.18}
{0 CHEMBL364071,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,138 1,155 6.287}
{0 CHEMBL364936,1 1,2 1,35 1,42 1,70 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL370839,1 1,2 1,35 1,42 1,100 1,104 1,105 1,106 1,108 1,115 1,137 1,155 5}
{0 CHEMBL372291,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 5}
{0 CHEMBL372570,1 1,2 1,35 1,42 1,100 1,104 1,105 1,106 1,108 1,115 1,137 1,155 5.146}
{0 CHEMBL383798,1 1,2 1,35 1,42 1,100 1,104 1,105 1,108 1,115 1,137 1,155 5}
{0 CHEMBL384043,1 1,2 1,70 1,85 1,104 1,105 1,115 1,137 1,155 5.86}
{0 CHEMBL384111,1 1,2 1,26 1,35 1,70 1,85 1,104 1,105 1,137 1,141 1,155 6.762}
{0 CHEMBL384844,1 1,2 1,35 1,70 1,85 1,104 1,105 1,137 1,155 5.618}
{0 CHEMBL384919,1 1,2 1,26 1,35 1,70 1,85 1,104 1,105 1,137 1,155 7.022}
{0 CHEMBL386281,1 1,2 1,36 1,47 1,70 1,85 1,95 1,104 1,105 1,137 1,155 7.337}
{0 CHEMBL424836,1 1,2 1,35 1,42 1,62 1,100 1,104 1,105 1,115 1,137 1,155 6.049}
{0 CHEMBL425013,1 1,2 1,42 1,100 1,104 1,105 1,115 1,121 1,137 1,155 5.951}
{0 CHEMBL425048,1 1,26 1,32 1,35 1,70 1,104 1,105 1,106 1,108 1,115 1,137 1,155 5}
{0 CHEMBL425257,1 1,2 1,26 1,70 1,85 1,88 1,104 1,105 1,120 1,137 1,155 5.561}
{0 CHEMBL425744,1 1,2 1,35 1,42 1,100 1,104 1,105 1,106 1,108 1,115 1,137 1,155 5}
{0 CHEMBL426292,1 1,2 1,35 1,42 1,100 1,104 1,105 1,115 1,137 1,155 6.983}