0 B15R1.48 CCOC(=O)C(C)Sc1ccc(cc1)O AB24944 [0,0,0,0,0,0|2,0,0]=2 1 B14R1.60 CCOC(=O)C(Cc1ccccn1)N AB21681 [1,0,0,0,0,0|1,0,0]=2 2 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)Br AB18059 [1,0,0,0,0,0|2,0,0]=3 3 B14R1.134 COC(=O)[C@@H](Cc1ccc(cc1)N)N AB25031 [1,0,0,0,0,0|1,0,0]=2 4 B14R1.502 CCOC(=O)CCc1ccc(cc1)N MB04702 [1,0,0,0,0,0|1,0,0]=2 5 B14R1.502 CCOC(=O)COc1ccc(cc1)Br AB06130 [1,0,0,0,0,0|2,0,0]=3 6 B14R1.502 CCOC(=O)COc1ccc(cc1)C AB04789 [1,0,0,0,0,0|2,0,0]=3 7 B14R1.502 CCOC(=O)COc1ccc(cc1)Cl AB07801 [1,0,0,0,0,0|2,0,0]=3 8 B14R1.502 CCOC(=O)COc1ccc(cc1)F AB14478 [1,0,0,0,0,0|2,0,0]=3 9 B14R1.502 CCOC(=O)COc1ccc(cc1)I AB26118 [1,0,0,0,0,0|2,0,0]=3 10 B16R1.743 CCOC(=O)C(Cc1ccc(cc1)Cl)CN AB72200 [0,1,0,0,0,0|1,0,0]=2 11 B16R1.4958 CCOC(=O)C(Cc1ccc(cc1)OC)O AB28655 [0,1,0,0,0,0|1,0,0]=2 12 B16R1.4958 CCOC(=O)[C@@H](Cc1ccc(cc1)OC)O AB29311 [0,1,0,0,0,0|1,0,0]=2 13 B16R1.4958 CCOC(=O)[C@H](Cc1ccc(cc1)OC)O AB29314 [0,1,0,0,0,0|1,0,0]=2 14 B16R1.15339 CCOC(=O)[C@](C)(Cc1ccc(cc1)Br)N AB26160 [0,1,0,0,0,0|1,0,0]=2 15 B16R1.15339 CCOC(=O)[C@](C)(Cc1ccc(cc1)C)N AB26170 [0,1,0,0,0,0|1,0,0]=2 16 B16R1.15339 CCOC(=O)[C@](C)(Cc1ccc(cc1)Cl)N AB26162 [0,1,0,0,0,0|1,0,0]=2 17 B16R1.15339 CCOC(=O)[C@](C)(Cc1ccc(cc1)F)N AB26156 [0,1,0,0,0,0|1,0,0]=2 18 B16R2.1129 Cc1ccc(cc1)CC2C(=O)NCCN2 AB37839 [0,0,0,1,0,0|2,0,0]=3 19 B16R2.1129 Cc1ccc(cc1)C[C@@H]2C(=O)NCCN2 AB37845 [0,0,0,1,0,0|2,0,0]=3 20 B16R2.1129 Cc1ccc(cc1)C[C@H]2C(=O)NCCN2 AB37841 [0,0,0,1,0,0|2,0,0]=3 21 B16R2.1129 c1cc(ccc1CC2C(=O)NCCN2)Br AB37902 [0,0,0,1,0,0|2,0,0]=3 22 B16R2.1129 c1cc(ccc1CC2C(=O)NCCN2)Cl AB37885 [0,0,0,1,0,0|2,0,0]=3 23 B16R2.1129 c1cc(ccc1CC2C(=O)NCCN2)F AB37863 [0,0,0,1,0,0|2,0,0]=3 24 B16R2.1129 c1cc(ccc1C[C@@H]2C(=O)NCCN2)Br AB37909 [0,0,0,1,0,0|2,0,0]=3 25 B16R2.1129 c1cc(ccc1C[C@@H]2C(=O)NCCN2)Cl AB37889 [0,0,0,1,0,0|2,0,0]=3 26 B16R2.1129 c1cc(ccc1C[C@@H]2C(=O)NCCN2)F AB37869 [0,0,0,1,0,0|2,0,0]=3 27 B16R2.1129 c1cc(ccc1C[C@H]2C(=O)NCCN2)Br AB37906 [0,0,0,1,0,0|2,0,0]=3 28 B16R2.1129 c1cc(ccc1C[C@H]2C(=O)NCCN2)Cl AB37888 [0,0,0,1,0,0|2,0,0]=3 29 B16R2.1129 c1cc(ccc1C[C@H]2C(=O)NCCN2)F AB37865 [0,0,0,1,0,0|2,0,0]=3 30 B14R1.35 CCOC(=O)C(=O)c1ccc(cc1)Br AB26265 [0,0,0,0,1,0|2,0,1]=4 31 B14R1.35 CCOC(=O)C(c1ccc(cc1)N)Br AB66086 [0,0,0,0,1,0|2,0,0]=3 32 B14R1.35 CCOC(=O)C(c1ccc(cn1)C)N AB21630 [0,0,0,0,1,0|2,0,0]=3 33 B13R1.135 COC(=O)C(Cc1ccccc1)N AB01980 [2,0,0,0,0,0|0,0,0]=2 34 B13R1.135 COC(=O)[C@H](Cc1ccccc1)N AB01100 [2,0,0,0,0,0|0,0,0]=2 35 B13R1.14 COC(=O)CCc1ccc(cc1)Br AB55324 [2,0,0,0,0,0|1,0,0]=3 36 B13R1.133 Cc1ccc(cc1)CC(C(=O)O)N AB21662 [2,0,0,0,0,0|1,0,0]=3 37 B13R1.133 Cc1ccc(cc1)C[C@@H](C(=O)O)N AB01742 [2,0,0,0,0,0|1,0,0]=3 38 B13R1.133 c1cc(ccc1CC(C(=O)O)N)Br AB00237 [2,0,0,0,0,0|1,0,0]=3 39 B13R1.133 c1cc(ccc1CC(C(=O)O)N)Cl AB00241 [2,0,0,0,0,0|1,0,0]=3 40 B13R1.133 c1cc(ccc1CC(C(=O)O)N)F AB00239 [2,0,0,0,0,0|1,0,0]=3 41 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)Br AB02494 [2,0,0,0,0,0|1,0,0]=3 42 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)Cl AB02502 [2,0,0,0,0,0|1,0,0]=3 43 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)O AB00245 [2,0,0,0,0,0|0,0,0]=2 44 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)Cl AB03058 [2,0,0,0,0,0|1,0,0]=3 45 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)F AB02498 [2,0,0,0,0,0|1,0,0]=3 46 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)O AB02505 [2,0,0,0,0,0|0,0,0]=2 47 B15R1.3960 CCOC(=O)C(Cc1ccccc1C)N AB21680 [1,1,0,0,0,0|0,0,0]=2 48 B15R1.10540 CCOC(=O)[C@@](C)(Cc1ccccc1)O AB21892 [1,1,0,0,0,0|1,0,0]=3 49 B15R1.10540 CCOC(=O)[C@](C)(Cc1ccccc1)O AB21890 [1,1,0,0,0,0|1,0,0]=3 50 B15R1.793 CCOC(=O)CCc1ccc(cc1)C#N MB05758 [1,1,0,0,0,0|1,0,0]=3 51 B15R1.793 CCOC(=O)CCc1ccc(cc1)C=O MB05765 [1,1,0,0,0,0|0,0,1]=3 52 B15R1.793 CCOC(=O)COc1ccc(cc1)C#N AB09718 [1,1,0,0,0,0|2,0,0]=4 53 B15R1.793 CCOC(=O)COc1ccc(cc1)OC AB05981 [1,1,0,0,0,0|1,0,0]=3 54 B15R1.3956 CCOC(=O)C(c1cc(c(cn1)Cl)Cl)N AB70226 [0,1,0,0,1,0|2,0,0]=4 55 B17R1.8694 CCOc1ccc(cc1)SC(C)C(=O)OCC AB24987 [0,2,0,0,0,0|2,0,0]=4 56 B17R1.127470 CCOC(=O)[C@](C)(Cc1ccc(cc1)OC)N AB26169 [0,2,0,0,0,0|0,0,0]=2 57 B15R2.38 c1cc(cnc1)CC2C(=O)NCCN2 AB38225 [1,0,0,1,0,0|2,0,0]=4 58 B15R2.38 c1cc(cnc1)C[C@@H]2C(=O)NCCN2 AB38232 [1,0,0,1,0,0|2,0,0]=4 59 B15R2.38 c1cc(cnc1)C[C@H]2C(=O)NCCN2 AB38228 [1,0,0,1,0,0|2,0,0]=4 60 B15R2.38 c1ccc(cc1)CC2C(=O)NCCN2 AB37816 [1,0,0,1,0,0|1,0,0]=3 61 B15R2.38 c1ccc(cc1)C[C@H]2C(=O)NCCN2 AB37824 [1,0,0,1,0,0|1,0,0]=3 62 B15R2.38 c1ccnc(c1)CC2C(=O)NCCN2 AB38221 [1,0,0,1,0,0|2,0,0]=4 63 B15R2.38 c1ccnc(c1)C[C@@H]2C(=O)NCCN2 AB38224 [1,0,0,1,0,0|2,0,0]=4 64 B15R2.38 c1ccnc(c1)C[C@H]2C(=O)NCCN2 AB38223 [1,0,0,1,0,0|2,0,0]=4 65 B15R2.38 c1cnccc1CC2C(=O)NCCN2 AB38234 [1,0,0,1,0,0|2,0,0]=4 66 B15R2.38 c1cnccc1C[C@@H]2C(=O)NCCN2 AB38238 [1,0,0,1,0,0|2,0,0]=4 67 B15R2.38 c1cnccc1C[C@H]2C(=O)NCCN2 AB38235 [1,0,0,1,0,0|2,0,0]=4 68 B17R2.6194 CCOC(=O)C1Cc2cc(ccc2CN1)O PB28266 [0,0,0,1,0,1|1,0,0]=3 69 B17R2.6194 CCOC(=O)C1Cc2cc(ccc2OC1)Cl AB18679 [0,0,0,1,0,1|2,0,0]=4 70 B17R2.49831 CCOC(=O)C1CCc2cc(ccc2N1)O AB27569 [0,1,0,1,0,0|2,0,0]=4 71 B17R2.79 CCc1ccc(cc1)CC2C(=O)NCCN2 AB37979 [0,1,0,1,0,0|2,0,0]=4 72 B17R2.79 CCc1ccc(cc1)C[C@@H]2C(=O)NCCN2 AB37981 [0,1,0,1,0,0|2,0,0]=4 73 B17R2.79 CCc1ccc(cc1)C[C@H]2C(=O)NCCN2 AB37980 [0,1,0,1,0,0|2,0,0]=4 74 B17R2.79 COc1ccc(cc1)CC2C(=O)NCCN2 AB37949 [0,1,0,1,0,0|1,0,0]=3 75 B17R2.79 COc1ccc(cc1)C[C@@H]2C(=O)NCCN2 AB37956 [0,1,0,1,0,0|1,0,0]=3 76 B17R2.79 COc1ccc(cc1)C[C@H]2C(=O)NCCN2 AB37952 [0,1,0,1,0,0|1,0,0]=3 77 B17R2.5115 c1cc(c(cc1CC2C(=O)NCCN2)Cl)Cl AB38091 [0,1,0,1,0,0|2,0,0]=4 78 B17R2.5115 c1cc(c(cc1CC2C(=O)NCCN2)F)F AB38045 [0,1,0,1,0,0|2,0,0]=4 79 B17R2.5115 c1cc(c(cc1C[C@@H]2C(=O)NCCN2)Cl)Cl AB38093 [0,1,0,1,0,0|2,0,0]=4 80 B17R2.5115 c1cc(c(cc1C[C@@H]2C(=O)NCCN2)F)F AB38048 [0,1,0,1,0,0|2,0,0]=4 81 B17R2.5115 c1cc(c(cc1C[C@H]2C(=O)NCCN2)Cl)Cl AB38092 [0,1,0,1,0,0|2,0,0]=4 82 B17R2.5115 c1cc(c(cc1C[C@H]2C(=O)NCCN2)F)F AB38047 [0,1,0,1,0,0|2,0,0]=4 83 B17R2.42570 c1cc(c(cc1Cl)Cl)CC2C(=O)NCCN2 AB38065 [0,1,0,1,0,0|2,0,0]=4 84 B17R2.42570 c1cc(c(cc1Cl)Cl)C[C@@H]2C(=O)NCCN2 AB38072 [0,1,0,1,0,0|2,0,0]=4 85 B17R2.42570 c1cc(c(cc1Cl)Cl)C[C@H]2C(=O)NCCN2 AB38069 [0,1,0,1,0,0|2,0,0]=4 86 B17R2.42570 c1cc(c(cc1F)F)CC2C(=O)NCCN2 AB38027 [0,1,0,1,0,0|2,0,0]=4 87 B17R2.42570 c1cc(c(cc1F)F)C[C@@H]2C(=O)NCCN2 AB38031 [0,1,0,1,0,0|2,0,0]=4 88 B17R2.42570 c1cc(c(cc1F)F)C[C@H]2C(=O)NCCN2 AB38028 [0,1,0,1,0,0|2,0,0]=4 89 B13R1.47 CCOC(=O)C(c1ccccn1)N PB12827 [1,0,0,0,1,0|1,0,0]=3 90 B13R1.21 COC(=O)C(c1ccc(cc1)N)Br AB66082 [1,0,0,0,1,0|2,0,0]=4 91 B13R1.21 COC(=O)[C@H](c1ccc(cc1)F)N AB48592 [1,0,0,0,1,0|1,0,0]=3