0 B15R1.640 CCOC(=O)C(=Cc1ccccc1)C#N CSC000162506 [1,0,0,0,0,0|1,0,1]=3 1 B15R1.640 CCOC(=O)C(=Cc1cccnc1)C#N CSC000162505 [1,0,0,0,0,0|2,0,1]=4 2 B17R2.50008 CCNC(=O)c1cc2ccccc2oc1=O CSC021959206 [0,0,0,1,0,0|2,0,0]=3 3 B17R2.50008 CCOC(=O)c1cc2ccccc2[nH]c1=O CSC000031236 [0,0,0,1,0,0|1,0,0]=2 4 B17R2.50008 CCOC(=O)c1cc2ccccc2oc1=O CSC000170496 [0,0,0,1,0,0|1,0,0]=2 5 B17R1.18492 CCOC(=O)C(Cc1ccccc1)NC(=O)C CSC046241657 [0,0,0,0,0,1|0,0,2]=3 6 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 CSC000027867 [2,0,0,0,0,0|2,0,0]=4 7 B14R1.60 CCOC(=O)C(C)Oc1ccccc1 CSC000170572 [2,0,0,0,0,0|1,0,1]=4 8 B14R1.60 CCOC(=O)C(C)Sc1ccccc1 CSC011212192 [2,0,0,0,0,0|1,0,1]=4 9 B16R1.743 CCOC(=O)C(=Cc1ccc(cc1)Br)C#N CSC000162510 [1,1,0,0,0,0|1,0,1]=4 10 B16R1.744 CCOC(=O)C(=Cc1cccc(c1)Br)C#N CSC000162513 [1,1,0,0,0,0|1,0,1]=4 11 B16R1.15117 CCOC(=O)C(=Cc1ccccc1Cl)C#N CSC000162508 [1,1,0,0,0,0|1,0,1]=4 12 B18R1.5634 CCOC(=O)CN(Cc1ccccc1)C(=O)CC CSC011579542 [0,1,0,0,0,1|1,0,1]=4 13 B16R2.757 CCOC(=O)c1[nH]c2ccccc2c1Br CSC009814654 [1,0,0,1,0,0|2,0,0]=4 14 B16R2.757 CCOC(=O)c1cc2ccccc2n1C CSC000054198 [1,0,0,1,0,0|1,0,0]=3 15 B16R2.767 CCOC(=O)c1ccc2ccccc2c1 CSC000171408 [1,0,0,1,0,0|0,0,1]=3 16 B16R2.767 CCOC(=O)c1ccc2ccccc2n1 CSC000169932 [1,0,0,1,0,0|1,0,1]=4 17 B16R2.767 CCOC(=O)c1ccc2ncccc2c1 CSC011581696 [1,0,0,1,0,0|1,0,1]=4 18 B16R2.33941 CNC(=O)c1cc2ccccc2oc1=O CSC000002962 [1,0,0,1,0,0|2,0,0]=4 19 B16R2.33941 COC(=O)c1cc2ccccc2[nH]c1=O CSC000062812 [1,0,0,1,0,0|1,0,0]=3 20 B16R2.33941 COC(=O)c1cc2ccccc2oc1=O CSC000149469 [1,0,0,1,0,0|1,0,0]=3 21 B16R2.29842 CCOC(=O)c1c([nH]c2c1cccc2)C CSC011213068 [0,0,0,1,1,0|1,0,0]=3 22 B18R2.8107 CCNC(=O)c1sc(nc1C)c2ccccc2 CSC046652574 [0,0,0,1,0,1|2,0,0]=4 23 B18R2.8107 CCOC(=O)c1cc(nn1C)c2ccccc2 CSC016988620 [0,0,0,1,0,1|2,0,0]=4 24 B18R2.8107 CCOC(=O)c1cn(nc1C)c2ccccc2 CSC020598216 [0,0,0,1,0,1|1,0,0]=3 25 B18R2.8107 CCOC(=O)c1nc([nH]c1C)c2ccccc2 CSC000283495 [0,0,0,1,0,1|1,0,0]=3 26 B18R2.8107 CCOC(=O)c1nc(oc1C)c2ccccc2 CSC020622933 [0,0,0,1,0,1|0,0,1]=3 27 B18R2.8107 CCOC(=O)c1oc(nc1C)c2ccccc2 CSC000763432 [0,0,0,1,0,1|1,0,0]=3 28 B18R2.8107 CCOC(=O)c1sc(nc1C)c2ccccn2 CSC000256597 [0,0,0,1,0,1|2,0,0]=4 29 B18R2.8107 CCOC(=O)c1sc(nc1C)c2ccncc2 CSC000287307 [0,0,0,1,0,1|2,0,0]=4 30 B18R2.8169 CCNC(=O)c1cc2ccccc2cc1OC CSC046748415 [0,1,0,1,0,0|2,0,0]=4 31 B18R2.80684 CCNC(=O)c1c(onc1c2ccccc2)C CSC046237968 [0,1,0,1,0,0|1,0,1]=4 32 B18R2.80684 CCOC(=O)c1c(onc1c2ccccc2)C CSC020621407 [0,1,0,1,0,0|0,0,1]=3 33 B18R2.80684 CCOC(=O)c1c(onc1c2ccncc2)C CSC000731629 [0,1,0,1,0,0|1,0,1]=4 34 B18R2.123786 C=CCOC(=O)c1cc2ccccc2oc1=O CSC046824776 [0,1,0,1,0,0|1,0,1]=4 35 B18R2.123786 CCCNC(=O)c1cc2ccccc2oc1=O CSC036898653 [0,1,0,1,0,0|2,0,0]=4 36 B18R2.123786 CCCOC(=O)c1cc2ccccc2oc1=O CSC000256824 [0,1,0,1,0,0|1,0,0]=3 37 B18R2.61969 CC(C)NC(=O)c1cc2ccccc2oc1=O CSC020645575 [0,1,0,1,0,0|2,0,0]=4 38 B18R2.61969 CC(C)OC(=O)c1cc2ccccc2oc1=O CSC000256823 [0,1,0,1,0,0|1,0,0]=3 39 B14R1.604 CCOC(=O)C(CC)c1ccccc1 CSC000170534 [1,0,0,0,1,0|0,0,2]=4 40 B16R1.740 CCOC(=O)C(=CNc1ccccc1)C#N CSC000020011 [1,0,0,0,0,1|1,0,1]=4 41 B16R1.5825 COC(=O)C(Cc1ccccc1)NC(=O)C CSC000253422 [1,0,0,0,0,1|0,0,2]=4 42 B16R1.5825 COC(=O)[C@H](Cc1ccccc1)NC(=O)C CSC000053717 [1,0,0,0,0,1|0,0,2]=4