0 B15R1.157 CCCCC(=O)NCCc1ccccc1 CSC000001554 [0,0,0,0,0,0|3,0,1]=4 1 B15R1.157 CCCCC(C)NCCc1ccccn1 CSC011340143 [0,0,0,0,0,0|3,0,0]=3 2 B15R1.157 CCCNC(=O)NCCc1ccccc1 CSC000163261 [0,0,0,0,0,0|3,0,1]=4 3 B15R1.157 CCCOC(=O)NCCc1ccccc1 CSC013037360 [0,0,0,0,0,0|2,0,1]=3 4 B15R1.157 CCOCC(C)NCCc1ccccn1 CSC011557346 [0,0,0,0,0,0|4,0,0]=4 5 B15R1.157 COCCC(C)NCCc1ccccc1 CSC011564158 [0,0,0,0,0,0|3,0,0]=3 6 B15R1.157 COCCN(C)CCCc1ccccc1 CSC027715109 [0,0,0,0,0,0|4,0,0]=4 7 B14R1.123 CCCCCCNCc1ccccc1 CSC000180837 [1,0,0,0,0,0|3,0,0]=4 8 B14R1.123 CCCNCCNCc1ccccc1 CSC011556071 [1,0,0,0,0,0|3,0,0]=4 9 B14R1.123 OCCOCCNCc1ccccc1 CSC000180863 [1,0,0,0,0,0|3,0,0]=4 10 B14R1.520 CCOC(=O)CCCc1ccccc1 CSC011295114 [1,0,0,0,0,0|2,0,1]=4 11 B16R1.1516 CCCNC(C)C(=O)NCc1ccccc1 CSC015399251 [0,1,0,0,0,0|3,0,0]=4 12 B16R1.4473 COCCC(C)NCCc1ccccc1F CSC005577979 [0,1,0,0,0,0|3,0,0]=4 13 B16R1.14049 CCCC(=O)N(C)CCCc1ccccc1 CSC000338872 [0,1,0,0,0,0|3,0,0]=4 14 B16R1.18213 CC(C)CCC(C)NCCc1ccccn1 CSC000259594 [0,1,0,0,0,0|3,0,0]=4 15 B16R2.71 CC1CNCCN1CCc2ccccc2 CSC011726131 [0,0,0,1,0,0|3,0,0]=4 16 B16R2.71 C[C@@H]1CNCCN1CCc2ccccc2 CSC013092120 [0,0,0,1,0,0|3,0,0]=4 17 B16R2.71 C[C@H]1CNCCN1CCc2ccccc2 CSC013037635 [0,0,0,1,0,0|3,0,0]=4 18 B16R2.317 CC1CN(C(CN1)C)Cc2ccccc2 CSC000692200 [0,0,0,1,0,0|3,0,0]=4 19 B16R2.2256 C(Cc1ccccc1)NC2CCCNC2 CSC011516355 [0,0,0,1,0,0|3,0,0]=4 20 B16R2.2256 C(Cc1ccccc1)NC2CCNCC2 CSC011396813 [0,0,0,1,0,0|3,0,0]=4 21 B16R2.2256 C(Cc1ccccc1)NC2CCOCC2 CSC000714549 [0,0,0,1,0,0|3,0,0]=4 22 B16R2.2256 C(Cc1ccccn1)NC2CCCCC2 CSC000177531 [0,0,0,1,0,0|3,0,0]=4 23 B16R2.2256 C(Cc1ccccn1)NC2CCCCC2 CSC000177531 [0,0,0,1,0,0|3,0,0]=4 24 B16R2.2256 C(Cc1ccncc1)NC2CCCCC2 CSC000177529 [0,0,0,1,0,0|3,0,0]=4 25 B16R2.2256 C(Cc1ccncc1)SC2CCCCC2 CSC037775952 [0,0,0,1,0,0|2,1,0]=4 26 B16R2.2256 C(NCc1ccccc1)C2CCCCC2 CSC000187296 [0,0,0,1,0,0|3,0,0]=4 27 B16R2.2256 C(NCc1ccccc1)C2CNCCO2 CSC011543576 [0,0,0,1,0,0|3,0,0]=4 28 B14R1.156 CCCCC(=O)OCc1ccccc1 CSC000000752 [0,0,0,0,1,0|2,0,1]=4 29 B14R1.156 CCCNC(=O)CCc1ccccc1 CSC000161725 [0,0,0,0,1,0|2,0,1]=4 30 B14R1.177 CCCCC(C)NCCc1cccs1 CSC011340204 [0,0,0,0,1,0|3,0,0]=4 31 B16R1.1465 CCCCC(C)NCCOc1ccccc1 CSC005549780 [0,0,0,0,0,1|2,0,0]=3 32 B16R1.1465 CCCCN(C)CCNCc1ccccc1 CSC011699254 [0,0,0,0,0,1|3,0,0]=4 33 B16R1.1465 CCOCC(C)NCCCc1ccccc1 CSC005573049 [0,0,0,0,0,1|3,0,0]=4 34 B16R1.1465 CCOCC(C)NCCOc1ccccc1 CSC005573218 [0,0,0,0,0,1|3,0,0]=4 35 B13R1.28 CCCCCCNc1ccccc1 CSC000219565 [2,0,0,0,0,0|2,0,0]=4 36 B13R1.28 CCCCCNCc1ccccc1 CSC000180875 [2,0,0,0,0,0|2,0,0]=4 37 B13R1.28 CCOCCSCc1ccccc1 CSC000006442 [2,0,0,0,0,0|2,0,0]=4 38 B13R1.718 CCC(=O)OCCc1ccccc1 CSC000024285 [2,0,0,0,0,0|1,0,1]=4 39 B13R1.718 CCC(C)NCCc1ccccc1 CSC000199858 [2,0,0,0,0,0|1,0,0]=3 40 B13R1.718 CCC(C)NCCc1ccccn1 CSC000177427 [2,0,0,0,0,0|2,0,0]=4 41 B15R1.35 CCCCCCCNCc1ccccc1 CSC000187258 [1,1,0,0,0,0|2,0,0]=4 42 B15R1.35 CCCCOCCNCc1ccccc1 CSC011426076 [1,1,0,0,0,0|2,0,0]=4 43 B15R1.138 CCCCCNCC(C)c1ccccc1 CSC000199936 [1,1,0,0,0,0|2,0,0]=4 44 B15R1.89 COCC(C)NCC(C)c1ccccc1 CSC000202100 [1,1,0,0,0,0|2,0,0]=4 45 B15R1.633 COCC(C)NCCc1cccc(c1)F CSC011695449 [1,1,0,0,0,0|2,0,0]=4 46 B15R1.826 CCCC(C)C(=O)NCc1ccccc1 CSC000153277 [1,1,0,0,0,0|2,0,0]=4 47 B15R1.1306 CCCC(CC)NCCc1ccccn1 CSC011608051 [1,1,0,0,0,0|2,0,0]=4 48 B15R1.115 CCCCN(C)CC(C)c1ccccc1 CSC029724375 [0,1,0,0,1,0|2,0,0]=4 49 B15R1.127 CC(CCc1cccc(c1)C)NCCO CSC011425870 [0,1,0,0,1,0|2,0,0]=4 50 B15R1.127 CCCCC(C)NCc1cccc(c1)O CSC011622243 [0,1,0,0,1,0|2,0,0]=4 51 B15R1.127 CCCNC(C)CCc1cccc(c1)C CSC011391199 [0,1,0,0,1,0|1,0,0]=3 52 B15R1.127 CCCNC(C)CCc1cccc(c1)F CSC011391196 [0,1,0,0,1,0|1,0,0]=3 53 B15R1.139 CCCNC(C)CCc1ccc(cc1)C CSC011391197 [0,1,0,0,1,0|1,0,0]=3 54 B15R1.139 CCCNC(C)CCc1ccc(cc1)F CSC011391198 [0,1,0,0,1,0|1,0,0]=3 55 B15R1.741 CCC(=O)NC(C)CCc1ccccc1 CSC000155385 [0,1,0,0,1,0|1,0,1]=4 56 B15R1.1208 CCCNC(C)CCc1ccccc1F CSC011391185 [0,1,0,0,1,0|1,0,0]=3 57 B15R1.5934 CC(C)(CCc1ccccc1)NCCN CSC013117041 [0,1,0,0,1,0|2,0,0]=4 58 B17R1.9781 CCCNC(C)C(=O)NCCc1ccccc1 CSC057476588 [0,1,0,0,0,1|2,0,0]=4 59 B17R1.1507 CCCCC(C)NCCc1ccc(cc1)OC CSC007788463 [0,2,0,0,0,0|2,0,0]=4 60 B15R2.31 CC1CCCN(C1)Cc2ccccc2 CSC000006979 [1,0,0,1,0,0|2,0,0]=4 61 B17R2.236 CCCNC1CCC(C1)Cc2ccccc2 CSC005873323 [0,0,0,1,0,1|2,0,0]=4 62 B17R2.2382 C(CC1CCCCC1)NCc2ccccc2 CSC011255920 [0,0,0,1,0,1|2,0,0]=4 63 B17R2.2382 C(CNC1CCCCC1)Cc2ccccc2 CSC000268400 [0,0,0,1,0,1|2,0,0]=4 64 B17R2.2382 C(COc1ccccc1)NC2CCCCC2 CSC000269322 [0,0,0,1,0,1|2,0,0]=4 65 B17R2.2382 C(Cc1ccccc1)NCC2CCCCC2 CSC017298573 [0,0,0,1,0,1|2,0,0]=4 66 B17R2.5365 CC1CN(C(CN1)C)CCc2ccccc2 CSC005909754 [0,0,0,1,0,1|2,0,0]=4 67 B17R2.216 Fc1ccc(cc1)CCNC2CCCCC2 CSC000268789 [0,1,0,1,0,0|2,0,0]=4 68 B17R2.216 NC1CCC(CC1)NCCc2ccccc2 CSC005625478 [0,1,0,1,0,0|2,0,0]=4 69 B17R2.5301 Fc1cccc(c1)CCNC2CCCCC2 CSC000271921 [0,1,0,1,0,0|2,0,0]=4 70 B17R2.19965 CC1CN(CCCO1)Cc2cccc(c2)N CSC005705259 [0,1,0,1,0,0|2,0,0]=4 71 B17R2.41855 CC1CN(C(CO1)C)Cc2cccc(c2)N CSC000349213 [0,1,0,1,0,0|2,0,0]=4 72 B17R2.30 CCCNC1CCC(CC1)c2ccccc2 CSC000268780 [0,1,0,1,0,0|2,0,0]=4 73 B17R2.2342 CC(CNC1CCCCC1)c2ccccc2 CSC000268397 [0,1,0,1,0,0|2,0,0]=4 74 B17R2.2342 CN(CCc1ccccc1)C2CCCCC2 CSC046257898 [0,1,0,1,0,0|2,0,0]=4 75 B17R2.2342 NC(CNC1CCCCC1)c2ccccc2 CSC005494803 [0,1,0,1,0,0|2,0,0]=4 76 B17R2.2342 OC(CNC1CCCCC1)c2ccccc2 CSC000251583 [0,1,0,1,0,0|2,0,0]=4 77 B17R2.3241 CC1CCC(C1)NCC(N)c2ccccc2 CSC006822774 [0,1,0,1,0,0|2,0,0]=4 78 B17R2.2069 CCCCC(C)NC1Cc2ccccc2C1 CSC005613101 [0,1,0,1,0,0|2,0,0]=4 79 B17R2.145 CC1CN(C(CO1)c2ccccc2)CCN CSC019878118 [0,1,0,1,0,0|2,0,0]=4 80 B17R2.262 NCC1CCCCN1CCc2ccccc2 CSC000301406 [0,1,0,1,0,0|2,0,0]=4 81 B13R1.42 CCCC(=O)OCc1ccccc1 CSC000000759 [1,0,0,0,1,0|1,0,1]=4 82 B13R1.42 CCCC(C)NCc1ccccc1 CSC000196585 [1,0,0,0,1,0|1,0,0]=3 83 B13R1.42 CCCC(O)CSc1ccccc1 CSC012179918 [1,0,0,0,1,0|2,0,0]=4 84 B13R1.42 CCOC(=O)CCc1ccccc1 CSC000170145 [1,0,0,0,1,0|1,0,1]=4 85 B13R1.42 CN(CCN)CCc1ccccc1 CSC011293287 [1,0,0,0,1,0|2,0,0]=4 86 B13R1.44 CCCCN(C)Cc1ccccc1 CSC000006983 [0,0,0,0,2,0|2,0,0]=4