0 B15R1.499 CC(=C)COc1ccc(cc1)NC(=O)C CSC000006277 [0,0,0,0,0,0|3,0,0]=3 1 B15R1.499 CC(=O)CCc1ccc(cc1)OC(=O)C CSC000002119 [0,0,0,0,0,0|0,0,0]=0 2 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C CSC011195921 [0,0,0,0,0,0|2,0,0]=2 3 B15R1.499 CC(=O)NCc1ccc(nc1)NC(=O)C CSC060958362 [0,0,0,0,0,0|3,0,0]=3 4 B15R1.499 CC(=O)Nc1ccc(cc1)C=CC(=O)O CSC000244255 [0,0,0,0,0,0|2,0,2]=4 5 B15R1.499 CC(=O)Nc1ccc(cc1)CCC(=O)O CSC011225046 [0,0,0,0,0,0|2,0,0]=2 6 B15R1.499 CC(=O)Nc1ccc(cc1)CCC(=O)O CSC011225046 [0,0,0,0,0,0|2,0,0]=2 7 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N CSC000148105 [0,0,0,0,0,0|3,0,0]=3 8 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)O CSC011194236 [0,0,0,0,0,0|3,0,0]=3 9 B15R1.499 CC(C)COc1ccc(cc1)NC(=O)C CSC000005943 [0,0,0,0,0,0|3,0,1]=4 10 B15R1.499 CC(C)NCc1ccc(cc1)NC(=O)C CSC000200195 [0,0,0,0,0,0|3,0,1]=4 11 B15R1.499 CC(C)Oc1ccc(cc1)CNC(=O)C CSC047745522 [0,0,0,0,0,0|2,0,1]=3 12 B15R1.499 CC(C)Oc1ccc(cn1)CNC(=O)C CSC061736563 [0,0,0,0,0,0|3,0,1]=4 13 B15R1.499 CC(O)COc1ccc(cc1)NC(=O)C CSC012254249 [0,0,0,0,0,0|2,0,2]=4 14 B14R1.68 CC(=O)Nc1ccc(cc1)OCC=C CSC000006476 [1,0,0,0,0,0|2,0,1]=4 15 B14R1.68 CCCCc1ccc(cc1)NC(=O)C CSC000155289 [1,0,0,0,0,0|1,0,1]=3 16 B14R1.68 CCCCc1ccc(cc1)NC(=O)N CSC011191009 [1,0,0,0,0,0|2,0,1]=4 17 B14R1.68 CCCOc1ccc(cc1)NC(=O)C CSC000170815 [1,0,0,0,0,0|2,0,1]=4 18 B14R1.142 CCOc1ccc(cc1)CNC(=O)C CSC000044878 [1,0,0,0,0,0|1,0,1]=3 19 B16R1.1139 CC(=O)Nc1ccc(cc1)CNC(=O)CN CSC000290486 [0,1,0,0,0,0|2,0,0]=3 20 B16R1.1139 CC(C)Oc1ccc(cc1)CNC(=O)CN CSC000056791 [0,1,0,0,0,0|2,0,1]=4 21 B16R1.1139 CCC(=O)CSc1ccc(cc1)NC(=O)C CSC011595629 [0,1,0,0,0,0|2,0,0]=3 22 B16R1.1139 CCC(=O)NCc1ccc(cc1)OC(C)C CSC041654381 [0,1,0,0,0,0|2,0,1]=4 23 B16R1.1139 COC(=O)CCc1ccc(cc1)OC(F)F CSC042240995 [0,1,0,0,0,0|2,0,1]=4 24 B16R1.1139 COC(=O)COc1ccc(cc1)NC(=O)N CSC000047406 [0,1,0,0,0,0|3,0,0]=4 25 B16R1.1283 CC(Cc1ccc(cc1)NC(=O)C)C(=O)O CSC016629131 [0,1,0,0,0,0|2,0,0]=3 26 B16R1.2915 CCC(=O)Nc1ccc(cc1)CCC(=O)O CSC012352453 [0,1,0,0,0,0|2,0,0]=3 27 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)O CSC011593264 [0,1,0,0,0,0|3,0,0]=4 28 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)O CSC011593264 [0,1,0,0,0,0|3,0,0]=4 29 B16R1.2915 COC(=O)Nc1ccc(cc1)OCC(=O)N CSC048946772 [0,1,0,0,0,0|3,0,0]=4 30 B16R1.6700 CC(=O)Nc1ccc(cc1C)OCC(=O)O CSC000056285 [0,1,0,0,0,0|3,0,0]=4 31 B16R1.6700 CC(=O)Nc1ccc(cc1C)OCC(=O)O CSC000056285 [0,1,0,0,0,0|3,0,0]=4 32 B16R2.11975 CC(=O)Oc1ccc2ccc(=O)oc2c1 CSC000002116 [0,0,0,1,0,0|1,0,2]=4 33 B14R1.419 CC(=O)COc1ccc(cc1)[N+](=O)[O-] CSC000150489 [0,0,0,0,1,0|3,0,0]=4 34 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] CSC011407412 [0,0,0,0,1,0|3,0,0]=4 35 B14R1.419 CC(=O)OCc1ccc(cc1)[N+](=O)[O-] CSC000000624 [0,0,0,0,1,0|3,0,0]=4 36 B14R1.419 NC(=O)COc1ccc(cc1)C(=O)N CSC000148646 [0,0,0,0,1,0|3,0,0]=4 37 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C CSC000152660 [0,0,0,0,1,0|2,0,0]=3 38 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C CSC000002093 [0,0,0,0,1,0|1,0,0]=2 39 B14R1.805 CC(C)Oc1ccc(cc1)NC(=O)C CSC000170813 [0,0,0,0,1,0|2,0,1]=4 40 B16R1.1287 CC(C)CCOc1ccc(cc1)NC(=O)C CSC020586440 [0,0,0,0,0,1|2,0,1]=4 41 B16R1.1287 CC(C)CNCc1ccc(cc1)NC(=O)C CSC000268651 [0,0,0,0,0,1|2,0,1]=4 42 B16R1.1287 CC(C)CNCc1ccc(cc1)NC(=O)C CSC000268651 [0,0,0,0,0,1|2,0,1]=4 43 B16R1.1287 CC(O)CNCc1ccc(cc1)NC(=O)C CSC000268969 [0,0,0,0,0,1|1,0,2]=4 44 B13R1.3 COc1ccc(cc1)CCC(=O)C CSC000170882 [2,0,0,0,0,0|0,0,0]=2 45 B13R1.3 COc1ccc(cc1)CNC(=O)C CSC000155742 [2,0,0,0,0,0|1,0,0]=3 46 B13R1.3 COc1ccc(cc1)CNC(=O)N CSC000238945 [2,0,0,0,0,0|2,0,0]=4 47 B15R1.104 CCCCc1ccc(cc1)NC(=O)CC CSC000155290 [1,1,0,0,0,0|1,0,1]=4 48 B15R1.104 CCCCc1ccc(cc1)NC(=O)CN CSC000168457 [1,1,0,0,0,0|1,0,1]=4 49 B15R1.104 CCCCc1ccc(cc1)NC(=O)CN CSC000168457 [1,1,0,0,0,0|1,0,1]=4 50 B15R1.104 CSCCc1ccc(cc1)NC(=O)CN CSC057442783 [1,1,0,0,0,0|2,0,0]=4 51 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C CSC000019853 [1,1,0,0,0,0|1,0,1]=4 52 B15R1.560 COCCOc1ccc(cc1)NC(=O)C CSC000234090 [1,1,0,0,0,0|2,0,0]=4 53 B15R1.560 COCCSc1ccc(cc1)NC(=O)C CSC025846985 [1,1,0,0,0,0|2,0,0]=4 54 B15R1.18 CCOc1ccc(cc1)CNC(=O)CC CSC046405204 [1,1,0,0,0,0|1,0,1]=4 55 B15R1.18 CCOc1ccc(cc1)CNC(=O)CN CSC010103579 [1,1,0,0,0,0|1,0,1]=4 56 B15R1.18 CCOc1ccc(cc1)OCC(=O)OC CSC000148215 [1,1,0,0,0,0|1,0,1]=4 57 B15R1.495 CN(Cc1ccc(cc1)C(=O)O)C(=O)C CSC011265463 [0,1,0,0,1,0|2,0,0]=4 58 B15R1.498 CC(=O)NCc1ccc(cc1)S(=O)(=O)C CSC011281546 [0,1,0,0,1,0|2,0,0]=4 59 B15R1.956 CCC(=O)NCc1ccc(cc1)C(=O)O CSC000193303 [0,1,0,0,1,0|2,0,0]=4 60 B15R1.956 CCC(=O)NCc1ccc(cc1)C(=O)O CSC000193303 [0,1,0,0,1,0|2,0,0]=4 61 B15R1.956 CNC(=O)CCc1ccc(cc1)C(=O)O CSC031446114 [0,1,0,0,1,0|1,0,0]=3 62 B15R1.956 CNC(=O)CCc1ccc(cc1)C(C)C CSC049043760 [0,1,0,0,1,0|1,0,1]=4 63 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)N CSC000193707 [0,1,0,0,1,0|2,0,0]=4 64 B15R1.1075 CC(=O)Nc1ccc(cc1)CS(=O)(=O)C CSC060732979 [0,1,0,0,1,0|2,0,0]=4 65 B15R1.5387 CC(=O)Nc1ccc(c(c1)C)NC(=O)C CSC011221197 [0,1,0,0,1,0|2,0,0]=4 66 B15R1.12250 CC(C(=O)O)c1ccc(cc1)NC(=O)C CSC010002063 [0,1,0,0,1,0|2,0,0]=4 67 B15R1.12250 CN(C(=O)C)c1ccc(cc1)NC(=O)C CSC000012591 [0,1,0,0,1,0|2,0,0]=4 68 B17R1.1191 CNC(=O)COc1ccc(cc1)OCC(=C)C CSC027165477 [0,1,0,0,0,1|2,0,0]=4 69 B17R1.1191 COC(=O)COc1ccc(cc1)CCC(=O)C CSC000256977 [0,1,0,0,0,1|0,0,0]=2 70 B17R1.9288 CN(Cc1ccc(cc1)OCC(=O)O)C(=O)C CSC057776747 [0,1,0,0,0,1|2,0,0]=4 71 B17R1.1154 CC(=O)Nc1ccc(cc1)CCNC(=O)CN CSC057135252 [0,1,0,0,0,1|1,0,0]=3 72 B17R1.4793 CCC(=O)Nc1ccc(cc1)OCCC(=O)N CSC000784864 [0,1,0,0,0,1|2,0,0]=4 73 B17R1.4793 NCC(=O)Nc1ccc(cc1)OCCC(=O)N CSC000475092 [0,1,0,0,0,1|2,0,0]=4 74 B17R1.965 CC(=O)Nc1ccc(cc1)CNC(=O)CCN CSC000849441 [0,2,0,0,0,0|2,0,0]=4 75 B17R1.965 CCOC(=O)COc1ccc(cc1)NC(=O)C CSC000256972 [0,2,0,0,0,0|2,0,0]=4 76 B17R1.965 CCOC(=O)CSc1ccc(cc1)NC(=O)C CSC000257207 [0,2,0,0,0,0|2,0,0]=4 77 B17R1.965 CNCC(=O)NCc1ccc(cc1)NC(=O)C CSC000634710 [0,2,0,0,0,0|2,0,0]=4 78 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)OC CSC000439623 [0,2,0,0,0,0|2,0,0]=4 79 B17R1.1355 COC(=O)CCc1ccc(cc1)NC(=O)CN CSC057629663 [0,2,0,0,0,0|1,0,0]=3 80 B17R1.1355 COC(=O)COc1ccc(cc1)NC(=O)CN CSC000475103 [0,2,0,0,0,0|2,0,0]=4 81 B17R1.4792 CCC(=O)Nc1ccc(cc1)CC(C)C(=O)O CSC057055997 [0,2,0,0,0,0|2,0,0]=4 82 B17R1.1629 CCCC(=O)Nc1ccc(cc1)CCC(=O)O CSC006009832 [0,2,0,0,0,0|2,0,0]=4 83 B17R1.1629 COCC(=O)Nc1ccc(cc1)CCC(=O)O CSC006343686 [0,2,0,0,0,0|2,0,0]=4 84 B15R2.926 CC(=O)Nc1ccc2c(c1)CC(=O)N2 CSC000116762 [0,0,0,1,1,0|2,0,0]=4 85 B17R2.9611 NCC(=O)Nc1ccc2c(c1)NC(=O)CC2 CSC010364356 [0,1,0,1,0,0|2,0,0]=4 86 B13R1.74 CC(=O)c1ccc(cc1)OCC=C CSC000172053 [1,0,0,0,1,0|1,0,1]=4 87 B13R1.74 CCCCc1ccc(cc1)C(=O)N CSC000216912 [1,0,0,0,1,0|1,0,1]=4 88 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C CSC000152756 [0,0,0,0,2,0|1,0,0]=3 89 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N CSC000154964 [0,0,0,0,2,0|2,0,0]=4 90 B13R1.585 CC(=O)Nc1ccc(cc1)S(=O)C CSC000064362 [0,0,0,0,2,0|2,0,0]=4 91 B13R1.585 CC(=O)Oc1ccc(cc1)C(=O)N CSC000002065 [0,0,0,0,2,0|2,0,0]=4 92 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] CSC011218092 [0,0,0,0,1,1|2,0,0]=4 93 B15R1.1080 CC(=O)c1ccc(nc1)NCCC(=O)O CSC019827770 [0,0,0,0,1,1|2,0,0]=4 94 B15R1.1080 CC(C)CCOc1ccc(cc1)C(=O)C CSC000183935 [0,0,0,0,1,1|1,0,1]=4 95 B15R1.8936 CC(=O)NCc1ccnc(c1)NC(=O)C CSC061578767 [0,0,0,0,1,1|2,0,0]=4 96 B15R1.8936 CC(=O)Nc1cccc(c1)CCC(=O)O CSC012357783 [0,0,0,0,1,1|2,0,0]=4 97 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCCC(=O)O CSC000293852 [0,0,0,0,0,2|2,0,0]=4