0 B15R2.7137 Cn1c(cnc1Cl)c2ccc[n+](c2)[O-] 271570a_100000070314_100009815978 [0,0,0,0,0,0|2,0,2]=4 1 B14R2.22 C[n+]1cccc(c1)C2=CC(=O)CC2 271570a_100010737933_100009996589 [1,0,0,0,0,0|2,0,1]=4 2 B14R2.22 O=C1C=C(CC1)c2c[n+](ccn2)[O-] 271570a_100010737933_100009880115 [1,0,0,0,0,0|2,0,1]=4 3 B14R2.22 O=C1C=C(CC1)c2ccc[n+](c2)[O-] 271570a_100010737933_100009815978 [1,0,0,0,0,0|1,0,1]=3 4 B14R2.269 CN1CCCC1c2cccc(c2)Br 2230a_100015187783_200000210301 [1,0,0,0,0,0|2,0,1]=4 5 B14R2.269 CN1CCCC1c2cccc(c2)Br 269982a_100015187783_200000210301 [1,0,0,0,0,0|2,0,1]=4 6 B14R2.269 CN1CCCC1c2cccc(c2)Br 34a_100015187783_200000210301 [1,0,0,0,0,0|2,0,1]=4 7 B14R2.269 CN1CCCC1c2cccc(c2)Cl 2230a_100000741648_200000210301 [1,0,0,0,0,0|2,0,1]=4 8 B14R2.269 CN1CCCC1c2cccc(c2)Cl 269982a_100000741648_200000210301 [1,0,0,0,0,0|2,0,1]=4 9 B14R2.269 CN1CCCC1c2cccc(c2)Cl 34a_100000741648_200000210301 [1,0,0,0,0,0|2,0,1]=4 10 B14R2.269 CN1CCCC1c2cccc(c2)F 2230a_100000742875_200000210301 [1,0,0,0,0,0|2,0,1]=4 11 B14R2.269 CN1CCCC1c2cccc(c2)F 269982a_100000742875_200000210301 [1,0,0,0,0,0|2,0,1]=4 12 B14R2.269 CN1CCCC1c2cccc(c2)F 34a_100000742875_200000210301 [1,0,0,0,0,0|2,0,1]=4 13 B14R2.269 Cc1cccc(c1)C2CCCN2C 2230a_100000741861_200000210301 [1,0,0,0,0,0|2,0,1]=4 14 B14R2.269 Cc1cccc(c1)C2CCCN2C 269982a_100000741861_200000210301 [1,0,0,0,0,0|2,0,1]=4 15 B14R2.269 Cc1cccc(c1)C2CCCN2C 34a_100000741861_200000210301 [1,0,0,0,0,0|2,0,1]=4 16 B14R2.269 Cc1cccc(c1)C2CCCN2[13CH3] 2230a_100000741861_200025704644 [1,0,0,0,0,0|2,0,1]=4 17 B14R2.269 Cc1cccc(c1)C2CCCN2[13CH3] 269982a_100000741861_200025704644 [1,0,0,0,0,0|2,0,1]=4 18 B14R2.269 Cc1cccc(c1)C2CCCN2[13CH3] 34a_100000741861_200025704644 [1,0,0,0,0,0|2,0,1]=4 19 B14R2.269 Cn1cccc1c2ccc[n+](c2)[O-] 271570a_100000068268_100009815978 [1,0,0,0,0,0|0,0,3]=4 20 B14R2.269 Cn1cncc1c2ccc[n+](c2)[O-] 271570a_100009892668_100009815978 [1,0,0,0,0,0|1,0,2]=4 21 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Br 2230a_100015187783_200025704644 [1,0,0,0,0,0|2,0,1]=4 22 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Br 269982a_100015187783_200025704644 [1,0,0,0,0,0|2,0,1]=4 23 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Br 34a_100015187783_200025704644 [1,0,0,0,0,0|2,0,1]=4 24 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Cl 2230a_100000741648_200025704644 [1,0,0,0,0,0|2,0,1]=4 25 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Cl 269982a_100000741648_200025704644 [1,0,0,0,0,0|2,0,1]=4 26 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Cl 34a_100000741648_200025704644 [1,0,0,0,0,0|2,0,1]=4 27 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)F 2230a_100000742875_200025704644 [1,0,0,0,0,0|2,0,1]=4 28 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)F 269982a_100000742875_200025704644 [1,0,0,0,0,0|2,0,1]=4 29 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)F 34a_100000742875_200025704644 [1,0,0,0,0,0|2,0,1]=4 30 B14R1.135 CCC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000742827 [0,0,1,0,0,0|2,0,0]=3 31 B14R1.135 CCC(=O)C(C)Sc1c[n+](ccn1)[O-] 62a_100000742827_100009880115 [0,0,1,0,0,0|3,0,0]=4 32 B14R1.135 CCC(=O)C(C)Sc1ccc[n+](c1)C 62a_100000742827_100009996589 [0,0,1,0,0,0|3,0,0]=4 33 B14R1.135 CCC(=O)C(C)Sc1ccc[n+](c1)C 62a_100009996589_100000742827 [0,0,1,0,0,0|3,0,0]=4 34 B14R1.135 CCC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100000742827_100009815978 [0,0,1,0,0,0|2,0,0]=3 35 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)C 11a_106354213154_100000210414 [0,0,1,0,0,0|3,0,0]=4 36 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)C 240690a_106354213154_100000210414 [0,0,1,0,0,0|3,0,0]=4 37 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)C 527a_106354213154_100000210414 [0,0,1,0,0,0|3,0,0]=4 38 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)Cl 11a_100102954512_100000210414 [0,0,1,0,0,0|3,0,0]=4 39 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)Cl 1626a_100102954512_100000210414 [0,0,1,0,0,0|3,0,0]=4 40 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)Cl 240690a_100102954512_100000210414 [0,0,1,0,0,0|3,0,0]=4 41 B14R1.135 CCC(=O)N(C)Cc1cc(ccn1)Cl 527a_100102954512_100000210414 [0,0,1,0,0,0|3,0,0]=4 42 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000210414 [0,0,1,0,0,0|2,0,0]=3 43 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000210414 [0,0,1,0,0,0|2,0,0]=3 44 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000210414 [0,0,1,0,0,0|2,0,0]=3 45 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000210414 [0,0,1,0,0,0|2,0,0]=3 46 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100000210414 [0,0,1,0,0,0|2,0,0]=3 47 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100000210414 [0,0,1,0,0,0|2,0,0]=3 48 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100000210414 [0,0,1,0,0,0|2,0,0]=3 49 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100000210414 [0,0,1,0,0,0|2,0,0]=3 50 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000210414 [0,0,1,0,0,0|2,0,0]=3 51 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000210414 [0,0,1,0,0,0|2,0,0]=3 52 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000210414 [0,0,1,0,0,0|2,0,0]=3 53 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000210414 [0,0,1,0,0,0|2,0,0]=3 54 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000210414 [0,0,1,0,0,0|2,0,0]=3 55 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000210414 [0,0,1,0,0,0|2,0,0]=3 56 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000210414 [0,0,1,0,0,0|2,0,0]=3 57 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000210414 [0,0,1,0,0,0|2,0,0]=3 58 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000210414 [0,0,1,0,0,0|1,0,1]=3 59 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000210414 [0,0,1,0,0,0|1,0,1]=3 60 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)Br 11a_106354212997_100000210414 [0,0,1,0,0,0|3,0,0]=4 61 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)Br 1626a_106354212997_100000210414 [0,0,1,0,0,0|3,0,0]=4 62 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)Br 240690a_106354212997_100000210414 [0,0,1,0,0,0|3,0,0]=4 63 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)Br 527a_106354212997_100000210414 [0,0,1,0,0,0|3,0,0]=4 64 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)C 11a_100000687132_100000210414 [0,0,1,0,0,0|3,0,0]=4 65 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)C 1626a_100000687132_100000210414 [0,0,1,0,0,0|3,0,0]=4 66 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)C 240690a_100000687132_100000210414 [0,0,1,0,0,0|3,0,0]=4 67 B14R1.135 CCC(=O)N(C)Cc1cccc(n1)C 527a_100000687132_100000210414 [0,0,1,0,0,0|3,0,0]=4 68 B14R1.135 CCC(=O)N(C)Cc1cncc(c1)Br 11a_103549770560_100000210414 [0,0,1,0,0,0|3,0,0]=4 69 B14R1.135 CCC(=O)N(C)Cc1cncc(c1)Br 240690a_103549770560_100000210414 [0,0,1,0,0,0|3,0,0]=4 70 B14R1.135 CCC(=O)N(C)Cc1cncc(c1)Br 527a_103549770560_100000210414 [0,0,1,0,0,0|3,0,0]=4 71 B14R1.135 CN(Cc1cccc(c1)Br)C(=O)CO 240690a_100000187585_100000210174 [0,0,1,0,0,0|3,0,0]=4 72 B14R1.135 CN(Cc1cccc(c1)Br)C(=O)CO 527a_100000187585_100000210174 [0,0,1,0,0,0|3,0,0]=4 73 B14R1.135 CN(Cc1cccc(c1)Cl)C(=O)CO 240690a_100020629429_100000210174 [0,0,1,0,0,0|3,0,0]=4 74 B14R1.135 CN(Cc1cccc(c1)Cl)C(=O)CO 527a_100020629429_100000210174 [0,0,1,0,0,0|3,0,0]=4 75 B14R1.135 CN(Cc1cccc(c1)F)C(=O)CO 240690a_100000184398_100000210174 [0,0,1,0,0,0|3,0,0]=4 76 B14R1.135 CN(Cc1cccc(c1)F)C(=O)CO 527a_100000184398_100000210174 [0,0,1,0,0,0|3,0,0]=4 77 B14R1.135 CN(Cc1cccc(c1)O)C(=O)CO 240690a_100000207540_100000210174 [0,0,1,0,0,0|2,0,1]=4 78 B14R1.135 CN(Cc1cccc(c1)O)C(=O)CO 527a_100000207540_100000210174 [0,0,1,0,0,0|2,0,1]=4 79 B14R1.135 CNC(=O)C(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100000731044 [0,0,1,0,0,0|3,0,0]=4 80 B14R1.135 CNC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000209862 [0,0,1,0,0,0|3,0,0]=4 81 B14R1.135 CNC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100000209862_100009815978 [0,0,1,0,0,0|3,0,0]=4 82 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Br 2708a_100102657272_100000187585 [0,0,1,0,0,0|3,0,0]=4 83 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Br 273464a_100102657272_100000187585 [0,0,1,0,0,0|3,0,0]=4 84 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)C 2708a_100102657272_102495364743 [0,0,1,0,0,0|3,0,0]=4 85 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)C 273464a_100102657272_102495364743 [0,0,1,0,0,0|3,0,0]=4 86 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Cl 2708a_100102657272_100020629429 [0,0,1,0,0,0|3,0,0]=4 87 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Cl 273464a_100102657272_100020629429 [0,0,1,0,0,0|3,0,0]=4 88 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)F 2708a_100102657272_100000184398 [0,0,1,0,0,0|3,0,0]=4 89 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)F 273464a_100102657272_100000184398 [0,0,1,0,0,0|3,0,0]=4 90 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)O 2708a_100102657272_100000207540 [0,0,1,0,0,0|2,0,1]=4 91 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)O 273464a_100102657272_100000207540 [0,0,1,0,0,0|2,0,1]=4 92 B14R1.135 COC(=O)C(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100000211248 [0,0,1,0,0,0|3,0,0]=4 93 B14R1.135 COC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000211248 [0,0,1,0,0,0|3,0,0]=4 94 B14R1.135 COC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100000211248_100009815978 [0,0,1,0,0,0|3,0,0]=4 95 B14R1.135 Cc1cccc(c1)CN(C)C(=O)CO 240690a_102495364743_100000210174 [0,0,1,0,0,0|3,0,0]=4 96 B14R1.135 Cc1cccc(c1)CN(C)C(=O)CO 527a_102495364743_100000210174 [0,0,1,0,0,0|3,0,0]=4 97 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 11a_100025717457_100015343762 [0,0,1,0,0,0|2,0,0]=3 98 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 1626a_100025717457_100015343762 [0,0,1,0,0,0|2,0,0]=3 99 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 240690a_100025717457_100015343762 [0,0,1,0,0,0|2,0,0]=3 100 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 527a_100025717457_100103153847 [0,0,1,0,0,0|2,0,0]=3 101 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 11a_100000231114_100015343762 [0,0,1,0,0,0|2,0,0]=3 102 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 1626a_100000231114_100015343762 [0,0,1,0,0,0|2,0,0]=3 103 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 240690a_100000231114_100015343762 [0,0,1,0,0,0|2,0,0]=3 104 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 527a_100000231114_100103153847 [0,0,1,0,0,0|2,0,0]=3 105 B14R1.1025 CCC(=O)CCCc1cccc(c1)Br 1458a_100000210414_100011713683 [0,0,1,0,0,0|3,0,0]=4 106 B14R1.1025 CCC(=O)CCCc1cccc(c1)Br 1458a_100000685939_100000210202 [0,0,1,0,0,0|3,0,0]=4 107 B14R1.1025 CCC(=O)CCCc1cccc(c1)F 1458a_100000210414_200000698031 [0,0,1,0,0,0|3,0,0]=4 108 B14R1.1025 CCC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000747405 [0,0,1,0,0,0|2,0,0]=3 109 B14R1.1025 CNC(=O)CCCc1cccc(c1)Br 11a_106832991635_100000685939 [0,0,1,0,0,0|2,0,0]=3 110 B14R1.1025 CNC(=O)CCCc1cccc(c1)Br 1626a_100102657272_100000685939 [0,0,1,0,0,0|2,0,0]=3 111 B14R1.1025 CNC(=O)CCCc1cccc(c1)Br 240690a_100102657272_100000685939 [0,0,1,0,0,0|2,0,0]=3 112 B14R1.1025 CNC(=O)CCCc1cccc(c1)Br 527a_100102657272_100000685939 [0,0,1,0,0,0|2,0,0]=3 113 B14R1.1025 CNC(=O)CCNc1c[n+](ccn1)[O-] 27a_100000738227_100009880115 [0,0,1,0,0,0|2,0,0]=3 114 B14R1.1025 CNC(=O)CCNc1cccc(c1)Br 34a_100000210019_100012179268 [0,0,1,0,0,0|3,0,0]=4 115 B14R1.1025 CNC(=O)CCNc1cccc(c1)C 2230a_100000188690_100000737683 [0,0,1,0,0,0|3,0,0]=4 116 B14R1.1025 CNC(=O)CCNc1cccc(c1)C 34a_100000188690_100012179268 [0,0,1,0,0,0|3,0,0]=4 117 B14R1.1025 CNC(=O)CCNc1cccc(c1)Cl 34a_100000185859_100012179268 [0,0,1,0,0,0|3,0,0]=4 118 B14R1.1025 CNC(=O)CCNc1cccc(c1)F 34a_100000210047_100012179268 [0,0,1,0,0,0|3,0,0]=4 119 B14R1.1025 CNC(=O)CCNc1cccc(c1)I 34a_100000211102_100012179268 [0,0,1,0,0,0|3,0,0]=4 120 B14R1.1025 CNC(=O)CCNc1cccc(c1)O 34a_100000210217_100012179268 [0,0,1,0,0,0|2,0,1]=4 121 B14R1.1025 CNC(=O)CCOc1ccc[n+](c1)[O-] 34a_100000039713_100012179268 [0,0,1,0,0,0|1,0,0]=2 122 B14R1.1025 CNC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000737683 [0,0,1,0,0,0|1,0,0]=2 123 B14R1.1025 CNC(=O)CCOc1cccc(c1)Br 240690a_100102657272_100000183437 [0,0,1,0,0,0|3,0,0]=4 124 B14R1.1025 CNC(=O)CCOc1cccc(c1)Br 34a_100000210342_100012179268 [0,0,1,0,0,0|3,0,0]=4 125 B14R1.1025 CNC(=O)CCOc1cccc(c1)Br 7a_100000210342_100000737683 [0,0,1,0,0,0|3,0,0]=4 126 B14R1.1025 CNC(=O)CCOc1cccc(c1)C 11a_106832991635_100000182325 [0,0,1,0,0,0|3,0,0]=4 127 B14R1.1025 CNC(=O)CCOc1cccc(c1)C 1626a_100102657272_100000182325 [0,0,1,0,0,0|3,0,0]=4 128 B14R1.1025 CNC(=O)CCOc1cccc(c1)C 240690a_100102657272_100000182325 [0,0,1,0,0,0|3,0,0]=4 129 B14R1.1025 CNC(=O)CCOc1cccc(c1)C 34a_100000210337_100012179268 [0,0,1,0,0,0|3,0,0]=4 130 B14R1.1025 CNC(=O)CCOc1cccc(c1)C 7a_100000210337_100000737683 [0,0,1,0,0,0|3,0,0]=4 131 B14R1.1025 CNC(=O)CCOc1cccc(c1)Cl 1626a_100102657272_100000738917 [0,0,1,0,0,0|3,0,0]=4 132 B14R1.1025 CNC(=O)CCOc1cccc(c1)Cl 240690a_100102657272_100000738917 [0,0,1,0,0,0|3,0,0]=4 133 B14R1.1025 CNC(=O)CCOc1cccc(c1)Cl 34a_100000210295_100012179268 [0,0,1,0,0,0|3,0,0]=4 134 B14R1.1025 CNC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100000737683 [0,0,1,0,0,0|3,0,0]=4 135 B14R1.1025 CNC(=O)CCOc1cccc(c1)F 11a_106832991635_100000737089 [0,0,1,0,0,0|3,0,0]=4 136 B14R1.1025 CNC(=O)CCOc1cccc(c1)F 1626a_100102657272_100000737089 [0,0,1,0,0,0|3,0,0]=4 137 B14R1.1025 CNC(=O)CCOc1cccc(c1)F 240690a_100102657272_100000737089 [0,0,1,0,0,0|3,0,0]=4 138 B14R1.1025 CNC(=O)CCOc1cccc(c1)F 34a_100000210426_100012179268 [0,0,1,0,0,0|3,0,0]=4 139 B14R1.1025 CNC(=O)CCOc1cccc(c1)F 7a_100000210426_100000737683 [0,0,1,0,0,0|3,0,0]=4 140 B14R1.1025 CNC(=O)CCOc1cccc(c1)I 34a_100000211634_100012179268 [0,0,1,0,0,0|3,0,0]=4 141 B14R1.1025 CNC(=O)CCOc1cccc(c1)I 7a_100000211634_100000737683 [0,0,1,0,0,0|3,0,0]=4 142 B14R1.1025 CNC(=O)CCOc1cccc(c1)N 34a_100000210217_100012179268 [0,0,1,0,0,0|3,0,0]=4 143 B14R1.1025 CNC(=O)CCSc1c[n+](ccn1)[O-] 62a_100000737683_100009880115 [0,0,1,0,0,0|2,0,0]=3 144 B14R1.1025 CNC(=O)CCSc1ccc[n+](c1)C 62a_100000737683_100009996589 [0,0,1,0,0,0|2,0,0]=3 145 B14R1.1025 CNC(=O)CCSc1ccc[n+](c1)C 62a_100009996589_100000737683 [0,0,1,0,0,0|2,0,0]=3 146 B14R1.1025 CNC(=O)CCSc1ccc[n+](c1)[O-] 62a_100000737683_100009815978 [0,0,1,0,0,0|1,0,0]=2 147 B14R1.1025 CNC(=O)CCSc1cccc(c1)Br 62a_100000691529_100000737683 [0,0,1,0,0,0|3,0,0]=4 148 B14R1.1025 CNC(=O)CCSc1cccc(c1)Br 62a_100000737683_100000691529 [0,0,1,0,0,0|3,0,0]=4 149 B14R1.1025 CNC(=O)CCSc1cccc(c1)C 62a_100000737683_100011215228 [0,0,1,0,0,0|3,0,0]=4 150 B14R1.1025 CNC(=O)CCSc1cccc(c1)C 62a_100011215228_100000737683 [0,0,1,0,0,0|3,0,0]=4 151 B14R1.1025 CNC(=O)CCSc1cccc(c1)Cl 62a_100000699651_100000737683 [0,0,1,0,0,0|3,0,0]=4 152 B14R1.1025 CNC(=O)CCSc1cccc(c1)Cl 62a_100000737683_100000699651 [0,0,1,0,0,0|3,0,0]=4 153 B14R1.1025 CNC(=O)CCSc1cccc(c1)F 62a_100000685547_100000737683 [0,0,1,0,0,0|3,0,0]=4 154 B14R1.1025 CNC(=O)CCSc1cccc(c1)F 62a_100000737683_100000685547 [0,0,1,0,0,0|3,0,0]=4 155 B14R1.1025 CNC(=O)CCSc1cccc(c1)N 62a_100000210019_100000737683 [0,0,1,0,0,0|3,0,0]=4 156 B14R1.1025 CNC(=O)CCSc1cccc(c1)N 62a_100000737683_100000210019 [0,0,1,0,0,0|3,0,0]=4 157 B14R1.1025 CNC(=O)CCSc1cccc(c1)O 62a_100000737683_100000211634 [0,0,1,0,0,0|2,0,1]=4 158 B14R1.1025 CNC(=O)CCSc1cccc(c1)[S] 62a_100000737683_114929384022 [0,0,1,0,0,0|2,1,0]=4 159 B14R1.1025 CNC(=O)CCSc1cccc(c1)[S] 62a_114929384022_100000737683 [0,0,1,0,0,0|2,1,0]=4 160 B14R1.1025 CNC(=O)CNCc1cccc(c1)Br 207a_100000693194_100000210085 [0,0,1,0,0,0|3,0,0]=4 161 B14R1.1025 CNC(=O)CNCc1cccc(c1)Br 2230a_100000174977_100000183359 [0,0,1,0,0,0|3,0,0]=4 162 B14R1.1025 CNC(=O)CNCc1cccc(c1)Br 2230a_100000693194_100000698116 [0,0,1,0,0,0|3,0,0]=4 163 B14R1.1025 CNC(=O)CNCc1cccc(c1)Br 270004a_100000693194_100000210085 [0,0,1,0,0,0|3,0,0]=4 164 B14R1.1025 CNC(=O)CNCc1cccc(c1)Br 34a_100000174977_100000183359 [0,0,1,0,0,0|3,0,0]=4 165 B14R1.1025 CNC(=O)CNCc1cccc(c1)C 207a_100000693194_100000211157 [0,0,1,0,0,0|3,0,0]=4 166 B14R1.1025 CNC(=O)CNCc1cccc(c1)C 2230a_100000185548_100000183359 [0,0,1,0,0,0|3,0,0]=4 167 B14R1.1025 CNC(=O)CNCc1cccc(c1)C 2230a_100000693194_100000211840 [0,0,1,0,0,0|3,0,0]=4 168 B14R1.1025 CNC(=O)CNCc1cccc(c1)C 270004a_100000693194_100000211157 [0,0,1,0,0,0|3,0,0]=4 169 B14R1.1025 CNC(=O)CNCc1cccc(c1)C 34a_100000185548_100000183359 [0,0,1,0,0,0|3,0,0]=4 170 B14R1.1025 CNC(=O)CNCc1cccc(c1)Cl 207a_100000693194_100000210801 [0,0,1,0,0,0|3,0,0]=4 171 B14R1.1025 CNC(=O)CNCc1cccc(c1)Cl 2230a_100000174878_100000183359 [0,0,1,0,0,0|3,0,0]=4 172 B14R1.1025 CNC(=O)CNCc1cccc(c1)Cl 2230a_100000693194_100000181238 [0,0,1,0,0,0|3,0,0]=4 173 B14R1.1025 CNC(=O)CNCc1cccc(c1)Cl 270004a_100000693194_100000210801 [0,0,1,0,0,0|3,0,0]=4 174 B14R1.1025 CNC(=O)CNCc1cccc(c1)Cl 34a_100000174878_100000183359 [0,0,1,0,0,0|3,0,0]=4 175 B14R1.1025 CNC(=O)CNCc1cccc(c1)F 207a_100000693194_100000210812 [0,0,1,0,0,0|3,0,0]=4 176 B14R1.1025 CNC(=O)CNCc1cccc(c1)F 2230a_100000174948_100000183359 [0,0,1,0,0,0|3,0,0]=4 177 B14R1.1025 CNC(=O)CNCc1cccc(c1)F 2230a_100000693194_100000230114 [0,0,1,0,0,0|3,0,0]=4 178 B14R1.1025 CNC(=O)CNCc1cccc(c1)F 270004a_100000693194_100000210812 [0,0,1,0,0,0|3,0,0]=4 179 B14R1.1025 CNC(=O)CNCc1cccc(c1)F 34a_100000174948_100000183359 [0,0,1,0,0,0|3,0,0]=4 180 B14R1.1025 CNC(=O)CNCc1cccc(c1)I 207a_100000693194_100000014684 [0,0,1,0,0,0|3,0,0]=4 181 B14R1.1025 CNC(=O)CNCc1cccc(c1)I 2230a_100000106179_100000183359 [0,0,1,0,0,0|3,0,0]=4 182 B14R1.1025 CNC(=O)CNCc1cccc(c1)I 2230a_100000693194_100011218688 [0,0,1,0,0,0|3,0,0]=4 183 B14R1.1025 CNC(=O)CNCc1cccc(c1)I 270004a_100000693194_100000014684 [0,0,1,0,0,0|3,0,0]=4 184 B14R1.1025 CNC(=O)CNCc1cccc(c1)I 34a_100000106179_100000183359 [0,0,1,0,0,0|3,0,0]=4 185 B14R1.1025 CNC(=O)CNCc1cccc(c1)O 207a_100000693194_100000188321 [0,0,1,0,0,0|2,0,1]=4 186 B14R1.1025 CNC(=O)CNCc1cccc(c1)O 2230a_100000693194_100011660834 [0,0,1,0,0,0|2,0,1]=4 187 B14R1.1025 CNC(=O)CNCc1cccc(c1)O 2230a_100000743036_100000183359 [0,0,1,0,0,0|2,0,1]=4 188 B14R1.1025 CNC(=O)CNCc1cccc(c1)O 270004a_100000693194_100000188321 [0,0,1,0,0,0|2,0,1]=4 189 B14R1.1025 CNC(=O)CNCc1cccc(c1)O 34a_100000743036_100000183359 [0,0,1,0,0,0|2,0,1]=4 190 B14R1.1025 CNC(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000183359 [0,0,1,0,0,0|1,0,0]=2 191 B14R1.1025 CNC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000183359 [0,0,1,0,0,0|1,0,0]=2 192 B14R1.1025 CNC(=O)COCc1cccc(c1)Br 34a_100000687537_100000183359 [0,0,1,0,0,0|3,0,0]=4 193 B14R1.1025 CNC(=O)COCc1cccc(c1)Br 34a_100000750040_100000698116 [0,0,1,0,0,0|3,0,0]=4 194 B14R1.1025 CNC(=O)COCc1cccc(c1)Br 7a_100000687537_100000183359 [0,0,1,0,0,0|3,0,0]=4 195 B14R1.1025 CNC(=O)COCc1cccc(c1)C 34a_100000750040_100000211840 [0,0,1,0,0,0|3,0,0]=4 196 B14R1.1025 CNC(=O)COCc1cccc(c1)C 34a_100011217746_100000183359 [0,0,1,0,0,0|3,0,0]=4 197 B14R1.1025 CNC(=O)COCc1cccc(c1)C 7a_100011217746_100000183359 [0,0,1,0,0,0|3,0,0]=4 198 B14R1.1025 CNC(=O)COCc1cccc(c1)Cl 34a_100000241301_100000183359 [0,0,1,0,0,0|3,0,0]=4 199 B14R1.1025 CNC(=O)COCc1cccc(c1)Cl 34a_100000750040_100000187163 [0,0,1,0,0,0|3,0,0]=4 200 B14R1.1025 CNC(=O)COCc1cccc(c1)Cl 7a_100000241301_100000183359 [0,0,1,0,0,0|3,0,0]=4 201 B14R1.1025 CNC(=O)COCc1cccc(c1)F 34a_100000210976_100000183359 [0,0,1,0,0,0|3,0,0]=4 202 B14R1.1025 CNC(=O)COCc1cccc(c1)F 34a_100000750040_100000187166 [0,0,1,0,0,0|3,0,0]=4 203 B14R1.1025 CNC(=O)COCc1cccc(c1)F 7a_100000210976_100000183359 [0,0,1,0,0,0|3,0,0]=4 204 B14R1.1025 CNC(=O)COCc1cccc(c1)I 34a_100000750040_100011218688 [0,0,1,0,0,0|3,0,0]=4 205 B14R1.1025 CNC(=O)COCc1cccc(c1)I 34a_100011215336_100000183359 [0,0,1,0,0,0|3,0,0]=4 206 B14R1.1025 CNC(=O)COCc1cccc(c1)I 7a_100011215336_100000183359 [0,0,1,0,0,0|3,0,0]=4 207 B14R1.1025 CNC(=O)COCc1cccc(c1)N 34a_100000211919_100000183359 [0,0,1,0,0,0|3,0,0]=4 208 B14R1.1025 CNC(=O)COCc1cccc(c1)O 34a_100000750040_100011660834 [0,0,1,0,0,0|2,0,1]=4 209 B14R1.1025 CNC(=O)CSCc1cccc(c1)Br 62a_100000183359_100000211773 [0,0,1,0,0,0|3,0,0]=4 210 B14R1.1025 CNC(=O)CSCc1cccc(c1)Br 62a_100000211773_100000183359 [0,0,1,0,0,0|3,0,0]=4 211 B14R1.1025 CNC(=O)CSCc1cccc(c1)C 62a_100000183359_100000211840 [0,0,1,0,0,0|3,0,0]=4 212 B14R1.1025 CNC(=O)CSCc1cccc(c1)C 62a_100000211840_100000183359 [0,0,1,0,0,0|3,0,0]=4 213 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl 11a_106832991635_100000150269 [0,0,1,0,0,0|3,0,0]=4 214 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl 1626a_100102657272_100000150269 [0,0,1,0,0,0|3,0,0]=4 215 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl 240690a_100102657272_100000150269 [0,0,1,0,0,0|3,0,0]=4 216 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl 527a_100102657272_100000150269 [0,0,1,0,0,0|3,0,0]=4 217 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl 62a_100000183359_100000187163 [0,0,1,0,0,0|3,0,0]=4 218 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl 62a_100000187163_100000183359 [0,0,1,0,0,0|3,0,0]=4 219 B14R1.1025 CNC(=O)CSCc1cccc(c1)F 62a_100000183359_100000230114 [0,0,1,0,0,0|3,0,0]=4 220 B14R1.1025 CNC(=O)CSCc1cccc(c1)F 62a_100000230114_100000183359 [0,0,1,0,0,0|3,0,0]=4 221 B14R1.1025 CNC(=O)CSCc1cccc(c1)I 62a_100000183359_100011218688 [0,0,1,0,0,0|3,0,0]=4 222 B14R1.1025 CNC(=O)CSCc1cccc(c1)I 62a_100011218688_100000183359 [0,0,1,0,0,0|3,0,0]=4 223 B14R1.1025 CNC(=O)CSCc1cccc(c1)O 62a_100000183359_100011660834 [0,0,1,0,0,0|2,0,1]=4 224 B14R1.1025 CNC(=O)CSCc1cccc(c1)O 62a_100011660834_100000183359 [0,0,1,0,0,0|2,0,1]=4 225 B14R1.1025 CNC(=O)NCCc1cccc(c1)Br 2708a_100011207229_106832991635 [0,0,1,0,0,0|3,0,0]=4 226 B14R1.1025 CNC(=O)NCCc1cccc(c1)Br 2708a_100102657272_100011207229 [0,0,1,0,0,0|3,0,0]=4 227 B14R1.1025 CNC(=O)NCCc1cccc(c1)Br 273464a_100011207229_100102657272 [0,0,1,0,0,0|3,0,0]=4 228 B14R1.1025 CNC(=O)NCCc1cccc(c1)Br 273464a_100102657272_100011207229 [0,0,1,0,0,0|3,0,0]=4 229 B14R1.1025 CNC(=O)NCCc1cccc(c1)Br 512a_100011207229_100102657272 [0,0,1,0,0,0|3,0,0]=4 230 B14R1.1025 CNC(=O)NCCc1cccc(c1)Br 512a_106832991638_100011207229 [0,0,1,0,0,0|3,0,0]=4 231 B14R1.1025 CNC(=O)NCCc1cccc(c1)C 2708a_100000749837_106832991635 [0,0,1,0,0,0|3,0,0]=4 232 B14R1.1025 CNC(=O)NCCc1cccc(c1)C 2708a_100102657272_100000749837 [0,0,1,0,0,0|3,0,0]=4 233 B14R1.1025 CNC(=O)NCCc1cccc(c1)C 273464a_100000749837_100102657272 [0,0,1,0,0,0|3,0,0]=4 234 B14R1.1025 CNC(=O)NCCc1cccc(c1)C 273464a_100102657272_100000749837 [0,0,1,0,0,0|3,0,0]=4 235 B14R1.1025 CNC(=O)NCCc1cccc(c1)C 512a_100000749837_100102657272 [0,0,1,0,0,0|3,0,0]=4 236 B14R1.1025 CNC(=O)NCCc1cccc(c1)C 512a_106832991638_100000749837 [0,0,1,0,0,0|3,0,0]=4 237 B14R1.1025 CNC(=O)NCCc1cccc(c1)Cl 2708a_100000185263_106832991635 [0,0,1,0,0,0|3,0,0]=4 238 B14R1.1025 CNC(=O)NCCc1cccc(c1)Cl 2708a_100102657272_100000185263 [0,0,1,0,0,0|3,0,0]=4 239 B14R1.1025 CNC(=O)NCCc1cccc(c1)Cl 273464a_100000185263_100102657272 [0,0,1,0,0,0|3,0,0]=4 240 B14R1.1025 CNC(=O)NCCc1cccc(c1)Cl 273464a_100102657272_100000185263 [0,0,1,0,0,0|3,0,0]=4 241 B14R1.1025 CNC(=O)NCCc1cccc(c1)Cl 512a_100000185263_100102657272 [0,0,1,0,0,0|3,0,0]=4 242 B14R1.1025 CNC(=O)NCCc1cccc(c1)Cl 512a_106832991638_100000185263 [0,0,1,0,0,0|3,0,0]=4 243 B14R1.1025 CNC(=O)NCCc1cccc(c1)F 2708a_100000205154_106832991635 [0,0,1,0,0,0|3,0,0]=4 244 B14R1.1025 CNC(=O)NCCc1cccc(c1)F 2708a_100102657272_100000205154 [0,0,1,0,0,0|3,0,0]=4 245 B14R1.1025 CNC(=O)NCCc1cccc(c1)F 273464a_100000205154_100102657272 [0,0,1,0,0,0|3,0,0]=4 246 B14R1.1025 CNC(=O)NCCc1cccc(c1)F 273464a_100102657272_100000205154 [0,0,1,0,0,0|3,0,0]=4 247 B14R1.1025 CNC(=O)NCCc1cccc(c1)F 512a_100000205154_100102657272 [0,0,1,0,0,0|3,0,0]=4 248 B14R1.1025 CNC(=O)NCCc1cccc(c1)F 512a_106832991638_100000205154 [0,0,1,0,0,0|3,0,0]=4 249 B14R1.1025 CNC(=O)NCCc1cccc(c1)O 2708a_100000747277_106832991635 [0,0,1,0,0,0|2,0,1]=4 250 B14R1.1025 CNC(=O)NCCc1cccc(c1)O 2708a_100102657272_100000747277 [0,0,1,0,0,0|2,0,1]=4 251 B14R1.1025 CNC(=O)NCCc1cccc(c1)O 273464a_100000747277_100102657272 [0,0,1,0,0,0|2,0,1]=4 252 B14R1.1025 CNC(=O)NCCc1cccc(c1)O 273464a_100102657272_100000747277 [0,0,1,0,0,0|2,0,1]=4 253 B14R1.1025 CNC(=O)NCCc1cccc(c1)O 512a_100000747277_100102657272 [0,0,1,0,0,0|2,0,1]=4 254 B14R1.1025 CNC(=O)NCCc1cccc(c1)O 512a_106832991638_100000747277 [0,0,1,0,0,0|2,0,1]=4 255 B14R1.1025 COC(=O)CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000742370 [0,0,1,0,0,0|2,0,0]=3 256 B14R1.1025 COC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000204255 [0,0,1,0,0,0|2,0,0]=3 257 B14R1.1025 COC(=O)CCSc1c[n+](ccn1)[O-] 62a_100000204255_100009880115 [0,0,1,0,0,0|3,0,0]=4 258 B14R1.1025 COC(=O)CCSc1ccc[n+](c1)C 62a_100000204255_100009996589 [0,0,1,0,0,0|3,0,0]=4 259 B14R1.1025 COC(=O)CCSc1ccc[n+](c1)C 62a_100009996589_100000204255 [0,0,1,0,0,0|3,0,0]=4 260 B14R1.1025 COC(=O)CCSc1ccc[n+](c1)[O-] 62a_100000204255_100009815978 [0,0,1,0,0,0|2,0,0]=3 261 B14R1.1025 COC(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000747449 [0,0,1,0,0,0|2,0,0]=3 262 B14R1.1025 COC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000747449 [0,0,1,0,0,0|2,0,0]=3 263 B16R2.2917 Cn1cc(ccc1=O)c2ccc[n+](c2)[O-] 271570a_100010233783_100009815978 [0,0,0,0,0,1|0,0,3]=4 264 B16R2.2921 CC1C(=O)NCCN1c2c[n+](ccn2)[O-] 27a_100000750721_100009880115 [0,0,0,0,0,1|3,0,0]=4 265 B13R1.15 CCC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000747405 [1,0,1,0,0,0|2,0,0]=4 266 B13R1.15 CCC(=O)CSc1ccc[n+](c1)[O-] 62a_100000747405_100009815978 [1,0,1,0,0,0|2,0,0]=4 267 B13R1.15 CCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000210414 [1,0,1,0,0,0|2,0,0]=4 268 B13R1.15 CCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000210414 [1,0,1,0,0,0|2,0,0]=4 269 B13R1.15 CCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000210414 [1,0,1,0,0,0|2,0,0]=4 270 B13R1.15 CCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000210414 [1,0,1,0,0,0|2,0,0]=4 271 B13R1.15 CCC(=O)NCc1cccc(c1)C 11a_100000185548_100000210414 [1,0,1,0,0,0|2,0,0]=4 272 B13R1.15 CCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000210414 [1,0,1,0,0,0|2,0,0]=4 273 B13R1.15 CCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000210414 [1,0,1,0,0,0|2,0,0]=4 274 B13R1.15 CCC(=O)NCc1cccc(c1)C 527a_100000185548_100000210414 [1,0,1,0,0,0|2,0,0]=4 275 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000210414 [1,0,1,0,0,0|2,0,0]=4 276 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000210414 [1,0,1,0,0,0|2,0,0]=4 277 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000210414 [1,0,1,0,0,0|2,0,0]=4 278 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000210414 [1,0,1,0,0,0|2,0,0]=4 279 B13R1.15 CCC(=O)NCc1cccc(c1)F 11a_100000174948_100000210414 [1,0,1,0,0,0|2,0,0]=4 280 B13R1.15 CCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000210414 [1,0,1,0,0,0|2,0,0]=4 281 B13R1.15 CCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000210414 [1,0,1,0,0,0|2,0,0]=4 282 B13R1.15 CCC(=O)NCc1cccc(c1)F 527a_100000174948_100000210414 [1,0,1,0,0,0|2,0,0]=4 283 B13R1.15 CCC(=O)NCc1cccc(c1)I 11a_100000106179_100000210414 [1,0,1,0,0,0|2,0,0]=4 284 B13R1.15 CCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000210414 [1,0,1,0,0,0|2,0,0]=4 285 B13R1.15 CCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000210414 [1,0,1,0,0,0|2,0,0]=4 286 B13R1.15 CCC(=O)NCc1cccc(c1)I 527a_100000106179_100000210414 [1,0,1,0,0,0|2,0,0]=4 287 B13R1.15 CCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000210414 [1,0,1,0,0,0|1,0,1]=4 288 B13R1.15 CCC(=O)NCc1cccc(c1)O 271570a_203496583355_200011236840 [1,0,1,0,0,0|1,0,1]=4 289 B13R1.15 CCC(=O)NCc1cccc(c1)O 527a_100000743036_100000210414 [1,0,1,0,0,0|1,0,1]=4 290 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000210414_200011218536 [1,0,1,0,0,0|2,0,0]=4 291 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210202 [1,0,1,0,0,0|2,0,0]=4 292 B13R1.135 CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210414 [1,0,1,0,0,0|1,0,0]=3 293 B13R1.135 CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210414 [1,0,1,0,0,0|1,0,0]=3 294 B13R1.135 CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210414 [1,0,1,0,0,0|1,0,0]=3 295 B13R1.135 CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210414 [1,0,1,0,0,0|1,0,0]=3 296 B13R1.135 CCC(=O)N(C)Cc1ccccn1 11a_100000207498_100000210414 [1,0,1,0,0,0|2,0,0]=4 297 B13R1.135 CCC(=O)N(C)Cc1ccccn1 240690a_100000207498_100000210414 [1,0,1,0,0,0|2,0,0]=4 298 B13R1.135 CCC(=O)N(C)Cc1ccccn1 527a_100000207498_100000210414 [1,0,1,0,0,0|2,0,0]=4 299 B13R1.135 CCC(=O)N(C)Cc1cccnc1 11a_100000184577_100000210414 [1,0,1,0,0,0|0,0,1]=3 300 B13R1.135 CCC(=O)N(C)Cc1cccnc1 240690a_100000184577_100000210414 [1,0,1,0,0,0|0,0,1]=3 301 B13R1.135 CCC(=O)N(C)Cc1cccnc1 527a_100000184577_100000210414 [1,0,1,0,0,0|0,0,1]=3 302 B13R1.135 CCC(=O)N(C)Cc1ccncc1 11a_100000187231_100000210414 [1,0,1,0,0,0|2,0,0]=4 303 B13R1.135 CCC(=O)N(C)Cc1ccncc1 240690a_100000187231_100000210414 [1,0,1,0,0,0|2,0,0]=4 304 B13R1.135 CCC(=O)N(C)Cc1ccncc1 527a_100000187231_100000210414 [1,0,1,0,0,0|2,0,0]=4 305 B13R1.135 CCC(=O)N(C)Cc1cnccn1 11a_100011269079_100000210414 [1,0,1,0,0,0|1,0,1]=4 306 B13R1.135 CCC(=O)N(C)Cc1cnccn1 240690a_100011269079_100000210414 [1,0,1,0,0,0|1,0,1]=4 307 B13R1.135 CCC(=O)N(C)Cc1cnccn1 527a_100011269079_100000210414 [1,0,1,0,0,0|1,0,1]=4 308 B13R1.135 CN(Cc1ccccc1)C(=O)CO 240690a_100000186898_100000210174 [1,0,1,0,0,0|2,0,0]=4 309 B13R1.135 CN(Cc1ccccc1)C(=O)CO 527a_100000186898_100000210174 [1,0,1,0,0,0|2,0,0]=4 310 B13R1.135 CN(Cc1cccnc1)C(=O)CO 240690a_100000184577_100000210174 [1,0,1,0,0,0|1,0,1]=4 311 B13R1.135 CN(Cc1cccnc1)C(=O)CO 527a_100000184577_100000210174 [1,0,1,0,0,0|1,0,1]=4 312 B13R1.135 CNC(=O)N(C)Cc1ccccc1 2708a_100102657272_100000186898 [1,0,1,0,0,0|2,0,0]=4 313 B13R1.135 CNC(=O)N(C)Cc1ccccc1 273464a_100102657272_100000186898 [1,0,1,0,0,0|2,0,0]=4 314 B13R1.135 CNC(=O)N(C)Cc1cccnc1 2708a_100102657272_100000184577 [1,0,1,0,0,0|1,0,1]=4 315 B13R1.135 CNC(=O)N(C)Cc1cccnc1 273464a_100102657272_100000184577 [1,0,1,0,0,0|1,0,1]=4 316 B13R1.148 CC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000179758 [1,0,1,0,0,0|2,0,0]=4 317 B13R1.148 CC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100009814033_100009815978 [1,0,1,0,0,0|2,0,0]=4 318 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100015343762 [1,0,1,0,0,0|2,0,0]=4 319 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100015343762 [1,0,1,0,0,0|2,0,0]=4 320 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100015343762 [1,0,1,0,0,0|2,0,0]=4 321 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100103153847 [1,0,1,0,0,0|2,0,0]=4 322 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100015343762 [1,0,1,0,0,0|2,0,0]=4 323 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100015343762 [1,0,1,0,0,0|2,0,0]=4 324 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100015343762 [1,0,1,0,0,0|2,0,0]=4 325 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100103153847 [1,0,1,0,0,0|2,0,0]=4 326 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100015343762 [1,0,1,0,0,0|2,0,0]=4 327 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100015343762 [1,0,1,0,0,0|2,0,0]=4 328 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100015343762 [1,0,1,0,0,0|2,0,0]=4 329 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100103153847 [1,0,1,0,0,0|2,0,0]=4 330 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100015343762 [1,0,1,0,0,0|2,0,0]=4 331 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100015343762 [1,0,1,0,0,0|2,0,0]=4 332 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100015343762 [1,0,1,0,0,0|2,0,0]=4 333 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100103153847 [1,0,1,0,0,0|2,0,0]=4 334 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100015343762 [1,0,1,0,0,0|1,0,1]=4 335 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100103153847 [1,0,1,0,0,0|1,0,1]=4 336 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 11a_100020642005_100015343762 [1,0,1,0,0,0|2,0,0]=4 337 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 1626a_100020642005_100015343762 [1,0,1,0,0,0|2,0,0]=4 338 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 240690a_100020642005_100015343762 [1,0,1,0,0,0|2,0,0]=4 339 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 527a_100020642005_100103153847 [1,0,1,0,0,0|2,0,0]=4 340 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 11a_100102723534_100015343762 [1,0,1,0,0,0|2,0,0]=4 341 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 1626a_100102723534_100015343762 [1,0,1,0,0,0|2,0,0]=4 342 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 240690a_100102723534_100015343762 [1,0,1,0,0,0|2,0,0]=4 343 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 527a_100102723534_100103153847 [1,0,1,0,0,0|2,0,0]=4 344 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 240690a_100000740644_100015343762 [1,0,1,0,0,0|1,0,1]=4 345 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 527a_100000740644_100103153847 [1,0,1,0,0,0|1,0,1]=4 346 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 11a_100000698126_100015343762 [1,0,1,0,0,0|2,0,0]=4 347 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 1626a_100000698126_100015343762 [1,0,1,0,0,0|2,0,0]=4 348 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 240690a_100000698126_100015343762 [1,0,1,0,0,0|2,0,0]=4 349 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 527a_100000698126_100103153847 [1,0,1,0,0,0|2,0,0]=4 350 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 11a_100015193778_100015343762 [1,0,1,0,0,0|2,0,0]=4 351 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 1626a_100015193778_100015343762 [1,0,1,0,0,0|2,0,0]=4 352 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 240690a_100015193778_100015343762 [1,0,1,0,0,0|2,0,0]=4 353 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 527a_100015193778_100103153847 [1,0,1,0,0,0|2,0,0]=4 354 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 11a_100000195388_100015343762 [1,0,1,0,0,0|1,0,0]=3 355 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 1626a_100000195388_100015343762 [1,0,1,0,0,0|1,0,0]=3 356 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 240690a_100000195388_100015343762 [1,0,1,0,0,0|1,0,0]=3 357 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 527a_100000195388_100103153847 [1,0,1,0,0,0|1,0,0]=3 358 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 11a_100000231138_100015343762 [1,0,1,0,0,0|2,0,0]=4 359 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 1626a_100000231138_100015343762 [1,0,1,0,0,0|2,0,0]=4 360 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 240690a_100000231138_100015343762 [1,0,1,0,0,0|2,0,0]=4 361 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 527a_100000231138_100103153847 [1,0,1,0,0,0|2,0,0]=4 362 B13R1.152 CC(=O)N(C)C(C)c1cccnc1 11a_100000232774_100015343762 [1,0,1,0,0,0|0,0,1]=3 363 B13R1.152 CC(=O)N(C)C(C)c1cccnc1 240690a_100000232774_100015343762 [1,0,1,0,0,0|0,0,1]=3 364 B13R1.152 CC(=O)N(C)C(C)c1cccnc1 527a_100000232774_100103153847 [1,0,1,0,0,0|0,0,1]=3 365 B13R1.152 CC(=O)N(C)C(C)c1ccncc1 11a_100000231139_100015343762 [1,0,1,0,0,0|2,0,0]=4 366 B13R1.152 CC(=O)N(C)C(C)c1ccncc1 240690a_100000231139_100015343762 [1,0,1,0,0,0|2,0,0]=4 367 B13R1.152 CC(=O)N(C)C(C)c1ccncc1 527a_100000231139_100103153847 [1,0,1,0,0,0|2,0,0]=4 368 B13R1.6 C/C=C/COCc1ccc[n+](c1)[O-] 34a_100000037817_100102629194 [1,0,1,0,0,0|2,0,0]=4 369 B13R1.6 C/C=C/COCc1ccc[n+](c1)[O-] 7a_100000037817_100102629194 [1,0,1,0,0,0|2,0,0]=4 370 B13R1.6 CC=CCOCc1ccc[n+](c1)[O-] 34a_100000037817_100000070051 [1,0,1,0,0,0|2,0,0]=4 371 B13R1.6 CC=CCOCc1ccc[n+](c1)[O-] 7a_100000037817_100000070051 [1,0,1,0,0,0|2,0,0]=4 372 B13R1.149 C=C(C)CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000730704 [1,0,1,0,0,0|2,0,0]=4 373 B13R1.149 C=C(C)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000730704 [1,0,1,0,0,0|2,0,0]=4 374 B13R1.149 C=C(C)CCSc1ccc[n+](c1)[O-] 62a_100000730704_100009815978 [1,0,1,0,0,0|2,0,0]=4 375 B13R1.149 C=C(C)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000748629 [1,0,1,0,0,0|2,0,0]=4 376 B13R1.149 C=C(C)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000748629 [1,0,1,0,0,0|2,0,0]=4 377 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000070787_100011713683 [1,0,1,0,0,0|2,0,0]=4 378 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000685939_200000210301 [1,0,1,0,0,0|2,0,0]=4 379 B13R1.149 CC(=O)CCCc1cccc(c1)F 1458a_100000070787_200000698031 [1,0,1,0,0,0|2,0,0]=4 380 B13R1.149 CC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000053229 [1,0,1,0,0,0|1,0,0]=3 381 B13R1.149 CC(=O)CCSc1c[n+](ccn1)[O-] 62a_100000053229_100009880115 [1,0,1,0,0,0|2,0,0]=4 382 B13R1.149 CC(=O)CCSc1ccc[n+](c1)C 62a_100000053229_100009996589 [1,0,1,0,0,0|2,0,0]=4 383 B13R1.149 CC(=O)CCSc1ccc[n+](c1)C 62a_100009996589_100000053229 [1,0,1,0,0,0|2,0,0]=4 384 B13R1.149 CC(=O)CCSc1ccc[n+](c1)[O-] 62a_100000053229_100009815978 [1,0,1,0,0,0|1,0,0]=3 385 B13R1.149 CC(=O)OCOc1ccc[n+](c1)[O-] 34a_100000039713_100009813279 [1,0,1,0,0,0|2,0,0]=4 386 B13R1.149 CC(=O)OCSc1ccc[n+](c1)[O-] 62a_100000076356_100009815978 [1,0,1,0,0,0|2,0,0]=4 387 B13R1.149 C[n+]1cccc(c1)SCCC(=O)N 62a_100000744528_100009996589 [1,0,1,0,0,0|2,0,0]=4 388 B13R1.149 C[n+]1cccc(c1)SCCC(=O)N 62a_100009996589_100000744528 [1,0,1,0,0,0|2,0,0]=4 389 B13R1.149 NC(=O)CCNc1c[n+](ccn1)[O-] 27a_100000740010_100009880115 [1,0,1,0,0,0|2,0,0]=4 390 B13R1.149 NC(=O)CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000731001 [1,0,1,0,0,0|1,0,0]=3 391 B13R1.149 NC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000744528 [1,0,1,0,0,0|1,0,0]=3 392 B13R1.149 NC(=O)CCSc1c[n+](ccn1)[O-] 62a_100000744528_100009880115 [1,0,1,0,0,0|2,0,0]=4 393 B13R1.149 NC(=O)CCSc1ccc[n+](c1)[O-] 62a_100000744528_100009815978 [1,0,1,0,0,0|1,0,0]=3 394 B13R1.149 NC(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000187820 [1,0,1,0,0,0|1,0,0]=3 395 B13R1.149 NC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000187820 [1,0,1,0,0,0|1,0,0]=3 396 B13R1.149 O=C([O-])COCc1ccc[n+](c1)[O-] 34a_100000037817_100020667443 [1,0,1,0,0,0|2,0,0]=4 397 B13R1.149 [13CH3]C(=O)CCCc1cccc(c1)Br 1458a_100000685939_200025704644 [1,0,1,0,0,0|2,0,0]=4 398 B13R1.718 CCC(=O)CCCc1ccccc1 1458a_100000210414_100000211621 [1,0,1,0,0,0|2,0,0]=4 399 B13R1.718 CCC(=O)CCCc1ccccc1 1458a_100011207963_100000210202 [1,0,1,0,0,0|2,0,0]=4 400 B13R1.718 CNC(=O)CCCc1ccccc1 11a_106832991635_100011207963 [1,0,1,0,0,0|1,0,0]=3 401 B13R1.718 CNC(=O)CCCc1ccccc1 1626a_100102657272_100011207963 [1,0,1,0,0,0|1,0,0]=3 402 B13R1.718 CNC(=O)CCCc1ccccc1 240690a_100102657272_100011207963 [1,0,1,0,0,0|1,0,0]=3 403 B13R1.718 CNC(=O)CCCc1ccccc1 527a_100102657272_100011207963 [1,0,1,0,0,0|1,0,0]=3 404 B13R1.718 CNC(=O)CCCc1ccccn1 11a_106832991635_100000752327 [1,0,1,0,0,0|2,0,0]=4 405 B13R1.718 CNC(=O)CCCc1ccccn1 1626a_100102657272_100000752327 [1,0,1,0,0,0|2,0,0]=4 406 B13R1.718 CNC(=O)CCCc1ccccn1 240690a_100102657272_100000752327 [1,0,1,0,0,0|2,0,0]=4 407 B13R1.718 CNC(=O)CCCc1ccccn1 527a_100102657272_100000752327 [1,0,1,0,0,0|2,0,0]=4 408 B13R1.718 CNC(=O)CCCc1ccncc1 11a_106832991635_100020654287 [1,0,1,0,0,0|2,0,0]=4 409 B13R1.718 CNC(=O)CCCc1ccncc1 1626a_100102657272_100020654287 [1,0,1,0,0,0|2,0,0]=4 410 B13R1.718 CNC(=O)CCCc1ccncc1 240690a_100102657272_100020654287 [1,0,1,0,0,0|2,0,0]=4 411 B13R1.718 CNC(=O)CCCc1ccncc1 527a_100102657272_100020654287 [1,0,1,0,0,0|2,0,0]=4 412 B13R1.718 CNC(=O)CCNc1ccccc1 34a_100000106764_100012179268 [1,0,1,0,0,0|2,0,0]=4 413 B13R1.718 CNC(=O)CCOc1ccccc1 11a_106832991635_100000182761 [1,0,1,0,0,0|2,0,0]=4 414 B13R1.718 CNC(=O)CCOc1ccccc1 1626a_100102657272_100000182761 [1,0,1,0,0,0|2,0,0]=4 415 B13R1.718 CNC(=O)CCOc1ccccc1 240690a_100102657272_100000182761 [1,0,1,0,0,0|2,0,0]=4 416 B13R1.718 CNC(=O)CCOc1ccccc1 34a_100000210340_100012179268 [1,0,1,0,0,0|2,0,0]=4 417 B13R1.718 CNC(=O)CCOc1ccccc1 7a_100000210340_100000737683 [1,0,1,0,0,0|2,0,0]=4 418 B13R1.718 CNC(=O)CCOc1cccnc1 34a_100000210849_100012179268 [1,0,1,0,0,0|1,0,1]=4 419 B13R1.718 CNC(=O)CCOc1cccnc1 7a_100000210849_100000737683 [1,0,1,0,0,0|1,0,1]=4 420 B13R1.718 CNC(=O)CCSc1ccccc1 11a_106832991635_100000182436 [1,0,1,0,0,0|2,0,0]=4 421 B13R1.718 CNC(=O)CCSc1ccccc1 1626a_100102657272_100000182436 [1,0,1,0,0,0|2,0,0]=4 422 B13R1.718 CNC(=O)CCSc1ccccc1 240690a_100102657272_100000182436 [1,0,1,0,0,0|2,0,0]=4 423 B13R1.718 CNC(=O)CCSc1ccccc1 62a_100000719477_100000737683 [1,0,1,0,0,0|2,0,0]=4 424 B13R1.718 CNC(=O)CCSc1ccccc1 62a_100000737683_100000041952 [1,0,1,0,0,0|2,0,0]=4 425 B13R1.718 CNC(=O)CCSc1cccnc1 62a_100000210063_100000737683 [1,0,1,0,0,0|1,0,1]=4 426 B13R1.718 CNC(=O)CCSc1cccnc1 62a_100000737683_100000210063 [1,0,1,0,0,0|1,0,1]=4 427 B13R1.718 CNC(=O)CNCc1ccccc1 207a_100000693194_100015611070 [1,0,1,0,0,0|2,0,0]=4 428 B13R1.718 CNC(=O)CNCc1ccccc1 2230a_100000693194_100015291786 [1,0,1,0,0,0|2,0,0]=4 429 B13R1.718 CNC(=O)CNCc1ccccc1 2230a_100015324214_100000183359 [1,0,1,0,0,0|2,0,0]=4 430 B13R1.718 CNC(=O)CNCc1ccccc1 270004a_100000693194_100015611070 [1,0,1,0,0,0|2,0,0]=4 431 B13R1.718 CNC(=O)CNCc1ccccc1 34a_100015324214_100000183359 [1,0,1,0,0,0|2,0,0]=4 432 B13R1.718 CNC(=O)CNCc1cccnc1 207a_100000693194_100000209961 [1,0,1,0,0,0|1,0,1]=4 433 B13R1.718 CNC(=O)CNCc1cccnc1 2230a_100000693194_100000741622 [1,0,1,0,0,0|1,0,1]=4 434 B13R1.718 CNC(=O)CNCc1cccnc1 270004a_100000693194_100000209961 [1,0,1,0,0,0|1,0,1]=4 435 B13R1.718 CNC(=O)COCc1ccccc1 11a_106832991635_100000230186 [1,0,1,0,0,0|2,0,0]=4 436 B13R1.718 CNC(=O)COCc1ccccc1 1626a_100102657272_100000230186 [1,0,1,0,0,0|2,0,0]=4 437 B13R1.718 CNC(=O)COCc1ccccc1 240690a_100102657272_100000230186 [1,0,1,0,0,0|2,0,0]=4 438 B13R1.718 CNC(=O)COCc1ccccc1 34a_100000210790_100000183359 [1,0,1,0,0,0|2,0,0]=4 439 B13R1.718 CNC(=O)COCc1ccccc1 34a_100000750040_100015291786 [1,0,1,0,0,0|2,0,0]=4 440 B13R1.718 CNC(=O)COCc1ccccc1 527a_100102657272_100000230186 [1,0,1,0,0,0|2,0,0]=4 441 B13R1.718 CNC(=O)COCc1ccccc1 7a_100000210790_100000183359 [1,0,1,0,0,0|2,0,0]=4 442 B13R1.718 CNC(=O)COCc1cccnc1 34a_100000750040_100000733263 [1,0,1,0,0,0|1,0,1]=4 443 B13R1.718 CNC(=O)CSCc1ccccc1 11a_106832991635_100000150264 [1,0,1,0,0,0|2,0,0]=4 444 B13R1.718 CNC(=O)CSCc1ccccc1 1626a_100102657272_100000150264 [1,0,1,0,0,0|2,0,0]=4 445 B13R1.718 CNC(=O)CSCc1ccccc1 240690a_100102657272_100000150264 [1,0,1,0,0,0|2,0,0]=4 446 B13R1.718 CNC(=O)CSCc1ccccc1 527a_100102657272_100000150264 [1,0,1,0,0,0|2,0,0]=4 447 B13R1.718 CNC(=O)CSCc1ccccc1 62a_100000183359_100015291786 [1,0,1,0,0,0|2,0,0]=4 448 B13R1.718 CNC(=O)CSCc1ccccc1 62a_100000211182_100000183359 [1,0,1,0,0,0|2,0,0]=4 449 B13R1.718 CNC(=O)CSCc1cccnc1 62a_100000183359_100000741622 [1,0,1,0,0,0|1,0,1]=4 450 B13R1.718 CNC(=O)CSCc1cccnc1 62a_100000741622_100000183359 [1,0,1,0,0,0|1,0,1]=4 451 B13R1.718 CNC(=O)NCCc1ccccc1 2708a_100000106460_106832991635 [1,0,1,0,0,0|2,0,0]=4 452 B13R1.718 CNC(=O)NCCc1ccccc1 2708a_100102657272_100000106460 [1,0,1,0,0,0|2,0,0]=4 453 B13R1.718 CNC(=O)NCCc1ccccc1 273464a_100000106460_100102657272 [1,0,1,0,0,0|2,0,0]=4 454 B13R1.718 CNC(=O)NCCc1ccccc1 273464a_100102657272_100000106460 [1,0,1,0,0,0|2,0,0]=4 455 B13R1.718 CNC(=O)NCCc1ccccc1 512a_100000106460_100102657272 [1,0,1,0,0,0|2,0,0]=4 456 B13R1.718 CNC(=O)NCCc1ccccc1 512a_106832991638_100000106460 [1,0,1,0,0,0|2,0,0]=4 457 B13R1.718 CNC(=O)NCCc1cccnc1 2708a_100000736294_106832991635 [1,0,1,0,0,0|1,0,1]=4 458 B13R1.718 CNC(=O)NCCc1cccnc1 2708a_100102657272_100000736294 [1,0,1,0,0,0|1,0,1]=4 459 B13R1.718 CNC(=O)NCCc1cccnc1 273464a_100000736294_100102657272 [1,0,1,0,0,0|1,0,1]=4 460 B13R1.718 CNC(=O)NCCc1cccnc1 273464a_100102657272_100000736294 [1,0,1,0,0,0|1,0,1]=4 461 B13R1.718 CNC(=O)NCCc1cccnc1 512a_100000736294_100102657272 [1,0,1,0,0,0|1,0,1]=4 462 B13R1.718 CNC(=O)NCCc1cccnc1 512a_106832991638_100000736294 [1,0,1,0,0,0|1,0,1]=4 463 B13R2.15 CN1CCCC1c2ccccc2 2230a_100000243309_200000210301 [2,0,0,0,0,0|1,0,1]=4 464 B13R2.15 CN1CCCC1c2ccccc2 269982a_100000243309_200000210301 [2,0,0,0,0,0|1,0,1]=4 465 B13R2.15 CN1CCCC1c2ccccc2 34a_100000243309_200000210301 [2,0,0,0,0,0|1,0,1]=4 466 B13R2.15 CN1CCCC1c2cccnc2 2230a_100000233489_200000210301 [2,0,0,0,0,0|0,0,2]=4 467 B13R2.15 CN1CCCC1c2cccnc2 269982a_100000233489_200000210301 [2,0,0,0,0,0|0,0,2]=4 468 B13R2.15 [13CH3]N1CCCC1c2ccccc2 2230a_100000243309_200025704644 [2,0,0,0,0,0|1,0,1]=4 469 B13R2.15 [13CH3]N1CCCC1c2ccccc2 269982a_100000243309_200025704644 [2,0,0,0,0,0|1,0,1]=4 470 B13R2.15 [13CH3]N1CCCC1c2ccccc2 34a_100000243309_200025704644 [2,0,0,0,0,0|1,0,1]=4 471 B13R2.15 [13CH3]N1CCCC1c2cccnc2 2230a_100000233489_200025704644 [2,0,0,0,0,0|0,0,2]=4 472 B13R2.15 [13CH3]N1CCCC1c2cccnc2 269982a_100000233489_200025704644 [2,0,0,0,0,0|0,0,2]=4 473 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000211992 [0,1,1,0,0,0|2,0,0]=4 474 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000211992 [0,1,1,0,0,0|2,0,0]=4 475 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000211992 [0,1,1,0,0,0|2,0,0]=4 476 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000211992 [0,1,1,0,0,0|2,0,0]=4 477 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100000211992 [0,1,1,0,0,0|2,0,0]=4 478 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100000211992 [0,1,1,0,0,0|2,0,0]=4 479 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100000211992 [0,1,1,0,0,0|2,0,0]=4 480 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100000211992 [0,1,1,0,0,0|2,0,0]=4 481 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000211992 [0,1,1,0,0,0|2,0,0]=4 482 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000211992 [0,1,1,0,0,0|2,0,0]=4 483 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000211992 [0,1,1,0,0,0|2,0,0]=4 484 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000211992 [0,1,1,0,0,0|2,0,0]=4 485 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000211992 [0,1,1,0,0,0|2,0,0]=4 486 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000211992 [0,1,1,0,0,0|2,0,0]=4 487 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000211992 [0,1,1,0,0,0|2,0,0]=4 488 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000211992 [0,1,1,0,0,0|2,0,0]=4 489 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000211992 [0,1,1,0,0,0|1,0,1]=4 490 B15R1.49 CCCC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000211992 [0,1,1,0,0,0|1,0,1]=4 491 B15R1.49 CCNC(=O)C(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100000230173 [0,1,1,0,0,0|2,0,0]=4 492 B15R1.49 CCNC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000230173 [0,1,1,0,0,0|2,0,0]=4 493 B15R1.49 CCNC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100000230173_100009815978 [0,1,1,0,0,0|2,0,0]=4 494 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)Br 2708a_100015525214_100000187585 [0,1,1,0,0,0|2,0,0]=4 495 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)Br 273464a_100015525214_100000187585 [0,1,1,0,0,0|2,0,0]=4 496 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)C 2708a_100015525214_102495364743 [0,1,1,0,0,0|2,0,0]=4 497 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)C 273464a_100015525214_102495364743 [0,1,1,0,0,0|2,0,0]=4 498 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)Cl 2708a_100015525214_100020629429 [0,1,1,0,0,0|2,0,0]=4 499 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)Cl 273464a_100015525214_100020629429 [0,1,1,0,0,0|2,0,0]=4 500 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)F 2708a_100015525214_100000184398 [0,1,1,0,0,0|2,0,0]=4 501 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)F 273464a_100015525214_100000184398 [0,1,1,0,0,0|2,0,0]=4 502 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)O 2708a_100015525214_100000207540 [0,1,1,0,0,0|1,0,1]=4 503 B15R1.49 CCNC(=O)N(C)Cc1cccc(c1)O 273464a_100015525214_100000207540 [0,1,1,0,0,0|1,0,1]=4 504 B15R1.49 CCOC(=O)C(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100011216346 [0,1,1,0,0,0|2,0,0]=4 505 B15R1.49 CCOC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100011216346 [0,1,1,0,0,0|2,0,0]=4 506 B15R1.49 CCOC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100011216346_100009815978 [0,1,1,0,0,0|2,0,0]=4 507 B15R1.49 CN(Cc1cccc(c1)Br)C(=O)CCO 240690a_100000187585_100011216618 [0,1,1,0,0,0|2,0,0]=4 508 B15R1.49 CN(Cc1cccc(c1)Cl)C(=O)CCO 240690a_100020629429_100011216618 [0,1,1,0,0,0|2,0,0]=4 509 B15R1.49 CN(Cc1cccc(c1)Cl)C(=O)CS[13CH3] 62a_100000217385_200025704644 [0,1,1,0,0,0|2,0,0]=4 510 B15R1.49 CN(Cc1cccc(c1)Cl)C(=O)CS[13CH3] 62a_200025704644_100000217385 [0,1,1,0,0,0|2,0,0]=4 511 B15R1.49 CN(Cc1cccc(c1)F)C(=O)CCO 240690a_100000184398_100011216618 [0,1,1,0,0,0|2,0,0]=4 512 B15R1.49 CN(Cc1cccc(c1)F)C(=O)CS[13CH3] 62a_100000204657_200025704644 [0,1,1,0,0,0|2,0,0]=4 513 B15R1.49 CN(Cc1cccc(c1)F)C(=O)CS[13CH3] 62a_200025704644_100000204657 [0,1,1,0,0,0|2,0,0]=4 514 B15R1.49 CN(Cc1cccc(c1)O)C(=O)CCO 240690a_100000207540_100011216618 [0,1,1,0,0,0|1,0,1]=4 515 B15R1.49 CNCC(=O)N(C)Cc1cccc(c1)Cl 2230a_106832991635_100000217385 [0,1,1,0,0,0|2,0,0]=4 516 B15R1.49 CNCC(=O)N(C)Cc1cccc(c1)Cl 34a_100102657272_100000217385 [0,1,1,0,0,0|2,0,0]=4 517 B15R1.49 CNCC(=O)N(C)Cc1cccc(c1)Cl 7a_106832991635_100000217385 [0,1,1,0,0,0|2,0,0]=4 518 B15R1.49 CNCC(=O)N(C)Cc1cccc(c1)F 2230a_106832991635_100000204657 [0,1,1,0,0,0|2,0,0]=4 519 B15R1.49 CNCC(=O)N(C)Cc1cccc(c1)F 34a_100102657272_100000204657 [0,1,1,0,0,0|2,0,0]=4 520 B15R1.49 CNCC(=O)N(C)Cc1cccc(c1)F 7a_106832991635_100000204657 [0,1,1,0,0,0|2,0,0]=4 521 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000210968 [0,1,1,0,0,0|2,0,0]=4 522 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000210968 [0,1,1,0,0,0|2,0,0]=4 523 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000210968 [0,1,1,0,0,0|2,0,0]=4 524 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000210968 [0,1,1,0,0,0|2,0,0]=4 525 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100000210968 [0,1,1,0,0,0|2,0,0]=4 526 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100000210968 [0,1,1,0,0,0|2,0,0]=4 527 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100000210968 [0,1,1,0,0,0|2,0,0]=4 528 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100000210968 [0,1,1,0,0,0|2,0,0]=4 529 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000210968 [0,1,1,0,0,0|2,0,0]=4 530 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000210968 [0,1,1,0,0,0|2,0,0]=4 531 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000210968 [0,1,1,0,0,0|2,0,0]=4 532 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Cl 34a_100138415774_100000217385 [0,1,1,0,0,0|2,0,0]=4 533 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000210968 [0,1,1,0,0,0|2,0,0]=4 534 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000210968 [0,1,1,0,0,0|2,0,0]=4 535 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000210968 [0,1,1,0,0,0|2,0,0]=4 536 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000210968 [0,1,1,0,0,0|2,0,0]=4 537 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)F 34a_100138415774_100000204657 [0,1,1,0,0,0|2,0,0]=4 538 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000210968 [0,1,1,0,0,0|2,0,0]=4 539 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000210968 [0,1,1,0,0,0|1,0,1]=4 540 B15R1.49 COCC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000210968 [0,1,1,0,0,0|1,0,1]=4 541 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000184570 [0,1,1,0,0,0|2,0,0]=4 542 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000184570 [0,1,1,0,0,0|2,0,0]=4 543 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000184570 [0,1,1,0,0,0|2,0,0]=4 544 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000184570 [0,1,1,0,0,0|2,0,0]=4 545 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100000184570 [0,1,1,0,0,0|2,0,0]=4 546 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100000184570 [0,1,1,0,0,0|2,0,0]=4 547 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100000184570 [0,1,1,0,0,0|2,0,0]=4 548 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100000184570 [0,1,1,0,0,0|2,0,0]=4 549 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000184570 [0,1,1,0,0,0|2,0,0]=4 550 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000184570 [0,1,1,0,0,0|2,0,0]=4 551 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000184570 [0,1,1,0,0,0|2,0,0]=4 552 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000184570 [0,1,1,0,0,0|2,0,0]=4 553 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Cl 62a_100000217385_200000210301 [0,1,1,0,0,0|2,0,0]=4 554 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)Cl 62a_200000210301_100000217385 [0,1,1,0,0,0|2,0,0]=4 555 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000184570 [0,1,1,0,0,0|2,0,0]=4 556 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000184570 [0,1,1,0,0,0|2,0,0]=4 557 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000184570 [0,1,1,0,0,0|2,0,0]=4 558 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000184570 [0,1,1,0,0,0|2,0,0]=4 559 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)F 62a_100000204657_200000210301 [0,1,1,0,0,0|2,0,0]=4 560 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)F 62a_200000210301_100000204657 [0,1,1,0,0,0|2,0,0]=4 561 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000184570 [0,1,1,0,0,0|1,0,1]=4 562 B15R1.49 CSCC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000184570 [0,1,1,0,0,0|1,0,1]=4 563 B15R1.49 Cc1cccc(c1)CN(C)C(=O)CCO 240690a_102495364743_100011216618 [0,1,1,0,0,0|2,0,0]=4 564 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)C#N 11a_100000168042_100000210414 [0,1,1,0,0,0|2,0,0]=4 565 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)C#N 1626a_100000168042_100000210414 [0,1,1,0,0,0|2,0,0]=4 566 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)C#N 240690a_100000168042_100000210414 [0,1,1,0,0,0|2,0,0]=4 567 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)C#N 527a_100000168042_100000210414 [0,1,1,0,0,0|2,0,0]=4 568 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)OC 11a_100000184262_100000210414 [0,1,1,0,0,0|1,0,1]=4 569 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)OC 1626a_100000184262_100000210414 [0,1,1,0,0,0|1,0,1]=4 570 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)OC 240690a_100000184262_100000210414 [0,1,1,0,0,0|1,0,1]=4 571 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)OC 527a_100000184262_100000210414 [0,1,1,0,0,0|1,0,1]=4 572 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)SC 11a_100011934695_100000210414 [0,1,1,0,0,0|1,1,0]=4 573 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)SC 240690a_100011934695_100000210414 [0,1,1,0,0,0|1,1,0]=4 574 B15R1.63 CCC(=O)N(C)Cc1cccc(c1)SC 527a_100011934695_100000210414 [0,1,1,0,0,0|1,1,0]=4 575 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)Br 11a_100025717457_100000210414 [0,1,1,0,0,0|2,0,0]=4 576 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)Br 1626a_100025717457_100000210414 [0,1,1,0,0,0|2,0,0]=4 577 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)Br 240690a_100025717457_100000210414 [0,1,1,0,0,0|2,0,0]=4 578 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)Br 527a_100025717457_100000210414 [0,1,1,0,0,0|2,0,0]=4 579 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)F 11a_100000231114_100000210414 [0,1,1,0,0,0|2,0,0]=4 580 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)F 1626a_100000231114_100000210414 [0,1,1,0,0,0|2,0,0]=4 581 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)F 240690a_100000231114_100000210414 [0,1,1,0,0,0|2,0,0]=4 582 B15R1.76 CCC(=O)N(C)C(C)c1cccc(c1)F 527a_100000231114_100000210414 [0,1,1,0,0,0|2,0,0]=4 583 B15R1.113 CCC(=O)N(C)Cc1cccc(c1C)C 1626a_100000207598_100000210414 [0,1,1,0,0,0|2,0,0]=4 584 B15R1.113 CCC(=O)N(C)Cc1cccc(c1C)C 240690a_100000207598_100000210414 [0,1,1,0,0,0|2,0,0]=4 585 B15R1.113 CCC(=O)N(C)Cc1cccc(c1C)C 527a_100000207598_100000210414 [0,1,1,0,0,0|2,0,0]=4 586 B15R1.113 CCC(=O)N(C)Cc1cccc(c1Cl)Cl 11a_100000690605_100000210414 [0,1,1,0,0,0|2,0,0]=4 587 B15R1.113 CCC(=O)N(C)Cc1cccc(c1Cl)Cl 1626a_100000690605_100000210414 [0,1,1,0,0,0|2,0,0]=4 588 B15R1.113 CCC(=O)N(C)Cc1cccc(c1Cl)Cl 240690a_100000690605_100000210414 [0,1,1,0,0,0|2,0,0]=4 589 B15R1.113 CCC(=O)N(C)Cc1cccc(c1Cl)Cl 527a_100000690605_100000210414 [0,1,1,0,0,0|2,0,0]=4 590 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)Br 11a_114873767014_100000210414 [0,1,1,0,0,0|2,0,0]=4 591 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)Br 1626a_114873767014_100000210414 [0,1,1,0,0,0|2,0,0]=4 592 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)Br 240690a_114873767014_100000210414 [0,1,1,0,0,0|2,0,0]=4 593 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)Br 527a_114873767014_100000210414 [0,1,1,0,0,0|2,0,0]=4 594 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)F 11a_102515433064_100000210414 [0,1,1,0,0,0|2,0,0]=4 595 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)F 1626a_102515433064_100000210414 [0,1,1,0,0,0|2,0,0]=4 596 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)F 240690a_102515433064_100000210414 [0,1,1,0,0,0|2,0,0]=4 597 B15R1.113 CCC(=O)N(C)Cc1cccc(c1F)F 527a_102515433064_100000210414 [0,1,1,0,0,0|2,0,0]=4 598 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 11a_100000187426_100000210414 [0,1,1,0,0,0|2,0,0]=4 599 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 1626a_100000187426_100000210414 [0,1,1,0,0,0|2,0,0]=4 600 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 240690a_100000187426_100000210414 [0,1,1,0,0,0|2,0,0]=4 601 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 527a_100000187426_100000210414 [0,1,1,0,0,0|2,0,0]=4 602 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 11a_102516607250_100000210414 [0,1,1,0,0,0|2,0,0]=4 603 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 1626a_102516607250_100000210414 [0,1,1,0,0,0|2,0,0]=4 604 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 240690a_102516607250_100000210414 [0,1,1,0,0,0|2,0,0]=4 605 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 527a_102516607250_100000210414 [0,1,1,0,0,0|2,0,0]=4 606 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 11a_100000201194_100000210414 [0,1,1,0,0,0|2,0,0]=4 607 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 1626a_100000201194_100000210414 [0,1,1,0,0,0|2,0,0]=4 608 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 240690a_100000201194_100000210414 [0,1,1,0,0,0|2,0,0]=4 609 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 527a_100000201194_100000210414 [0,1,1,0,0,0|2,0,0]=4 610 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 11a_100000195558_100000210414 [0,1,1,0,0,0|2,0,0]=4 611 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 1626a_100000195558_100000210414 [0,1,1,0,0,0|2,0,0]=4 612 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 240690a_100000195558_100000210414 [0,1,1,0,0,0|2,0,0]=4 613 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 527a_100000195558_100000210414 [0,1,1,0,0,0|2,0,0]=4 614 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)O 1626a_100000201218_100000210414 [0,1,1,0,0,0|1,0,1]=4 615 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)O 240690a_100000201218_100000210414 [0,1,1,0,0,0|1,0,1]=4 616 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)O 527a_100000201218_100000210414 [0,1,1,0,0,0|1,0,1]=4 617 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Br)Cl 11a_100000711432_100000210414 [0,1,1,0,0,0|2,0,0]=4 618 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Br)Cl 1626a_100000711432_100000210414 [0,1,1,0,0,0|2,0,0]=4 619 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Br)Cl 240690a_100000711432_100000210414 [0,1,1,0,0,0|2,0,0]=4 620 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Br)Cl 527a_100000711432_100000210414 [0,1,1,0,0,0|2,0,0]=4 621 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 11a_106744473289_100000210414 [0,1,1,0,0,0|2,0,0]=4 622 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 1626a_106744473289_100000210414 [0,1,1,0,0,0|2,0,0]=4 623 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 240690a_106744473289_100000210414 [0,1,1,0,0,0|2,0,0]=4 624 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 527a_106744473289_100000210414 [0,1,1,0,0,0|2,0,0]=4 625 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Cl)Cl 11a_106354212996_100000210414 [0,1,1,0,0,0|2,0,0]=4 626 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Cl)Cl 1626a_106354212996_100000210414 [0,1,1,0,0,0|2,0,0]=4 627 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Cl)Cl 240690a_106354212996_100000210414 [0,1,1,0,0,0|2,0,0]=4 628 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1Cl)Cl 527a_106354212996_100000210414 [0,1,1,0,0,0|2,0,0]=4 629 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)Br 11a_100000748472_100000210414 [0,1,1,0,0,0|2,0,0]=4 630 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)Br 1626a_100000748472_100000210414 [0,1,1,0,0,0|2,0,0]=4 631 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)Br 240690a_100000748472_100000210414 [0,1,1,0,0,0|2,0,0]=4 632 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)Br 527a_100000748472_100000210414 [0,1,1,0,0,0|2,0,0]=4 633 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)C 11a_102515433075_100000210414 [0,1,1,0,0,0|2,0,0]=4 634 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)C 1626a_102515433075_100000210414 [0,1,1,0,0,0|2,0,0]=4 635 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)C 240690a_102515433075_100000210414 [0,1,1,0,0,0|2,0,0]=4 636 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)C 527a_102515433075_100000210414 [0,1,1,0,0,0|2,0,0]=4 637 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)F 11a_100000724026_100000210414 [0,1,1,0,0,0|2,0,0]=4 638 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)F 1626a_100000724026_100000210414 [0,1,1,0,0,0|2,0,0]=4 639 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)F 240690a_100000724026_100000210414 [0,1,1,0,0,0|2,0,0]=4 640 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1F)F 527a_100000724026_100000210414 [0,1,1,0,0,0|2,0,0]=4 641 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1O)Br 240690a_100011602694_100000210414 [0,1,1,0,0,0|2,0,0]=4 642 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1O)Br 527a_100011602694_100000210414 [0,1,1,0,0,0|2,0,0]=4 643 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1O)Cl 240690a_100000712467_100000210414 [0,1,1,0,0,0|2,0,0]=4 644 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1O)Cl 527a_100000712467_100000210414 [0,1,1,0,0,0|2,0,0]=4 645 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1O)F 240690a_114855342409_100000210414 [0,1,1,0,0,0|2,0,0]=4 646 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1O)F 527a_114855342409_100000210414 [0,1,1,0,0,0|2,0,0]=4 647 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 11a_100016988021_100000210414 [0,1,1,0,0,0|2,0,0]=4 648 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 1626a_100016988021_100000210414 [0,1,1,0,0,0|2,0,0]=4 649 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 240690a_100016988021_100000210414 [0,1,1,0,0,0|2,0,0]=4 650 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 527a_100016988021_100000210414 [0,1,1,0,0,0|2,0,0]=4 651 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)F)F 11a_100000720221_100000210414 [0,1,1,0,0,0|2,0,0]=4 652 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)F)F 1626a_100000720221_100000210414 [0,1,1,0,0,0|2,0,0]=4 653 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)F)F 240690a_100000720221_100000210414 [0,1,1,0,0,0|2,0,0]=4 654 B15R1.5515 CCC(=O)N(C)Cc1cc(cc(c1)F)F 527a_100000720221_100000210414 [0,1,1,0,0,0|2,0,0]=4 655 B15R1.5521 CCC(=O)C(C)Sc1ccc([n+](c1)[O-])C 62a_100000742827_100000703231 [0,1,1,0,0,0|2,0,0]=4 656 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)C)C 11a_100015204808_100000210414 [0,1,1,0,0,0|2,0,0]=4 657 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)C)C 1626a_100015204808_100000210414 [0,1,1,0,0,0|2,0,0]=4 658 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)C)C 240690a_100015204808_100000210414 [0,1,1,0,0,0|2,0,0]=4 659 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)C)C 527a_100015204808_100000210414 [0,1,1,0,0,0|2,0,0]=4 660 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 11a_100000184578_100000210414 [0,1,1,0,0,0|2,0,0]=4 661 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 1626a_100000184578_100000210414 [0,1,1,0,0,0|2,0,0]=4 662 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 240690a_100000184578_100000210414 [0,1,1,0,0,0|2,0,0]=4 663 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 527a_100000184578_100000210414 [0,1,1,0,0,0|2,0,0]=4 664 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100000210414 [0,1,1,0,0,0|1,0,1]=4 665 B15R1.8301 CC(C)C(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100009893295 [0,1,1,0,0,0|2,0,0]=4 666 B15R1.8301 CC(C)C(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100009893295_100009815978 [0,1,1,0,0,0|2,0,0]=4 667 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000210198 [0,1,1,0,0,0|2,0,0]=4 668 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000210198 [0,1,1,0,0,0|2,0,0]=4 669 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000210198 [0,1,1,0,0,0|2,0,0]=4 670 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000210198 [0,1,1,0,0,0|2,0,0]=4 671 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000210198 [0,1,1,0,0,0|2,0,0]=4 672 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000210198 [0,1,1,0,0,0|2,0,0]=4 673 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000210198 [0,1,1,0,0,0|2,0,0]=4 674 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000210198 [0,1,1,0,0,0|2,0,0]=4 675 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000210198 [0,1,1,0,0,0|2,0,0]=4 676 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000210198 [0,1,1,0,0,0|2,0,0]=4 677 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000210198 [0,1,1,0,0,0|2,0,0]=4 678 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000210198 [0,1,1,0,0,0|2,0,0]=4 679 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000210198 [0,1,1,0,0,0|1,0,1]=4 680 B15R1.8301 CC(C)C(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000210198 [0,1,1,0,0,0|1,0,1]=4 681 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000062450 [0,1,1,0,0,0|2,0,0]=4 682 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000062450 [0,1,1,0,0,0|2,0,0]=4 683 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000062450 [0,1,1,0,0,0|2,0,0]=4 684 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000062450 [0,1,1,0,0,0|2,0,0]=4 685 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000062450 [0,1,1,0,0,0|2,0,0]=4 686 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000062450 [0,1,1,0,0,0|2,0,0]=4 687 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000062450 [0,1,1,0,0,0|2,0,0]=4 688 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000062450 [0,1,1,0,0,0|2,0,0]=4 689 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000062450 [0,1,1,0,0,0|2,0,0]=4 690 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000062450 [0,1,1,0,0,0|2,0,0]=4 691 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000062450 [0,1,1,0,0,0|2,0,0]=4 692 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000062450 [0,1,1,0,0,0|2,0,0]=4 693 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000062450 [0,1,1,0,0,0|1,0,1]=4 694 B15R1.8301 CC(F)C(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000062450 [0,1,1,0,0,0|1,0,1]=4 695 B15R1.8301 C[C@@H](O)C(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000717761 [0,1,1,0,0,0|2,0,0]=4 696 B15R1.8301 C[C@@H](O)C(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000717761 [0,1,1,0,0,0|2,0,0]=4 697 B15R1.8301 C[C@@H](O)C(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000717761 [0,1,1,0,0,0|2,0,0]=4 698 B15R1.8301 C[C@@H](O)C(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000717761 [0,1,1,0,0,0|1,0,1]=4 699 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_217856618621 [0,1,1,0,0,0|2,0,0]=4 700 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_217856618621 [0,1,1,0,0,0|2,0,0]=4 701 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_217856618621 [0,1,1,0,0,0|2,0,0]=4 702 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_217856618621 [0,1,1,0,0,0|2,0,0]=4 703 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_217856618621 [0,1,1,0,0,0|2,0,0]=4 704 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_217856618621 [0,1,1,0,0,0|2,0,0]=4 705 B15R1.8301 C[C@H](O)C(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_217856618621 [0,1,1,0,0,0|1,0,1]=4 706 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)C 11a_102495364743_100000210198 [0,1,1,0,0,0|2,0,0]=4 707 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)C 1626a_102495364743_100000210198 [0,1,1,0,0,0|2,0,0]=4 708 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)C 240690a_102495364743_100000210198 [0,1,1,0,0,0|2,0,0]=4 709 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)C 527a_102495364743_100000210198 [0,1,1,0,0,0|2,0,0]=4 710 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)F 11a_102495364743_100000062450 [0,1,1,0,0,0|2,0,0]=4 711 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)F 1626a_102495364743_100000062450 [0,1,1,0,0,0|2,0,0]=4 712 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)F 240690a_102495364743_100000062450 [0,1,1,0,0,0|2,0,0]=4 713 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)C(C)F 527a_102495364743_100000062450 [0,1,1,0,0,0|2,0,0]=4 714 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)[C@@H](C)O 240690a_102495364743_100000717761 [0,1,1,0,0,0|2,0,0]=4 715 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)[C@H](C)O 1626a_102495364743_217856618621 [0,1,1,0,0,0|2,0,0]=4 716 B15R1.8301 Cc1cccc(c1)CN(C)C(=O)[C@H](C)O 240690a_102495364743_217856618621 [0,1,1,0,0,0|2,0,0]=4 717 B15R1.66 COc1cccc(c1)C(C)N(C)C(=O)C 11a_100011194365_100015343762 [0,1,1,0,0,0|1,0,1]=4 718 B15R1.66 COc1cccc(c1)C(C)N(C)C(=O)C 1626a_100011194365_100015343762 [0,1,1,0,0,0|1,0,1]=4 719 B15R1.66 COc1cccc(c1)C(C)N(C)C(=O)C 240690a_100011194365_100015343762 [0,1,1,0,0,0|1,0,1]=4 720 B15R1.66 COc1cccc(c1)C(C)N(C)C(=O)C 527a_100011194365_100103153847 [0,1,1,0,0,0|1,0,1]=4 721 B15R1.121 CC(=O)C(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100011261029 [0,1,1,0,0,0|2,0,0]=4 722 B15R1.121 CC(C)C(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000753385 [0,1,1,0,0,0|2,0,0]=4 723 B15R1.121 CC(C)C(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000753385 [0,1,1,0,0,0|2,0,0]=4 724 B15R1.121 CN(C)C(=O)CCCc1cccc(c1)Br 11a_100102631434_100000685939 [0,1,1,0,0,0|2,0,0]=4 725 B15R1.121 CN(C)C(=O)CCCc1cccc(c1)Br 1626a_100102631434_100000685939 [0,1,1,0,0,0|2,0,0]=4 726 B15R1.121 CN(C)C(=O)CCCc1cccc(c1)Br 240690a_100102631434_100000685939 [0,1,1,0,0,0|2,0,0]=4 727 B15R1.121 CN(C)C(=O)CCCc1cccc(c1)Br 527a_100102631434_100000685939 [0,1,1,0,0,0|2,0,0]=4 728 B15R1.121 CN(C)C(=O)CCNc1c[n+](ccn1)[O-] 27a_100000738053_100009880115 [0,1,1,0,0,0|2,0,0]=4 729 B15R1.121 CN(C)C(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000737620 [0,1,1,0,0,0|1,0,0]=3 730 B15R1.121 CN(C)C(=O)CCSc1c[n+](ccn1)[O-] 62a_100000737620_100009880115 [0,1,1,0,0,0|2,0,0]=4 731 B15R1.121 CN(C)C(=O)CCSc1ccc[n+](c1)C 62a_100000737620_100009996589 [0,1,1,0,0,0|2,0,0]=4 732 B15R1.121 CN(C)C(=O)CCSc1ccc[n+](c1)C 62a_100009996589_100000737620 [0,1,1,0,0,0|2,0,0]=4 733 B15R1.121 CN(C)C(=O)CCSc1ccc[n+](c1)[O-] 62a_100000737620_100009815978 [0,1,1,0,0,0|1,0,0]=3 734 B15R1.121 CN(C)C(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000692301 [0,1,1,0,0,0|1,0,0]=3 735 B15R1.121 CN(C)C(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000692301 [0,1,1,0,0,0|1,0,0]=3 736 B15R1.133 CNC(=O)CCN(C)c1c[n+](ccn1)[O-] 27a_100000750875_100009880115 [0,1,1,0,0,0|2,0,0]=4 737 B15R1.633 CCCC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000747444 [0,1,1,0,0,0|2,0,0]=4 738 B15R1.633 CCNC(=O)CCCc1cccc(c1)Br 11a_100015525214_100000685939 [0,1,1,0,0,0|2,0,0]=4 739 B15R1.633 CCNC(=O)CCCc1cccc(c1)Br 240690a_100015525214_100000685939 [0,1,1,0,0,0|2,0,0]=4 740 B15R1.633 CCNC(=O)CCCc1cccc(c1)Br 527a_100015525214_100000685939 [0,1,1,0,0,0|2,0,0]=4 741 B15R1.633 CCNC(=O)CCNc1c[n+](ccn1)[O-] 27a_100025743525_100009880115 [0,1,1,0,0,0|2,0,0]=4 742 B15R1.633 CCNC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000737597 [0,1,1,0,0,0|1,0,0]=3 743 B15R1.633 CCNC(=O)CCSc1c[n+](ccn1)[O-] 62a_100000737597_100009880115 [0,1,1,0,0,0|2,0,0]=4 744 B15R1.633 CCNC(=O)CCSc1ccc[n+](c1)C 62a_100000737597_100009996589 [0,1,1,0,0,0|2,0,0]=4 745 B15R1.633 CCNC(=O)CCSc1ccc[n+](c1)C 62a_100009996589_100000737597 [0,1,1,0,0,0|2,0,0]=4 746 B15R1.633 CCNC(=O)CCSc1ccc[n+](c1)[O-] 62a_100000737597_100009815978 [0,1,1,0,0,0|1,0,0]=3 747 B15R1.633 CCNC(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000183381 [0,1,1,0,0,0|1,0,0]=3 748 B15R1.633 CCNC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000183381 [0,1,1,0,0,0|1,0,0]=3 749 B15R1.633 CCOC(=O)CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000765890 [0,1,1,0,0,0|2,0,0]=4 750 B15R1.633 CCOC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100011206558 [0,1,1,0,0,0|2,0,0]=4 751 B15R1.633 CCOC(=O)CCSc1ccc[n+](c1)[O-] 62a_100000765890_100009815978 [0,1,1,0,0,0|2,0,0]=4 752 B15R1.633 CCOC(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000188475 [0,1,1,0,0,0|2,0,0]=4 753 B15R1.633 CCOC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000188475 [0,1,1,0,0,0|2,0,0]=4 754 B15R1.633 CNNC(=O)CCCc1cccc(c1)Br 22a_100016993582_100000685939 [0,1,1,0,0,0|2,0,0]=4 755 B15R1.633 O=C(COCc1ccc[n+](c1)[O-])NCO 34a_100000037817_100000185155 [0,1,1,0,0,0|1,0,0]=3 756 B15R1.633 O=C(COCc1ccc[n+](c1)[O-])NCO 7a_100000037817_100000185155 [0,1,1,0,0,0|1,0,0]=3 757 B15R1.982 COC(=O)CC(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100009817358 [0,1,1,0,0,0|2,0,0]=4 758 B15R1.982 COC(=O)CC(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100009817358 [0,1,1,0,0,0|2,0,0]=4 759 B15R1.982 COC(=O)CC(C)Sc1ccc[n+](c1)[O-] 62a_100009817358_100009815978 [0,1,1,0,0,0|2,0,0]=4 760 B15R1.1002 CCC(=O)C(C)OCc1ccc[n+](c1)[O-] 7a_100000037817_100000742827 [0,1,1,0,0,0|2,0,0]=4 761 B15R1.1002 CNC(=O)C(C)CNc1c[n+](ccn1)[O-] 27a_100015187722_100009880115 [0,1,1,0,0,0|2,0,0]=4 762 B15R1.1002 CNC(=O)C(C)OCc1ccc[n+](c1)[O-] 34a_100000037817_100000731044 [0,1,1,0,0,0|1,0,0]=3 763 B15R1.1002 CNC(=O)C(C)OCc1ccc[n+](c1)[O-] 7a_100000037817_100000209862 [0,1,1,0,0,0|1,0,0]=3 764 B15R1.1002 CNC(=O)C(F)OCc1ccc[n+](c1)[O-] 34a_100000037817_100009813575 [0,1,1,0,0,0|1,0,0]=3 765 B15R1.1002 CNC(=O)C(F)OCc1ccc[n+](c1)[O-] 7a_100000037817_100009813575 [0,1,1,0,0,0|1,0,0]=3 766 B15R1.1002 COC(=O)C(C)COc1ccc[n+](c1)[O-] 34a_100000039713_100000698445 [0,1,1,0,0,0|2,0,0]=4 767 B15R1.1002 COC(=O)C(C)CSc1ccc[n+](c1)[O-] 62a_100000698445_100009815978 [0,1,1,0,0,0|2,0,0]=4 768 B15R1.1002 COC(=O)C(C)OCc1ccc[n+](c1)[O-] 34a_100000037817_100000211248 [0,1,1,0,0,0|2,0,0]=4 769 B15R1.1002 COC(=O)C(C)OCc1ccc[n+](c1)[O-] 7a_100000037817_100000211248 [0,1,1,0,0,0|2,0,0]=4 770 B15R1.1569 CC[n+]1cccc(c1)OCCC(=O)NC 34a_100000731997_100012179268 [0,1,1,0,0,0|2,0,0]=4 771 B15R1.1569 CC[n+]1cccc(c1)OCCC(=O)NC 7a_100000731997_100000737683 [0,1,1,0,0,0|2,0,0]=4 772 B15R1.11630 CNC(=O)CCCc1ccc(c(c1)C)F 11a_106832991635_100011998530 [0,1,1,0,0,0|2,0,0]=4 773 B15R1.11630 CNC(=O)CCCc1ccc(c(c1)C)F 1626a_100102657272_100011998530 [0,1,1,0,0,0|2,0,0]=4 774 B15R1.11630 CNC(=O)CCCc1ccc(c(c1)C)F 240690a_100102657272_100011998530 [0,1,1,0,0,0|2,0,0]=4 775 B15R1.11630 CNC(=O)CCCc1ccc(c(c1)C)F 527a_100102657272_100011998530 [0,1,1,0,0,0|2,0,0]=4 776 B15R1.11630 CNC(=O)CCSc1ccc([n+](c1)[O-])C 62a_100000737683_100000703231 [0,1,1,0,0,0|1,0,0]=3 777 B15R1.11630 COC(=O)CCSc1ccc([n+](c1)[O-])C 62a_100000204255_100000703231 [0,1,1,0,0,0|2,0,0]=4 778 B15R2.299 Cc1ccc(c[n+]1[O-])C2=CC(=O)CC2 271570a_100010737933_100000703231 [1,1,0,0,0,0|1,0,1]=4 779 B15R2.335 O=C1CCCC1Oc2ccc[n+](c2)[O-] 34a_100000039713_100000709159 [0,0,1,1,0,0|2,0,0]=4 780 B15R2.335 O=C1CCCC1Oc2ccc[n+](c2)[O-] 7a_100000039713_100000211823 [0,0,1,1,0,0|2,0,0]=4 781 B15R2.335 O=C1CCCC1Sc2ccc[n+](c2)[O-] 62a_100000211823_100009815978 [0,0,1,1,0,0|2,0,0]=4 782 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 11a_100000702344_100000210414 [0,0,1,1,0,0|2,0,0]=4 783 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 1626a_100000702344_100000210414 [0,0,1,1,0,0|2,0,0]=4 784 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 240690a_100000702344_100000210414 [0,0,1,1,0,0|2,0,0]=4 785 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 527a_100000702344_100000210414 [0,0,1,1,0,0|2,0,0]=4 786 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 11a_100015205306_100000210414 [0,0,1,1,0,0|2,0,0]=4 787 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 1626a_100015205306_100000210414 [0,0,1,1,0,0|2,0,0]=4 788 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 240690a_100015205306_100000210414 [0,0,1,1,0,0|2,0,0]=4 789 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 527a_100015205306_100000210414 [0,0,1,1,0,0|2,0,0]=4 790 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 11a_100000766377_100000210414 [0,0,1,1,0,0|2,0,0]=4 791 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 1626a_100000766377_100000210414 [0,0,1,1,0,0|2,0,0]=4 792 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 240690a_100000766377_100000210414 [0,0,1,1,0,0|2,0,0]=4 793 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 527a_100000766377_100000210414 [0,0,1,1,0,0|2,0,0]=4 794 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)O 240690a_100015195982_100000210414 [0,0,1,1,0,0|1,0,1]=4 795 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)O 527a_100015195982_100000210414 [0,0,1,1,0,0|1,0,1]=4 796 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Br 11a_100000703859_100000210414 [0,0,1,1,0,0|2,0,0]=4 797 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Br 1626a_100000703859_100000210414 [0,0,1,1,0,0|2,0,0]=4 798 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Br 240690a_100000703859_100000210414 [0,0,1,1,0,0|2,0,0]=4 799 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Br 527a_100000703859_100000210414 [0,0,1,1,0,0|2,0,0]=4 800 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)C 11a_100020635169_100000210414 [0,0,1,1,0,0|2,0,0]=4 801 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)C 1626a_100020635169_100000210414 [0,0,1,1,0,0|2,0,0]=4 802 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)C 240690a_100020635169_100000210414 [0,0,1,1,0,0|2,0,0]=4 803 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)C 527a_100020635169_100000210414 [0,0,1,1,0,0|2,0,0]=4 804 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Cl 11a_100000731892_100000210414 [0,0,1,1,0,0|2,0,0]=4 805 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Cl 1626a_100000731892_100000210414 [0,0,1,1,0,0|2,0,0]=4 806 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Cl 240690a_100000731892_100000210414 [0,0,1,1,0,0|2,0,0]=4 807 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)Cl 527a_100000731892_100000210414 [0,0,1,1,0,0|2,0,0]=4 808 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)F 11a_100000051403_100000210414 [0,0,1,1,0,0|2,0,0]=4 809 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)F 1626a_100000051403_100000210414 [0,0,1,1,0,0|2,0,0]=4 810 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)F 240690a_100000051403_100000210414 [0,0,1,1,0,0|2,0,0]=4 811 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)F 527a_100000051403_100000210414 [0,0,1,1,0,0|2,0,0]=4 812 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)O 240690a_100015191671_100000210414 [0,0,1,1,0,0|1,0,1]=4 813 B15R2.1598 CCC(=O)N1Cc2cccc(c2C1)O 527a_100015191671_100000210414 [0,0,1,1,0,0|1,0,1]=4 814 B15R2.329 O=C1CCC1OCc2ccc[n+](c2)[O-] 34a_100000037817_100009892977 [0,0,1,1,0,0|2,0,0]=4 815 B15R2.329 O=C1CCC1OCc2ccc[n+](c2)[O-] 7a_100000037817_100009892977 [0,0,1,1,0,0|2,0,0]=4 816 B15R2.1115 O=C1CC(CN1)Nc2c[n+](ccn2)[O-] 27a_100000697751_100009880115 [0,0,1,1,0,0|2,0,0]=4 817 B15R2.19094 CNC(=O)C1CCc2c1ccc(c2)C 11a_106832991635_100000103084 [0,0,1,1,0,0|2,0,0]=4 818 B15R2.19094 CNC(=O)C1CCc2c1ccc(c2)C 1626a_100102657272_100000103084 [0,0,1,1,0,0|2,0,0]=4 819 B15R2.19094 CNC(=O)C1CCc2c1ccc(c2)C 240690a_100102657272_100000103084 [0,0,1,1,0,0|2,0,0]=4 820 B15R2.19094 CNC(=O)C1CCc2c1ccc(c2)C 527a_100102657272_100000103084 [0,0,1,1,0,0|2,0,0]=4 821 B15R2.63978 CN1C(=O)CCCc2c1ccc(c2)O 271570a_203496583355_100016171256 [0,0,1,1,0,0|1,0,1]=4 822 B13R1.704 CCC(=O)N(C)Cc1cccn1C 11a_100000188278_100000210414 [0,0,1,0,1,0|1,0,1]=4 823 B13R1.704 CCC(=O)N(C)Cc1cccn1C 527a_100000188278_100000210414 [0,0,1,0,1,0|1,0,1]=4 824 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 11a_106832991635_200010160685 [0,0,1,0,0,1|2,0,0]=4 825 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 1626a_100102657272_200010160685 [0,0,1,0,0,1|2,0,0]=4 826 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 240690a_100102657272_200010160685 [0,0,1,0,0,1|2,0,0]=4 827 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 527a_100102657272_200010160685 [0,0,1,0,0,1|2,0,0]=4 828 B15R1.942 CNC(=O)CCCNc1c[n+](ccn1)[O-] 27a_100000740002_100009880115 [0,0,1,0,0,1|1,0,0]=3 829 B15R1.942 CNC(=O)CCCNc1cccc(c1)Br 34a_100000210019_100000741757 [0,0,1,0,0,1|2,0,0]=4 830 B15R1.942 CNC(=O)CCCNc1cccc(c1)C 2230a_100000188690_100000741757 [0,0,1,0,0,1|2,0,0]=4 831 B15R1.942 CNC(=O)CCCNc1cccc(c1)C 34a_100000188690_100000741757 [0,0,1,0,0,1|2,0,0]=4 832 B15R1.942 CNC(=O)CCCNc1cccc(c1)Cl 34a_100000185859_100000741757 [0,0,1,0,0,1|2,0,0]=4 833 B15R1.942 CNC(=O)CCCNc1cccc(c1)F 34a_100000210047_100000741757 [0,0,1,0,0,1|2,0,0]=4 834 B15R1.942 CNC(=O)CCCNc1cccc(c1)I 34a_100000211102_100000741757 [0,0,1,0,0,1|2,0,0]=4 835 B15R1.942 CNC(=O)CCCNc1cccc(c1)O 34a_100000210217_100000741757 [0,0,1,0,0,1|1,0,1]=4 836 B15R1.942 CNC(=O)CCCOc1ccc[n+](c1)[O-] 34a_100000039713_100000741757 [0,0,1,0,0,1|0,0,0]=2 837 B15R1.942 CNC(=O)CCCOc1ccc[n+](c1)[O-] 7a_100000039713_100000741757 [0,0,1,0,0,1|0,0,0]=2 838 B15R1.942 CNC(=O)CCCOc1cccc(c1)Br 34a_100000210342_100000741757 [0,0,1,0,0,1|2,0,0]=4 839 B15R1.942 CNC(=O)CCCOc1cccc(c1)Br 7a_100000210342_100000741757 [0,0,1,0,0,1|2,0,0]=4 840 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 11a_106832991635_100000183260 [0,0,1,0,0,1|2,0,0]=4 841 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 1626a_100102657272_100000183260 [0,0,1,0,0,1|2,0,0]=4 842 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 240690a_100102657272_100000183260 [0,0,1,0,0,1|2,0,0]=4 843 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 34a_100000210337_100000741757 [0,0,1,0,0,1|2,0,0]=4 844 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 527a_100102657272_100000183260 [0,0,1,0,0,1|2,0,0]=4 845 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 7a_100000210337_100000741757 [0,0,1,0,0,1|2,0,0]=4 846 B15R1.942 CNC(=O)CCCOc1cccc(c1)Cl 34a_100000210295_100000741757 [0,0,1,0,0,1|2,0,0]=4 847 B15R1.942 CNC(=O)CCCOc1cccc(c1)Cl 7a_100000210295_100000741757 [0,0,1,0,0,1|2,0,0]=4 848 B15R1.942 CNC(=O)CCCOc1cccc(c1)F 34a_100000210426_100000741757 [0,0,1,0,0,1|2,0,0]=4 849 B15R1.942 CNC(=O)CCCOc1cccc(c1)F 7a_100000210426_100000741757 [0,0,1,0,0,1|2,0,0]=4 850 B15R1.942 CNC(=O)CCCOc1cccc(c1)I 34a_100000211634_100000741757 [0,0,1,0,0,1|2,0,0]=4 851 B15R1.942 CNC(=O)CCCOc1cccc(c1)I 7a_100000211634_100000741757 [0,0,1,0,0,1|2,0,0]=4 852 B15R1.942 CNC(=O)CCCOc1cccc(c1)N 34a_100000210217_100000741757 [0,0,1,0,0,1|2,0,0]=4 853 B15R1.942 CNC(=O)CCCOc1cccc(c1)O 240690a_100102657272_200009913207 [0,0,1,0,0,1|1,0,1]=4 854 B15R1.942 CNC(=O)CCCOc1cccc(c1)O 527a_100102657272_200009913207 [0,0,1,0,0,1|1,0,1]=4 855 B15R1.942 CNC(=O)CCCSc1c[n+](ccn1)[O-] 62a_100000741757_100009880115 [0,0,1,0,0,1|1,0,0]=3 856 B15R1.942 CNC(=O)CCCSc1ccc[n+](c1)C 62a_100000741757_100009996589 [0,0,1,0,0,1|1,0,0]=3 857 B15R1.942 CNC(=O)CCCSc1ccc[n+](c1)C 62a_100009996589_100000741757 [0,0,1,0,0,1|1,0,0]=3 858 B15R1.942 CNC(=O)CCCSc1ccc[n+](c1)[O-] 62a_100000741757_100009815978 [0,0,1,0,0,1|0,0,0]=2 859 B15R1.942 CNC(=O)CCCSc1cccc(c1)Br 62a_100000691529_100000741757 [0,0,1,0,0,1|2,0,0]=4 860 B15R1.942 CNC(=O)CCCSc1cccc(c1)Br 62a_100000741757_100000691529 [0,0,1,0,0,1|2,0,0]=4 861 B15R1.942 CNC(=O)CCCSc1cccc(c1)C 62a_100000741757_100011215228 [0,0,1,0,0,1|2,0,0]=4 862 B15R1.942 CNC(=O)CCCSc1cccc(c1)C 62a_100011215228_100000741757 [0,0,1,0,0,1|2,0,0]=4 863 B15R1.942 CNC(=O)CCCSc1cccc(c1)Cl 62a_100000699651_100000741757 [0,0,1,0,0,1|2,0,0]=4 864 B15R1.942 CNC(=O)CCCSc1cccc(c1)Cl 62a_100000741757_100000699651 [0,0,1,0,0,1|2,0,0]=4 865 B15R1.942 CNC(=O)CCCSc1cccc(c1)F 62a_100000685547_100000741757 [0,0,1,0,0,1|2,0,0]=4 866 B15R1.942 CNC(=O)CCCSc1cccc(c1)F 62a_100000741757_100000685547 [0,0,1,0,0,1|2,0,0]=4 867 B15R1.942 CNC(=O)CCCSc1cccc(c1)N 62a_100000210019_100000741757 [0,0,1,0,0,1|2,0,0]=4 868 B15R1.942 CNC(=O)CCCSc1cccc(c1)N 62a_100000741757_100000210019 [0,0,1,0,0,1|2,0,0]=4 869 B15R1.942 CNC(=O)CCCSc1cccc(c1)O 62a_100000741757_100000211634 [0,0,1,0,0,1|1,0,1]=4 870 B15R1.942 CNC(=O)CCCSc1cccc(c1)[S] 62a_100000741757_114929384022 [0,0,1,0,0,1|1,1,0]=4 871 B15R1.942 CNC(=O)CCCSc1cccc(c1)[S] 62a_114929384022_100000741757 [0,0,1,0,0,1|1,1,0]=4 872 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 207a_100000738227_100000210085 [0,0,1,0,0,1|2,0,0]=4 873 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 2230a_100000174977_100000737683 [0,0,1,0,0,1|2,0,0]=4 874 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 2230a_100000738227_100000698116 [0,0,1,0,0,1|2,0,0]=4 875 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 270004a_100000738227_100000210085 [0,0,1,0,0,1|2,0,0]=4 876 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 34a_100000174977_100012179268 [0,0,1,0,0,1|2,0,0]=4 877 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 34a_100000738227_100000698116 [0,0,1,0,0,1|2,0,0]=4 878 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 207a_100000738227_100000211157 [0,0,1,0,0,1|2,0,0]=4 879 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 2230a_100000185548_100000737683 [0,0,1,0,0,1|2,0,0]=4 880 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 2230a_100000738227_100000211840 [0,0,1,0,0,1|2,0,0]=4 881 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 270004a_100000738227_100000211157 [0,0,1,0,0,1|2,0,0]=4 882 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 34a_100000185548_100012179268 [0,0,1,0,0,1|2,0,0]=4 883 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 34a_100000738227_100000211840 [0,0,1,0,0,1|2,0,0]=4 884 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 207a_100000738227_100000210801 [0,0,1,0,0,1|2,0,0]=4 885 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 2230a_100000174878_100000737683 [0,0,1,0,0,1|2,0,0]=4 886 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 2230a_100000738227_100000181238 [0,0,1,0,0,1|2,0,0]=4 887 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 270004a_100000738227_100000210801 [0,0,1,0,0,1|2,0,0]=4 888 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 34a_100000174878_100012179268 [0,0,1,0,0,1|2,0,0]=4 889 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 34a_100000738227_100000187163 [0,0,1,0,0,1|2,0,0]=4 890 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 207a_100000738227_100000210812 [0,0,1,0,0,1|2,0,0]=4 891 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 2230a_100000174948_100000737683 [0,0,1,0,0,1|2,0,0]=4 892 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 2230a_100000738227_100000230114 [0,0,1,0,0,1|2,0,0]=4 893 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 270004a_100000738227_100000210812 [0,0,1,0,0,1|2,0,0]=4 894 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 34a_100000174948_100012179268 [0,0,1,0,0,1|2,0,0]=4 895 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 34a_100000738227_100000187166 [0,0,1,0,0,1|2,0,0]=4 896 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 207a_100000738227_100000014684 [0,0,1,0,0,1|2,0,0]=4 897 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 2230a_100000106179_100000737683 [0,0,1,0,0,1|2,0,0]=4 898 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 2230a_100000738227_100011218688 [0,0,1,0,0,1|2,0,0]=4 899 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 270004a_100000738227_100000014684 [0,0,1,0,0,1|2,0,0]=4 900 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 34a_100000106179_100012179268 [0,0,1,0,0,1|2,0,0]=4 901 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 34a_100000738227_100011218688 [0,0,1,0,0,1|2,0,0]=4 902 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 207a_100000738227_100000188321 [0,0,1,0,0,1|1,0,1]=4 903 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 2230a_100000738227_100011660834 [0,0,1,0,0,1|1,0,1]=4 904 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 2230a_100000743036_100000737683 [0,0,1,0,0,1|1,0,1]=4 905 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 270004a_100000738227_100000188321 [0,0,1,0,0,1|1,0,1]=4 906 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 34a_100000738227_100011660834 [0,0,1,0,0,1|1,0,1]=4 907 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 34a_100000743036_100012179268 [0,0,1,0,0,1|1,0,1]=4 908 B15R1.942 CNC(=O)CCOCc1ccc[n+](c1)[O-] 34a_100000037817_100012179268 [0,0,1,0,0,1|0,0,0]=2 909 B15R1.942 CNC(=O)CCOCc1ccc[n+](c1)[O-] 7a_100000037817_100000737683 [0,0,1,0,0,1|0,0,0]=2 910 B15R1.942 CNC(=O)CCOCc1cccc(c1)Br 34a_100000687537_100012179268 [0,0,1,0,0,1|2,0,0]=4 911 B15R1.942 CNC(=O)CCOCc1cccc(c1)Br 34a_100000754576_100000698116 [0,0,1,0,0,1|2,0,0]=4 912 B15R1.942 CNC(=O)CCOCc1cccc(c1)Br 7a_100000687537_100000737683 [0,0,1,0,0,1|2,0,0]=4 913 B15R1.942 CNC(=O)CCOCc1cccc(c1)C 34a_100000754576_100000211840 [0,0,1,0,0,1|2,0,0]=4 914 B15R1.942 CNC(=O)CCOCc1cccc(c1)C 34a_100011217746_100012179268 [0,0,1,0,0,1|2,0,0]=4 915 B15R1.942 CNC(=O)CCOCc1cccc(c1)C 7a_100011217746_100000737683 [0,0,1,0,0,1|2,0,0]=4 916 B15R1.942 CNC(=O)CCOCc1cccc(c1)Cl 34a_100000241301_100012179268 [0,0,1,0,0,1|2,0,0]=4 917 B15R1.942 CNC(=O)CCOCc1cccc(c1)Cl 34a_100000754576_100000187163 [0,0,1,0,0,1|2,0,0]=4 918 B15R1.942 CNC(=O)CCOCc1cccc(c1)Cl 7a_100000241301_100000737683 [0,0,1,0,0,1|2,0,0]=4 919 B15R1.942 CNC(=O)CCOCc1cccc(c1)F 34a_100000210976_100012179268 [0,0,1,0,0,1|2,0,0]=4 920 B15R1.942 CNC(=O)CCOCc1cccc(c1)F 34a_100000754576_100000187166 [0,0,1,0,0,1|2,0,0]=4 921 B15R1.942 CNC(=O)CCOCc1cccc(c1)F 7a_100000210976_100000737683 [0,0,1,0,0,1|2,0,0]=4 922 B15R1.942 CNC(=O)CCOCc1cccc(c1)I 34a_100000754576_100011218688 [0,0,1,0,0,1|2,0,0]=4 923 B15R1.942 CNC(=O)CCOCc1cccc(c1)I 34a_100011215336_100012179268 [0,0,1,0,0,1|2,0,0]=4 924 B15R1.942 CNC(=O)CCOCc1cccc(c1)I 7a_100011215336_100000737683 [0,0,1,0,0,1|2,0,0]=4 925 B15R1.942 CNC(=O)CCOCc1cccc(c1)N 34a_100000211919_100012179268 [0,0,1,0,0,1|2,0,0]=4 926 B15R1.942 CNC(=O)CCOCc1cccc(c1)O 34a_100000754576_100011660834 [0,0,1,0,0,1|1,0,1]=4 927 B15R1.942 CNC(=O)CCSCc1cccc(c1)Br 62a_100000211773_100000737683 [0,0,1,0,0,1|2,0,0]=4 928 B15R1.942 CNC(=O)CCSCc1cccc(c1)Br 62a_100000737683_100000211773 [0,0,1,0,0,1|2,0,0]=4 929 B15R1.942 CNC(=O)CCSCc1cccc(c1)C 62a_100000211840_100000737683 [0,0,1,0,0,1|2,0,0]=4 930 B15R1.942 CNC(=O)CCSCc1cccc(c1)C 62a_100000737683_100000211840 [0,0,1,0,0,1|2,0,0]=4 931 B15R1.942 CNC(=O)CCSCc1cccc(c1)Cl 62a_100000187163_100000737683 [0,0,1,0,0,1|2,0,0]=4 932 B15R1.942 CNC(=O)CCSCc1cccc(c1)Cl 62a_100000737683_100000187163 [0,0,1,0,0,1|2,0,0]=4 933 B15R1.942 CNC(=O)CCSCc1cccc(c1)F 62a_100000230114_100000737683 [0,0,1,0,0,1|2,0,0]=4 934 B15R1.942 CNC(=O)CCSCc1cccc(c1)F 62a_100000737683_100000230114 [0,0,1,0,0,1|2,0,0]=4 935 B15R1.942 CNC(=O)CCSCc1cccc(c1)I 62a_100000737683_100011218688 [0,0,1,0,0,1|2,0,0]=4 936 B15R1.942 CNC(=O)CCSCc1cccc(c1)I 62a_100011218688_100000737683 [0,0,1,0,0,1|2,0,0]=4 937 B15R1.942 CNC(=O)CCSCc1cccc(c1)O 62a_100000737683_100011660834 [0,0,1,0,0,1|1,0,1]=4 938 B15R1.942 CNC(=O)CCSCc1cccc(c1)O 62a_100011660834_100000737683 [0,0,1,0,0,1|1,0,1]=4 939 B15R1.942 CNC(=O)CNCCc1cccc(c1)Br 2230a_100000693194_100011740638 [0,0,1,0,0,1|2,0,0]=4 940 B15R1.942 CNC(=O)CNCCc1cccc(c1)Br 2230a_100011207229_100000183359 [0,0,1,0,0,1|2,0,0]=4 941 B15R1.942 CNC(=O)CNCCc1cccc(c1)Br 34a_100011207229_100000183359 [0,0,1,0,0,1|2,0,0]=4 942 B15R1.942 CNC(=O)CNCCc1cccc(c1)C 2230a_100000693194_100011713685 [0,0,1,0,0,1|2,0,0]=4 943 B15R1.942 CNC(=O)CNCCc1cccc(c1)C 2230a_100000749837_100000183359 [0,0,1,0,0,1|2,0,0]=4 944 B15R1.942 CNC(=O)CNCCc1cccc(c1)C 34a_100000749837_100000183359 [0,0,1,0,0,1|2,0,0]=4 945 B15R1.942 CNC(=O)CNCCc1cccc(c1)Cl 2230a_100000185263_100000183359 [0,0,1,0,0,1|2,0,0]=4 946 B15R1.942 CNC(=O)CNCCc1cccc(c1)Cl 2230a_100000693194_100011713710 [0,0,1,0,0,1|2,0,0]=4 947 B15R1.942 CNC(=O)CNCCc1cccc(c1)Cl 34a_100000185263_100000183359 [0,0,1,0,0,1|2,0,0]=4 948 B15R1.942 CNC(=O)CNCCc1cccc(c1)F 2230a_100000205154_100000183359 [0,0,1,0,0,1|2,0,0]=4 949 B15R1.942 CNC(=O)CNCCc1cccc(c1)F 2230a_100000693194_100011217235 [0,0,1,0,0,1|2,0,0]=4 950 B15R1.942 CNC(=O)CNCCc1cccc(c1)F 34a_100000205154_100000183359 [0,0,1,0,0,1|2,0,0]=4 951 B15R1.942 CNC(=O)CNCCc1cccc(c1)O 2230a_100000747277_100000183359 [0,0,1,0,0,1|1,0,1]=4 952 B15R1.942 CNC(=O)CNCCc1cccc(c1)O 34a_100000747277_100000183359 [0,0,1,0,0,1|1,0,1]=4 953 B15R1.942 CNC(=O)COCCc1cccc(c1)Br 34a_100000750040_100011740638 [0,0,1,0,0,1|2,0,0]=4 954 B15R1.942 CNC(=O)COCCc1cccc(c1)Br 34a_100011217444_100000183359 [0,0,1,0,0,1|2,0,0]=4 955 B15R1.942 CNC(=O)COCCc1cccc(c1)Br 7a_100011217444_100000183359 [0,0,1,0,0,1|2,0,0]=4 956 B15R1.942 CNC(=O)COCCc1cccc(c1)C 34a_100000750040_100011713685 [0,0,1,0,0,1|2,0,0]=4 957 B15R1.942 CNC(=O)COCCc1cccc(c1)C 34a_100011217157_100000183359 [0,0,1,0,0,1|2,0,0]=4 958 B15R1.942 CNC(=O)COCCc1cccc(c1)C 7a_100011217157_100000183359 [0,0,1,0,0,1|2,0,0]=4 959 B15R1.942 CNC(=O)COCCc1cccc(c1)Cl 34a_100000750040_100011713710 [0,0,1,0,0,1|2,0,0]=4 960 B15R1.942 CNC(=O)COCCc1cccc(c1)Cl 34a_100000754733_100000183359 [0,0,1,0,0,1|2,0,0]=4 961 B15R1.942 CNC(=O)COCCc1cccc(c1)Cl 7a_100000754733_100000183359 [0,0,1,0,0,1|2,0,0]=4 962 B15R1.942 CNC(=O)COCCc1cccc(c1)F 34a_100000750040_100011217235 [0,0,1,0,0,1|2,0,0]=4 963 B15R1.942 CNC(=O)COCCc1cccc(c1)F 34a_100000763591_100000183359 [0,0,1,0,0,1|2,0,0]=4 964 B15R1.942 CNC(=O)COCCc1cccc(c1)F 7a_100000763591_100000183359 [0,0,1,0,0,1|2,0,0]=4 965 B15R1.942 CNC(=O)COCCc1cccc(c1)N 34a_100011996697_100000183359 [0,0,1,0,0,1|2,0,0]=4 966 B15R1.942 CNC(=O)CSCCc1cccc(c1)Br 62a_100000183359_100011740638 [0,0,1,0,0,1|2,0,0]=4 967 B15R1.942 CNC(=O)CSCCc1cccc(c1)Br 62a_100011740638_100000183359 [0,0,1,0,0,1|2,0,0]=4 968 B15R1.942 CNC(=O)CSCCc1cccc(c1)C 62a_100000183359_100011713685 [0,0,1,0,0,1|2,0,0]=4 969 B15R1.942 CNC(=O)CSCCc1cccc(c1)C 62a_100011713685_100000183359 [0,0,1,0,0,1|2,0,0]=4 970 B15R1.942 CNC(=O)CSCCc1cccc(c1)Cl 62a_100000183359_100011713710 [0,0,1,0,0,1|2,0,0]=4 971 B15R1.942 CNC(=O)CSCCc1cccc(c1)Cl 62a_100011713710_100000183359 [0,0,1,0,0,1|2,0,0]=4 972 B15R1.942 CNC(=O)CSCCc1cccc(c1)F 62a_100000183359_100011217235 [0,0,1,0,0,1|2,0,0]=4 973 B15R1.942 CNC(=O)CSCCc1cccc(c1)F 62a_100011217235_100000183359 [0,0,1,0,0,1|2,0,0]=4 974 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 2708a_100000753791_106832991635 [0,0,1,0,0,1|2,0,0]=4 975 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 2708a_100102657272_100000753791 [0,0,1,0,0,1|2,0,0]=4 976 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 273464a_100000753791_100102657272 [0,0,1,0,0,1|2,0,0]=4 977 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 273464a_100102657272_100000753791 [0,0,1,0,0,1|2,0,0]=4 978 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 512a_100000753791_100102657272 [0,0,1,0,0,1|2,0,0]=4 979 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 512a_106832991638_100000753791 [0,0,1,0,0,1|2,0,0]=4 980 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 2708a_100102657272_103496528808 [0,0,1,0,0,1|2,0,0]=4 981 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 2708a_103496528808_106832991635 [0,0,1,0,0,1|2,0,0]=4 982 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 273464a_100102657272_103496528808 [0,0,1,0,0,1|2,0,0]=4 983 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 273464a_103496528808_100102657272 [0,0,1,0,0,1|2,0,0]=4 984 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 512a_103496528808_100102657272 [0,0,1,0,0,1|2,0,0]=4 985 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 512a_106832991638_103496528808 [0,0,1,0,0,1|2,0,0]=4 986 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 2708a_100000704586_106832991635 [0,0,1,0,0,1|2,0,0]=4 987 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 2708a_100102657272_100000704586 [0,0,1,0,0,1|2,0,0]=4 988 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 273464a_100000704586_100102657272 [0,0,1,0,0,1|2,0,0]=4 989 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 273464a_100102657272_100000704586 [0,0,1,0,0,1|2,0,0]=4 990 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 512a_100000704586_100102657272 [0,0,1,0,0,1|2,0,0]=4 991 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 512a_106832991638_100000704586 [0,0,1,0,0,1|2,0,0]=4 992 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 2708a_100000754185_106832991635 [0,0,1,0,0,1|2,0,0]=4 993 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 2708a_100102657272_100000754185 [0,0,1,0,0,1|2,0,0]=4 994 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 273464a_100000754185_100102657272 [0,0,1,0,0,1|2,0,0]=4 995 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 273464a_100102657272_100000754185 [0,0,1,0,0,1|2,0,0]=4 996 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 512a_100000754185_100102657272 [0,0,1,0,0,1|2,0,0]=4 997 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 512a_106832991638_100000754185 [0,0,1,0,0,1|2,0,0]=4 998 B15R1.942 CNC(=O)NCCNc1c[n+](ccn1)[O-] 27a_100015205895_100009880115 [0,0,1,0,0,1|2,0,0]=4 999 B15R1.942 CNC(=O)OCCOc1ccc[n+](c1)[O-] 34a_100000039713_200011997002 [0,0,1,0,0,1|1,0,0]=3 1000 B15R1.942 CNC(=O)OCCOc1ccc[n+](c1)[O-] 7a_100000039713_200011997002 [0,0,1,0,0,1|1,0,0]=3 1001 B15R1.942 CNC(=O)OCCSc1c[n+](ccn1)[O-] 62a_200011997002_100009880115 [0,0,1,0,0,1|2,0,0]=4 1002 B15R1.942 CNC(=O)OCCSc1ccc[n+](c1)C 62a_100009996589_200011997002 [0,0,1,0,0,1|2,0,0]=4 1003 B15R1.942 CNC(=O)OCCSc1ccc[n+](c1)C 62a_200011997002_100009996589 [0,0,1,0,0,1|2,0,0]=4 1004 B15R1.942 CNC(=O)OCCSc1ccc[n+](c1)[O-] 62a_200011997002_100009815978 [0,0,1,0,0,1|1,0,0]=3 1005 B15R1.942 COC(=O)CCCOc1ccc[n+](c1)[O-] 34a_100000039713_100000742333 [0,0,1,0,0,1|1,0,0]=3 1006 B15R1.942 COC(=O)CCCOc1ccc[n+](c1)[O-] 7a_100000039713_100011218270 [0,0,1,0,0,1|1,0,0]=3 1007 B15R1.942 COC(=O)CCCSc1c[n+](ccn1)[O-] 62a_100011218270_100009880115 [0,0,1,0,0,1|2,0,0]=4 1008 B15R1.942 COC(=O)CCCSc1ccc[n+](c1)C 62a_100009996589_100011218270 [0,0,1,0,0,1|2,0,0]=4 1009 B15R1.942 COC(=O)CCCSc1ccc[n+](c1)C 62a_100011218270_100009996589 [0,0,1,0,0,1|2,0,0]=4 1010 B15R1.942 COC(=O)CCCSc1ccc[n+](c1)[O-] 62a_100011218270_100009815978 [0,0,1,0,0,1|1,0,0]=3 1011 B15R1.942 COC(=O)CCOCc1ccc[n+](c1)[O-] 34a_100000037817_100000742370 [0,0,1,0,0,1|1,0,0]=3 1012 B15R1.942 COC(=O)CCOCc1ccc[n+](c1)[O-] 7a_100000037817_100000204255 [0,0,1,0,0,1|1,0,0]=3 1013 B15R2.30 O=C1C=C(CCC1)c2ccc[n+](c2)[O-] 271570a_100000723966_100009815978 [1,0,0,0,0,1|1,0,1]=4 1014 B15R2.389 CN1CC(=O)OC[C@@H]1c2ccccc2 2230a_100000005368_200000210301 [1,0,0,0,0,1|2,0,0]=4 1015 B15R2.389 CN1CC(=O)OC[C@@H]1c2ccccc2 269982a_100000005368_200000210301 [1,0,0,0,0,1|2,0,0]=4 1016 B15R2.389 [13CH3]N1CC(=O)OC[C@@H]1c2ccccc2 2230a_100000005368_200025704644 [1,0,0,0,0,1|2,0,0]=4 1017 B15R2.389 [13CH3]N1CC(=O)OC[C@@H]1c2ccccc2 269982a_100000005368_200025704644 [1,0,0,0,0,1|2,0,0]=4 1018 B17R2.41853 O=C1CCC(C(=O)N1)Oc2ccc[n+](c2)[O-] 7a_100000039713_100000694648 [0,0,0,0,0,2|2,0,0]=4 1019 B17R2.41853 O=C1CCC(C(=O)N1)Sc2ccc[n+](c2)[O-] 62a_100000694648_100009815978 [0,0,0,0,0,2|2,0,0]=4 1020 B17R2.41860 CN1CC(CCC1=O)Nc2c[n+](ccn2)[O-] 27a_100011935005_100009880115 [0,0,0,0,0,2|1,0,0]=3 1021 B17R2.150300 CN1CCN(CCC1=O)c2c[n+](ccn2)[O-] 27a_100020591582_100009880115 [0,0,0,0,0,2|2,0,0]=4