0 B19R3.6048 O=c1n(ncc2c1cccc2)c3ccccc3 CSC046156449 [0,0,0,0,0,0|3,0,0]=3 1 B20R3.5292 Clc1ccc(cc1)n2ncc3ccccc3c2=O CSC025685049 [0,1,0,0,0,0|3,0,0]=4 2 B20R3.5292 Fc1ccc(cc1)n2ncc3ccccc3c2=O CSC046265584 [0,1,0,0,0,0|3,0,0]=4 3 B20R3.259727 O=c1[nH]n(c(=O)c2c1cccc2)c3ccccc3 CSC046194869 [0,1,0,0,0,0|3,0,0]=4 4 B18R2.2315 CCN(C(=O)c1ccccc1)c2ccccc2 CSC000390221 [0,0,1,0,0,0|2,0,1]=4 5 B18R2.3047 CNc1ccccc1C(=O)Nc2ccccc2 CSC031910152 [0,0,1,0,0,0|2,0,1]=4 6 B18R2.3047 COc1ccccc1C(=O)Nc2cccnc2 CSC046184177 [0,0,1,0,0,0|2,0,1]=4 7 B18R2.3047 COc1ccccc1C(=O)Nc2ccncc2 CSC046165702 [0,0,1,0,0,0|2,0,1]=4 8 B18R2.3988 CN(C(=O)c1ccccc1C)c2ccccc2 CSC046147501 [0,0,1,0,0,0|2,0,1]=4 9 B18R2.3988 CN(C(=O)c1ccccc1Cl)c2ccccc2 CSC046255498 [0,0,1,0,0,0|2,0,1]=4 10 B18R2.3988 CN(C(=O)c1ccccc1F)c2ccccc2 CSC000252021 [0,0,1,0,0,0|2,0,1]=4 11 B18R2.3988 CN(C(=O)c1ccccc1N)c2ccccc2 CSC000512025 [0,0,1,0,0,0|2,0,1]=4 12 B18R3.111 Cn1c(nc2c1cccc2)c3ccccc3 CSC000011584 [0,0,0,0,1,0|3,0,0]=4 13 B20R3.96365 O=C1C(=Cc2ccccc2)CCc3c1cccc3 CSC000013067 [0,0,0,0,0,1|1,0,1]=3 14 B20R3.96365 O=c1n(cnc2c1cccc2)Cc3ccccc3 CSC000018112 [0,0,0,0,0,1|2,0,0]=3 15 B20R3.96365 O=c1n(cnc2c1cccc2)Cc3ccccn3 CSC046128447 [0,0,0,0,0,1|3,0,0]=4 16 B20R3.96365 O=c1n(cnc2c1cccc2)Cc3cccnc3 CSC046098740 [0,0,0,0,0,1|3,0,0]=4 17 B20R3.96365 O=c1n(nnc2c1cccc2)Cc3ccccc3 CSC046170900 [0,0,0,0,0,1|3,0,0]=4 18 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 CSC000252023 [1,0,1,0,0,0|1,0,1]=4 19 B17R2.3417 Cc1ccccc1C(=O)Oc2ccccc2 CSC000001951 [1,0,1,0,0,0|1,0,1]=4 20 B17R2.3417 Fc1ccccc1C(=O)Nc2ccccc2 CSC000153486 [1,0,1,0,0,0|2,0,0]=4 21 B17R2.3417 Fc1ccccc1C(=O)Oc2ccccc2 CSC000001945 [1,0,1,0,0,0|2,0,0]=4 22 B17R2.3417 Ic1ccccc1C(=O)Nc2ccccc2 CSC000153495 [1,0,1,0,0,0|2,0,0]=4 23 B17R2.3417 Ic1ccccc1C(=O)Oc2ccccc2 CSC000001949 [1,0,1,0,0,0|2,0,0]=4 24 B17R2.2342 O=C(C=Cc1ccccc1)c2ccncc2 CSC020760964 [1,0,1,0,0,0|2,0,0]=4 25 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 CSC000150728 [1,0,1,0,0,0|0,1,1]=4 26 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 CSC000001589 [1,0,1,0,0,0|2,0,0]=4 27 B17R2.3426 Oc1ccccc1NC(=O)c2ccccc2 CSC005462413 [1,0,1,0,0,0|2,0,0]=4 28 B19R2.8826 NC(=O)c1ccccc1OCCc2ccccc2 CSC020586076 [0,1,1,0,0,0|0,0,2]=4 29 B19R2.912 COc1cccc(c1C(=O)Nc2ccccc2)F CSC008290388 [0,1,1,0,0,0|1,0,1]=4 30 B19R2.2713 COc1ccc(cc1C(=O)Nc2ccccc2)Br CSC000500631 [0,1,1,0,0,0|1,0,1]=4 31 B19R2.2816 COc1cc(ccc1C(=O)Nc2ccccc2)Br CSC020631501 [0,1,1,0,0,0|1,0,1]=4 32 B19R2.3353 COc1ccccc1C(=O)Nc2ccc(cc2)Cl CSC046172545 [0,1,1,0,0,0|1,0,1]=4 33 B19R2.3353 COc1ccccc1C(=O)Nc2ccc(cc2)F CSC046269159 [0,1,1,0,0,0|1,0,1]=4 34 B19R2.3353 COc1ccccc1C(=O)Nc2ccc(cc2)I CSC000581730 [0,1,1,0,0,0|1,0,1]=4 35 B19R2.3353 COc1ccccc1C(=O)Nc2ccc(cc2)O CSC015194475 [0,1,1,0,0,0|1,0,1]=4 36 B19R2.3353 COc1ccccc1C(=O)Oc2ccc(cc2)Br CSC046444027 [0,1,1,0,0,0|1,0,1]=4 37 B19R2.3353 COc1ccccc1C(=O)Oc2ccc(cc2)C CSC046582385 [0,1,1,0,0,0|1,0,1]=4 38 B19R2.3353 COc1ccccc1C(=O)Oc2ccc(cc2)Cl CSC048922346 [0,1,1,0,0,0|1,0,1]=4 39 B19R2.3393 COc1ccccc1C(=O)N(C)c2ccccc2 CSC046227953 [0,1,1,0,0,0|1,0,1]=4 40 B19R2.3420 COc1ccccc1C(=O)Nc2cccc(c2)Cl CSC046225459 [0,1,1,0,0,0|1,0,1]=4 41 B19R2.3420 COc1ccccc1C(=O)Nc2cccc(c2)F CSC046199222 [0,1,1,0,0,0|1,0,1]=4 42 B19R2.3420 COc1ccccc1C(=O)Nc2cccc(c2)I CSC000578632 [0,1,1,0,0,0|1,0,1]=4 43 B19R2.3420 COc1ccccc1C(=O)Nc2cccc(c2)O CSC000584469 [0,1,1,0,0,0|1,0,1]=4 44 B19R2.29259 COc1ccccc1C(=O)Nc2ccccc2Br CSC000579970 [0,1,1,0,0,0|1,0,1]=4 45 B19R2.29259 COc1ccccc1C(=O)Nc2ccccc2C CSC046176758 [0,1,1,0,0,0|1,0,1]=4 46 B19R2.29259 COc1ccccc1C(=O)Nc2ccccc2O CSC046083599 [0,1,1,0,0,0|1,0,1]=4 47 B21R3.19605 O=c1sc2ccccc2c(=O)n1Cc3ccccc3 CSC009999643 [0,1,0,0,0,1|1,1,0]=4 48 B21R3.20221 Cc1ccccc1Cn2cnc3ccccc3c2=O CSC046260283 [0,1,0,0,0,1|2,0,0]=4 49 B21R3.20221 Clc1ccccc1C=C2CCc3ccccc3C2=O CSC046123797 [0,1,0,0,0,1|1,0,1]=4 50 B21R3.20221 Clc1ccccc1Cn2cnc3ccccc3c2=O CSC046160613 [0,1,0,0,0,1|2,0,0]=4 51 B21R3.30613 Brc1ccc(cc1)Cn2cnc3ccccc3c2=O CSC000595739 [0,1,0,0,0,1|2,0,0]=4 52 B21R3.30613 Cc1ccc(cc1)C=C2COc3ccccc3C2=O CSC046209596 [0,1,0,0,0,1|0,0,1]=3 53 B21R3.30613 Cc1ccc(cc1)C=C2CSc3ccccc3C2=O CSC047659113 [0,1,0,0,0,1|0,1,1]=4 54 B21R3.154115 Brc1ccc2ncn(c(=O)c2c1)Cc3ccccc3 CSC009812567 [0,1,0,0,0,1|2,0,0]=4 55 B19R3.182 O=C1C(=Cc2ccccc2)Oc3c1cccc3 CSC046110939 [0,0,1,1,0,0|0,0,0]=2 56 B19R2.9974 O=C(C(=Cc1ccccc1)C#N)c2ccccc2 CSC046145058 [0,0,1,0,0,1|1,0,1]=4 57 B19R2.5647 CC(NC(=O)c1ccccc1O)c2ccccc2 CSC000596043 [0,0,1,0,0,1|0,0,2]=4 58 B19R2.5647 CC(OC(=O)c1ccccc1O)c2ccccc2 CSC046213153 [0,0,1,0,0,1|0,0,2]=4 59 B19R2.5647 C[C@H](NC(=O)c1ccccc1O)c2ccccc2 CSC047909001 [0,0,1,0,0,1|0,0,2]=4 60 B21R3.3944604 O=c1n(cnc2c1cccc2)CCc3ccccc3 CSC046248541 [0,0,0,0,0,2|2,0,0]=4