"molecule_id","FCFP4_1024b37","FCFP4_1024b644","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","pXC50"
{3 1,18 1,26 1,52 1,72 1,103 5.1}
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{0 CHEMBL1087650,1 1,2 1,3 1,4 1,18 1,62 1,93 1,103 5.022}
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{0 CHEMBL1090360,3 1,37 1,39 1,66 1,87 1,103 5.2}
{0 CHEMBL1091356,1 1,2 1,3 1,4 1,8 1,37 1,63 1,102 1,103 4.301}
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{0 CHEMBL1095627,3 1,28 1,44 1,88 1,102 1,103 4.301}
{0 CHEMBL116070,3 1,72 1,103 6.4}
{0 CHEMBL1163016,3 1,4 1,8 1,45 1,64 1,103 4.301}
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{0 CHEMBL1190711,3 1,60 1,64 1,66 1,103 5.2}
{0 CHEMBL119385,3 1,9 1,20 1,72 1,93 1,103 5}
{0 CHEMBL1230020,3 1,37 1,72 1,86 1,103 5}
{0 CHEMBL1230122,3 1,37 1,72 1,88 1,103 5.2}
{0 CHEMBL1236107,3 1,102 1,103 5}
{0 CHEMBL1240703,3 1,10 1,46 1,62 1,103 5}
{0 CHEMBL1241674,3 1,28 1,55 1,77 1,103 5.409}
{0 CHEMBL1242373,3 1,23 1,28 1,29 1,37 1,77 1,103 5.6}
{0 CHEMBL124660,1 1,2 1,3 1,4 1,37 1,60 1,88 1,103 5}
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{0 CHEMBL1289926,3 1,6 1,29 1,38 1,52 1,70 1,79 1,101 1,103 5}
{0 CHEMBL1336,3 1,37 1,38 1,51 1,70 1,72 1,79 1,103 5.1}
{0 CHEMBL1375418,3 1,37 1,70 1,103 5.2}
{0 CHEMBL1375640,3 1,28 1,47 1,72 1,103 5.6}
{0 CHEMBL1419458,3 1,26 1,28 1,41 1,103 5.2}
{0 CHEMBL1421,1 1,2 1,3 1,4 1,18 1,37 1,72 1,88 1,103 5.1}
{0 CHEMBL1461728,3 1,6 1,31 1,37 1,55 1,72 1,103 5.2}
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{0 CHEMBL162,3 1,38 1,46 1,62 1,103 5.228}
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{0 CHEMBL1682553,3 1,6 1,31 1,37 1,55 1,103 5.2}
{0 CHEMBL1682558,1 1,2 1,3 1,4 1,6 1,31 1,55 1,72 1,103 5.2}
{0 CHEMBL1721885,1 1,2 1,3 1,4 1,37 1,52 1,55 1,72 1,87 1,103 6}
{0 CHEMBL1727312,3 1,37 1,103 5.2}
{0 CHEMBL17370,3 1,18 1,26 1,60 1,72 1,103 5.2}
{0 CHEMBL17594,3 1,103 4.398}
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{0 CHEMBL1789941,3 1,4 1,41 1,74 1,89 1,102 1,103 5}
{0 CHEMBL180022,1 1,2 1,3 1,4 1,37 1,70 1,87 1,103 5}
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{0 CHEMBL183844,3 1,8 1,37 1,103 5.2}
{0 CHEMBL185569,3 1,37 1,103 5.2}
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{0 CHEMBL1908392,1 1,2 1,3 1,4 1,10 1,55 1,66 1,103 5}
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{0 CHEMBL1908394,1 1,2 1,3 1,4 1,51 1,72 1,103 5}
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{0 CHEMBL1916359,18 1,72 1,103 5}
{0 CHEMBL1958401,3 1,67 1,72 1,87 1,103 5.4}
{0 CHEMBL196363,3 1,23 1,28 1,29 1,37 1,77 1,103 6}
{0 CHEMBL1964290,3 1,28 1,91 1,103 7.1}
{0 CHEMBL1964444,3 1,37 1,51 1,66 1,103 5.2}
{0 CHEMBL1964644,3 1,37 1,53 1,103 5.2}
{0 CHEMBL1964687,3 1,23 1,26 1,28 1,29 1,37 1,77 1,103 5.5}
{0 CHEMBL1964692,3 1,28 1,37 1,51 1,66 1,103 6.6}
{0 CHEMBL1964777,3 1,72 1,103 6}
{0 CHEMBL1964804,3 1,82 1,103 5.2}
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{0 CHEMBL1966279,3 1,26 1,37 1,54 1,103 5.2}
{0 CHEMBL1966343,3 1,6 1,28 1,55 1,103 5.8}
{0 CHEMBL1966425,1 1,2 1,3 1,4 1,103 5.2}
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{0 CHEMBL1967094,3 1,6 1,42 1,62 1,72 1,103 5.3}
{0 CHEMBL1967116,3 1,28 1,37 1,102 1,103 5.8}
{0 CHEMBL1967302,3 1,8 1,37 1,45 1,55 1,82 1,86 1,87 1,103 5.2}
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{0 CHEMBL1967720,3 1,28 1,37 1,72 1,87 1,102 1,103 6.2}
{0 CHEMBL1967878,1 1,2 1,3 1,4 1,37 1,87 1,103 6.8}
{0 CHEMBL1967887,3 1,6 1,52 1,82 1,103 5.7}
{0 CHEMBL1968127,1 1,2 1,3 1,4 1,34 1,37 1,39 1,66 1,72 1,103 5.6}
{0 CHEMBL1968151,3 1,18 1,37 1,103 5.2}
{0 CHEMBL1968380,1 1,2 1,3 1,4 1,19 1,60 1,88 1,103 5.6}
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