0 B17R2.2159 CC(CC#N)Oc1ccc2ccccc2c1 7a_100000185828_100009813641 [0,0,1,0,0,0|2,0,1]=4 1 B17R2.2159 CC(CCO)Nc1ccc2ccccc2c1 34a_100000211940_100009893172 [0,0,1,0,0,0|3,0,0]=4 2 B17R2.2159 CC(CCO)Nc1ccc2ccccc2c1 7a_100000211940_100009893172 [0,0,1,0,0,0|3,0,0]=4 3 B17R2.2159 CC(CCO)Oc1ccc2ccccc2c1 34a_100000185828_100009893172 [0,0,1,0,0,0|2,0,0]=3 4 B17R2.2159 CC(CCO)Oc1ccc2ccccc2c1 7a_100000185828_100009893172 [0,0,1,0,0,0|2,0,0]=3 5 B17R2.2159 CC(CCO)Oc1ccc2cccnc2c1 34a_100011216045_100009893172 [0,0,1,0,0,0|3,0,0]=4 6 B17R2.2159 CC(CCO)Oc1ccc2ccncc2c1 7a_100000752006_100009893172 [0,0,1,0,0,0|3,0,0]=4 7 B17R2.2159 CC(CCO)Oc1ccc2cnccc2c1 34a_100000046372_100009893172 [0,0,1,0,0,0|3,0,0]=4 8 B17R2.2159 CC(CCO)Oc1ccc2cnccc2c1 7a_100000046372_100009893172 [0,0,1,0,0,0|3,0,0]=4 9 B17R2.2159 CC(CCO)Oc1ccc2ncccc2c1 34a_100011215586_100009893172 [0,0,1,0,0,0|3,0,0]=4 10 B17R2.2159 CC(CCO)Oc1ccc2ncccc2c1 7a_100011215586_100009893172 [0,0,1,0,0,0|3,0,0]=4 11 B17R2.2159 CC(CCO)Oc1cnc2ccccc2c1 34a_100011934006_100009893172 [0,0,1,0,0,0|3,0,0]=4 12 B17R2.2159 CC(CCO)Oc1cnc2ccccc2c1 7a_100011934006_100009893172 [0,0,1,0,0,0|3,0,0]=4 13 B17R2.2159 CC(CCO)Sc1ccc2ccccc2c1 62a_100009893172_100000233703 [0,0,1,0,0,0|2,1,0]=4 14 B17R2.2159 CCCC(C)Nc1ccc2ccccc2c1 34a_100000211940_100000766640 [0,0,1,0,0,0|2,0,0]=3 15 B17R2.2159 CCCC(C)Nc1ccc2ccccc2c1 7a_100000211940_100000766640 [0,0,1,0,0,0|2,0,0]=3 16 B17R2.2159 CCCC(C)Nc1ccc2ccccc2n1 27a_100000741246_100011291633 [0,0,1,0,0,0|3,0,0]=4 17 B17R2.2159 CCCC(C)Nc1ccc2cccnc2c1 34a_100102887122_100000766640 [0,0,1,0,0,0|3,0,0]=4 18 B17R2.2159 CCCC(C)Nc1ccc2cnccc2c1 34a_100000039641_100000766640 [0,0,1,0,0,0|3,0,0]=4 19 B17R2.2159 CCCC(C)Nc1ccc2ncccc2c1 34a_100011198106_100000766640 [0,0,1,0,0,0|3,0,0]=4 20 B17R2.2159 CCCC(C)Oc1ccc2ccccc2c1 34a_100000185828_100000766640 [0,0,1,0,0,0|1,0,0]=2 21 B17R2.2159 CCCC(C)Oc1ccc2ccccc2c1 7a_100000185828_100000766640 [0,0,1,0,0,0|1,0,0]=2 22 B17R2.2159 CCCC(C)Oc1ccc2cccnc2c1 34a_100011216045_100000766640 [0,0,1,0,0,0|2,0,0]=3 23 B17R2.2159 CCCC(C)Oc1ccc2ccncc2c1 7a_100000752006_100000766640 [0,0,1,0,0,0|2,0,0]=3 24 B17R2.2159 CCCC(C)Oc1ccc2cnccc2c1 34a_100000046372_100000766640 [0,0,1,0,0,0|2,0,0]=3 25 B17R2.2159 CCCC(C)Oc1ccc2cnccc2c1 7a_100000046372_100000766640 [0,0,1,0,0,0|2,0,0]=3 26 B17R2.2159 CCCC(C)Oc1ccc2ncccc2c1 34a_100011215586_100000766640 [0,0,1,0,0,0|2,0,0]=3 27 B17R2.2159 CCCC(C)Oc1ccc2ncccc2c1 7a_100011215586_100000766640 [0,0,1,0,0,0|2,0,0]=3 28 B17R2.2159 CCCC(C)Oc1ccc2nccnc2c1 34a_100000694412_100000766640 [0,0,1,0,0,0|3,0,0]=4 29 B17R2.2159 CCCC(C)Oc1cnc2ccccc2c1 34a_100011934006_100000766640 [0,0,1,0,0,0|2,0,0]=3 30 B17R2.2159 CCCC(C)Oc1cnc2ccccc2c1 7a_100011934006_100000766640 [0,0,1,0,0,0|2,0,0]=3 31 B17R2.2159 CCCC(C)Sc1cc2ccccc2cn1 62a_100000766640_100000047361 [0,0,1,0,0,0|2,1,0]=4 32 B17R2.2159 CCCC(C)Sc1cc2ccccc2cn1 62a_100009816522_100000766640 [0,0,1,0,0,0|2,1,0]=4 33 B17R2.2159 CCCC(C)Sc1ccc2ccccc2c1 62a_100000766640_100000233703 [0,0,1,0,0,0|1,1,0]=3 34 B17R2.2159 CCCC(C)Sc1ccc2ccccc2n1 62a_100000766640_100011291633 [0,0,1,0,0,0|2,1,0]=4 35 B17R2.2159 CCCC(C)Sc1ccc2ccccc2n1 62a_100011291633_100000766640 [0,0,1,0,0,0|2,1,0]=4 36 B17R2.2159 CCCC(C)Sc1ccc2cccnc2c1 62a_100000766640_100009816655 [0,0,1,0,0,0|2,1,0]=4 37 B17R2.2159 CCCC(C)Sc1ccc2ccncc2c1 62a_100000686496_100000766640 [0,0,1,0,0,0|2,1,0]=4 38 B17R2.2159 CCCC(C)Sc1ccc2ccncc2c1 62a_100000766640_100000686496 [0,0,1,0,0,0|2,1,0]=4 39 B17R2.2159 CCCC(C)Sc1ccc2cnccc2c1 62a_100000766640_100009816743 [0,0,1,0,0,0|2,1,0]=4 40 B17R2.2159 CCCC(C)Sc1ccc2cnccc2c1 62a_100009816743_100000766640 [0,0,1,0,0,0|2,1,0]=4 41 B17R2.2159 CCCC(C)Sc1ccc2ncccc2c1 62a_100000766640_100011215947 [0,0,1,0,0,0|2,1,0]=4 42 B17R2.2159 CCCC(C)Sc1ccc2ncccc2c1 62a_100011215947_100000766640 [0,0,1,0,0,0|2,1,0]=4 43 B17R2.2159 CCCC(C)Sc1cnc2ccccc2c1 62a_100000766640_100000737414 [0,0,1,0,0,0|2,1,0]=4 44 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 2230a_100000185194_100000210303 [0,0,1,0,0,0|3,0,0]=4 45 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 2230a_100000747261_100011216711 [0,0,1,0,0,0|3,0,0]=4 46 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 269982a_100000185194_100000210303 [0,0,1,0,0,0|3,0,0]=4 47 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 269982a_100000747261_100011216711 [0,0,1,0,0,0|3,0,0]=4 48 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 270004a_100000747261_100000211584 [0,0,1,0,0,0|3,0,0]=4 49 B17R2.2159 CCNC(=O)Cc1ccc2ccccc2c1 11a_100015525214_100000181716 [0,0,1,0,0,0|2,0,1]=4 50 B17R2.2159 CCNC(=O)Cc1ccc2ccccc2c1 240690a_100015525214_100000181716 [0,0,1,0,0,0|2,0,1]=4 51 B17R2.2159 CCNC(=O)Cc1ccc2ccccc2c1 527a_100015525214_100000181716 [0,0,1,0,0,0|2,0,1]=4 52 B17R2.2159 CCNC(=O)Nc1ccc2ccccc2c1 2430a_100000211940_100015525214 [0,0,1,0,0,0|2,0,1]=4 53 B17R2.2159 CCNC(C)Cc1ccc2ccccc2n1 270004a_100015525214_100011245913 [0,0,1,0,0,0|2,0,0]=3 54 B17R2.2159 COCC(C)Nc1ccc2ccccc2c1 34a_100000211940_100000765312 [0,0,1,0,0,0|3,0,0]=4 55 B17R2.2159 COCC(C)Nc1ccc2ccccc2c1 7a_100000211940_100000765312 [0,0,1,0,0,0|3,0,0]=4 56 B17R2.2159 COCC(C)Oc1ccc2ccccc2c1 34a_100000185828_100000765312 [0,0,1,0,0,0|2,0,0]=3 57 B17R2.2159 COCC(C)Oc1ccc2ccccc2c1 7a_100000185828_100000765312 [0,0,1,0,0,0|2,0,0]=3 58 B17R2.2159 COCC(C)Oc1ccc2cccnc2c1 34a_100011216045_100000765312 [0,0,1,0,0,0|3,0,0]=4 59 B17R2.2159 COCC(C)Oc1ccc2ccncc2c1 7a_100000752006_100000765312 [0,0,1,0,0,0|3,0,0]=4 60 B17R2.2159 COCC(C)Oc1ccc2cnccc2c1 34a_100000046372_100000765312 [0,0,1,0,0,0|3,0,0]=4 61 B17R2.2159 COCC(C)Oc1ccc2cnccc2c1 7a_100000046372_100000765312 [0,0,1,0,0,0|3,0,0]=4 62 B17R2.2159 COCC(C)Oc1ccc2ncccc2c1 34a_100011215586_100000765312 [0,0,1,0,0,0|3,0,0]=4 63 B17R2.2159 COCC(C)Oc1ccc2ncccc2c1 7a_100011215586_100000765312 [0,0,1,0,0,0|3,0,0]=4 64 B17R2.2159 COCC(C)Oc1cnc2ccccc2c1 34a_100011934006_100000765312 [0,0,1,0,0,0|3,0,0]=4 65 B17R2.2159 COCC(C)Oc1cnc2ccccc2c1 7a_100011934006_100000765312 [0,0,1,0,0,0|3,0,0]=4 66 B17R2.2159 COCC(C)Sc1ccc2ccccc2c1 62a_100000765312_100000233703 [0,0,1,0,0,0|2,1,0]=4 67 B17R2.10039 C=C(C)c1c(ccc2c1cccc2)OCC 271570a_100000694244_200000173018 [0,0,1,0,0,0|1,0,1]=3 68 B17R2.10039 CC(=O)c1c(ccc2c1cccc2)OCF 7a_100000011452_100015361967 [0,0,1,0,0,0|2,0,1]=4 69 B17R2.10039 CCOc1ccc2ccccc2c1C(=O)C 1458a_100011215926_200000210301 [0,0,1,0,0,0|1,0,1]=3 70 B17R2.10039 CCOc1ccc2ccccc2c1C(=O)C 7a_100000011452_100000210202 [0,0,1,0,0,0|1,0,1]=3 71 B17R2.10039 CCOc1ccc2ccccc2c1C(=O)[13CH3] 1458a_100011215926_200025704644 [0,0,1,0,0,0|1,0,1]=3 72 B17R2.10039 CCOc1ccc2ccccc2c1[N+](=O)[O-] 34a_100000037421_100000210202 [0,0,1,0,0,0|3,0,0]=4 73 B17R2.10039 CCOc1ccc2ccccc2c1[N+](=O)[O-] 7a_100000037421_100000210202 [0,0,1,0,0,0|3,0,0]=4 74 B17R2.14947 CC(=O)Oc1ccc2ccccc2c1S[13CH3] 62a_200025704644_200103289829 [0,0,1,0,0,0|2,0,1]=4 75 B17R2.14947 CC(C)Oc1ccc2ccccc2c1N=O 34a_100000212102_100000210206 [0,0,1,0,0,0|3,0,0]=4 76 B17R2.14947 CC(C)Oc1ccc2ccccc2c1N=O 7a_100000212102_100000210206 [0,0,1,0,0,0|3,0,0]=4 77 B17R2.14947 COc1c(ccc2c1cccc2)SC(C)C 62a_100000210206_100010089960 [0,0,1,0,0,0|2,1,0]=4 78 B17R2.14947 CSc1c(ccc2c1cccc2)OC(=O)C 62a_200000210301_200103289829 [0,0,1,0,0,0|2,0,1]=4 79 B17R2.50138 CCCC(=O)c1c(ccc2c1cccc2)O 1458a_100011219592_100000210303 [0,0,1,0,0,0|2,0,1]=4 80 B17R2.50138 CCNC(=O)c1c(ccc2c1cccc2)C 11a_100015525214_100011933975 [0,0,1,0,0,0|2,0,1]=4 81 B17R2.50138 CCNC(=O)c1c(ccc2c1cccc2)C 240690a_100015525214_100011933975 [0,0,1,0,0,0|2,0,1]=4 82 B17R2.50138 CCNC(=O)c1c(ccc2c1cccc2)O 240690a_100015525214_100011219592 [0,0,1,0,0,0|1,0,1]=3 83 B17R2.50138 CNNC(=O)c1c(ccc2c1cccc2)O 22a_100016993582_100011219592 [0,0,1,0,0,0|2,0,1]=4 84 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 11a_100011830313_100015343762 [0,0,1,0,0,0|0,0,2]=3 85 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 1626a_100011830313_100015343762 [0,0,1,0,0,0|0,0,2]=3 86 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 240690a_100011830313_100015343762 [0,0,1,0,0,0|0,0,2]=3 87 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 527a_100011830313_100103153847 [0,0,1,0,0,0|0,0,2]=3 88 B17R2.712041 CC(C)CN(C)c1cccc2c1cccc2 2230a_100000220138_100000210760 [0,0,1,0,0,0|3,0,0]=4 89 B17R2.712041 CC(C)CN(C)c1cccc2c1cccc2 269982a_100000220138_100000210624 [0,0,1,0,0,0|3,0,0]=4 90 B17R2.712041 CC(C)CN(C)c1cccc2c1cccc2 34a_100000220138_100000210624 [0,0,1,0,0,0|3,0,0]=4 91 B17R2.712041 CC(C)C[C@H](N)c1cccc2c1cccc2 271570a_100015190218_100000210605 [0,0,1,0,0,0|3,0,0]=4 92 B17R2.712041 CC(C)NC(=O)c1cccc2c1cccc2 11a_100138425928_100000210949 [0,0,1,0,0,0|2,0,1]=4 93 B17R2.712041 CC(C)NC(=O)c1cccc2c1cccc2 1626a_100138425928_100000210949 [0,0,1,0,0,0|2,0,1]=4 94 B17R2.712041 CC(C)NC(=O)c1cccc2c1cccc2 240690a_100138425928_100000210949 [0,0,1,0,0,0|2,0,1]=4 95 B17R2.712041 CC(C)NC(=O)c1cccc2c1cccc2 527a_100138425928_100000210949 [0,0,1,0,0,0|2,0,1]=4 96 B17R2.712041 CC(C)N[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100000210206 [0,0,1,0,0,0|1,0,0]=2 97 B17R2.712041 CC(C)O[C@@H](C)c1cccc2c1cccc2 34a_100011852130_100000210206 [0,0,1,0,0,0|2,0,0]=3 98 B17R2.712041 CC(C)O[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100000210206 [0,0,1,0,0,0|2,0,0]=3 99 B17R2.712041 CC(O)CC(=O)c1cccc2c1cccc2 1458a_100000210949_100011218427 [0,0,1,0,0,0|2,0,1]=4 100 B17R2.712041 CC(O)CN(C)c1cccc2c1cccc2 2230a_100000220138_100011218427 [0,0,1,0,0,0|2,0,0]=3 101 B17R2.712041 CC(O)CN(C)c1cccc2c1cccc2 269982a_100000220138_100011218427 [0,0,1,0,0,0|2,0,0]=3 102 B17R2.712041 CC(O)CN(C)c1cccc2c1cccc2 34a_100000220138_100011218427 [0,0,1,0,0,0|2,0,0]=3 103 B17R2.712041 CC(O)CN(C)c1cccc2c1cccn2 27a_100000227577_100011290932 [0,0,1,0,0,0|3,0,0]=4 104 B17R2.712041 CC(O)CN(C)c1ccnc2c1cccc2 27a_100000227577_100011215880 [0,0,1,0,0,0|3,0,0]=4 105 B17R2.712041 CC(O)CN(C)c1nccc2c1cccc2 27a_100000227577_100011934041 [0,0,1,0,0,0|3,0,0]=4 106 B17R2.712041 C[C@@H](O)CN(C)c1cccc2c1cccc2 2230a_100000220138_100009817552 [0,0,1,0,0,0|2,0,0]=3 107 B17R2.712041 C[C@@H](O)CN(C)c1cccc2c1cccc2 269982a_100000220138_100009817552 [0,0,1,0,0,0|2,0,0]=3 108 B17R2.712041 C[C@@H](O)CN(C)c1cccc2c1cccc2 34a_100000220138_100009817552 [0,0,1,0,0,0|2,0,0]=3 109 B16R2.2441 C/C=C/COc1ccc2ccccc2c1 34a_100000185828_100102629194 [1,0,1,0,0,0|1,0,1]=4 110 B16R2.2441 C/C=C/COc1ccc2ccccc2c1 7a_100000185828_100102629194 [1,0,1,0,0,0|1,0,1]=4 111 B16R2.2441 CC#CCOc1ccc2ccccc2c1 34a_100000185828_100000748600 [1,0,1,0,0,0|1,0,1]=4 112 B16R2.2441 CC#CCOc1ccc2ccccc2c1 7a_100000185828_100000748600 [1,0,1,0,0,0|1,0,1]=4 113 B16R2.2441 CC=CCOc1ccc2ccccc2c1 34a_100000185828_100000070051 [1,0,1,0,0,0|1,0,1]=4 114 B16R2.2441 CC=CCOc1ccc2ccccc2c1 7a_100000185828_100000070051 [1,0,1,0,0,0|1,0,1]=4 115 B16R2.2441 CCCCNc1ccc2ccccc2c1 34a_100000211940_100000210210 [1,0,1,0,0,0|2,0,0]=4 116 B16R2.2441 CCCCNc1ccc2ccccc2c1 7a_100000211940_100000210211 [1,0,1,0,0,0|2,0,0]=4 117 B16R2.2441 CCCCOc1ccc2ccccc2c1 34a_100000185828_100000210210 [1,0,1,0,0,0|1,0,0]=3 118 B16R2.2441 CCCCOc1ccc2ccccc2c1 7a_100000185828_100000210211 [1,0,1,0,0,0|1,0,0]=3 119 B16R2.2441 CCCCOc1ccc2cccnc2c1 34a_100011216045_100000210210 [1,0,1,0,0,0|2,0,0]=4 120 B16R2.2441 CCCCOc1ccc2ccncc2c1 7a_100000752006_100000210211 [1,0,1,0,0,0|2,0,0]=4 121 B16R2.2441 CCCCOc1ccc2cnccc2c1 34a_100000046372_100000210210 [1,0,1,0,0,0|2,0,0]=4 122 B16R2.2441 CCCCOc1ccc2cnccc2c1 7a_100000046372_100000210211 [1,0,1,0,0,0|2,0,0]=4 123 B16R2.2441 CCCCOc1ccc2ncccc2c1 34a_100011215586_100000210210 [1,0,1,0,0,0|2,0,0]=4 124 B16R2.2441 CCCCOc1ccc2ncccc2c1 7a_100011215586_100000210211 [1,0,1,0,0,0|2,0,0]=4 125 B16R2.2441 CCCCOc1cnc2ccccc2c1 34a_100011934006_100000210210 [1,0,1,0,0,0|2,0,0]=4 126 B16R2.2441 CCCCOc1cnc2ccccc2c1 7a_100011934006_100000210211 [1,0,1,0,0,0|2,0,0]=4 127 B16R2.2441 CCCCSc1ccc2ccccc2c1 62a_100000210211_100000233703 [1,0,1,0,0,0|1,1,0]=4 128 B16R2.2441 CCNCCc1ccc2ccccc2c1 2230a_100000746582_100000210202 [1,0,1,0,0,0|1,0,0]=3 129 B16R2.2441 CCNCCc1ccc2ccccc2c1 34a_100000746582_100000210202 [1,0,1,0,0,0|1,0,0]=3 130 B16R2.2441 CCNN=Cc1ccc2ccccc2c1 4a_100000756455_100000211584 [1,0,1,0,0,0|2,0,0]=4 131 B16R2.2441 CCOCCc1ccc2ccccc2c1 34a_100000755654_100000210202 [1,0,1,0,0,0|2,0,0]=4 132 B16R2.2441 CCOCCc1ccc2ccccc2c1 7a_100000755654_100000210202 [1,0,1,0,0,0|2,0,0]=4 133 B16R2.2441 CCOCSc1ccc2ccccc2c1 62a_100000739092_100000233703 [1,0,1,0,0,0|1,1,0]=4 134 B16R2.2441 COCCOc1ccc2ccccc2c1 34a_100000185828_100011201679 [1,0,1,0,0,0|2,0,0]=4 135 B16R2.2441 COCCOc1ccc2ccccc2c1 34a_200011219602_200000210301 [1,0,1,0,0,0|2,0,0]=4 136 B16R2.2441 COCCOc1ccc2ccccc2c1 7a_100000185828_100000233755 [1,0,1,0,0,0|2,0,0]=4 137 B16R2.2441 COCCOc1ccc2ccccc2c1 7a_200011219602_200000210301 [1,0,1,0,0,0|2,0,0]=4 138 B16R2.2441 CSCCOc1ccc2ccccc2c1 34a_100000185828_100000212216 [1,0,1,0,0,0|2,0,0]=4 139 B16R2.2441 CSCCOc1ccc2ccccc2c1 7a_100000185828_100000212216 [1,0,1,0,0,0|2,0,0]=4 140 B16R2.2441 FCCCOc1ccc2ccccc2c1 34a_100000185828_100011934791 [1,0,1,0,0,0|2,0,0]=4 141 B16R2.2441 FCCCOc1ccc2ccccc2c1 7a_100000185828_100011934791 [1,0,1,0,0,0|2,0,0]=4 142 B16R2.2441 FCNCCc1ccc2ccccc2c1 34a_100000746582_100015361967 [1,0,1,0,0,0|2,0,0]=4 143 B16R2.2441 OCCCOc1ccc2ccccc2c1 34a_100000185828_100000230001 [1,0,1,0,0,0|2,0,0]=4 144 B16R2.2441 OCCCOc1ccc2ccccc2c1 7a_100000185828_100011215043 [1,0,1,0,0,0|2,0,0]=4 145 B16R2.2441 [13CH3]OCCOc1ccc2ccccc2c1 34a_200011219602_200025704644 [1,0,1,0,0,0|2,0,0]=4 146 B16R2.2441 [13CH3]OCCOc1ccc2ccccc2c1 7a_200011219602_200025704644 [1,0,1,0,0,0|2,0,0]=4 147 B16R2.5347 C#CC(C)Oc1ccc2ccccc2c1 34a_100000185828_200000035995 [1,0,1,0,0,0|0,0,2]=4 148 B16R2.5347 CC(C#N)Oc1ccc2ccccc2c1 7a_100000185828_100000703298 [1,0,1,0,0,0|1,0,1]=4 149 B16R2.5347 CC(CO)Nc1ccc2ccccc2c1 34a_100000211940_100012180447 [1,0,1,0,0,0|2,0,0]=4 150 B16R2.5347 CC(CO)Nc1ccc2ccccc2c1 7a_100000211940_100012180447 [1,0,1,0,0,0|2,0,0]=4 151 B16R2.5347 CC(CO)Oc1ccc2ccccc2c1 34a_100000185828_100012180447 [1,0,1,0,0,0|1,0,0]=3 152 B16R2.5347 CC(CO)Oc1ccc2ccccc2c1 7a_100000185828_100012180447 [1,0,1,0,0,0|1,0,0]=3 153 B16R2.5347 CC(CO)Oc1ccc2cccnc2c1 34a_100011216045_100012180447 [1,0,1,0,0,0|2,0,0]=4 154 B16R2.5347 CC(CO)Oc1ccc2ccncc2c1 7a_100000752006_100012180447 [1,0,1,0,0,0|2,0,0]=4 155 B16R2.5347 CC(CO)Oc1ccc2cnccc2c1 34a_100000046372_100012180447 [1,0,1,0,0,0|2,0,0]=4 156 B16R2.5347 CC(CO)Oc1ccc2cnccc2c1 7a_100000046372_100012180447 [1,0,1,0,0,0|2,0,0]=4 157 B16R2.5347 CC(CO)Oc1ccc2ncccc2c1 34a_100011215586_100012180447 [1,0,1,0,0,0|2,0,0]=4 158 B16R2.5347 CC(CO)Oc1ccc2ncccc2c1 7a_100011215586_100012180447 [1,0,1,0,0,0|2,0,0]=4 159 B16R2.5347 CC(CO)Oc1cnc2ccccc2c1 34a_100011934006_100012180447 [1,0,1,0,0,0|2,0,0]=4 160 B16R2.5347 CC(CO)Oc1cnc2ccccc2c1 7a_100011934006_100012180447 [1,0,1,0,0,0|2,0,0]=4 161 B16R2.5347 CC(CO)Sc1ccc2ccccc2c1 62a_100012180447_100000233703 [1,0,1,0,0,0|1,1,0]=4 162 B16R2.5347 CCC(C)Nc1ccc2ccccc2c1 34a_100000211940_100011215416 [1,0,1,0,0,0|1,0,0]=3 163 B16R2.5347 CCC(C)Nc1ccc2ccccc2c1 7a_100000211940_100000758301 [1,0,1,0,0,0|1,0,0]=3 164 B16R2.5347 CCC(C)Nc1ccc2cccnc2c1 34a_100102887122_100011215416 [1,0,1,0,0,0|2,0,0]=4 165 B16R2.5347 CCC(C)Nc1ccc2cnccc2c1 34a_100000039641_100011215416 [1,0,1,0,0,0|2,0,0]=4 166 B16R2.5347 CCC(C)Nc1ccc2ncccc2c1 34a_100011198106_100011215416 [1,0,1,0,0,0|2,0,0]=4 167 B16R2.5347 CCC(C)Oc1ccc2ccccc2c1 34a_100000185828_100011215416 [1,0,1,0,0,0|0,0,0]=2 168 B16R2.5347 CCC(C)Oc1ccc2ccccc2c1 7a_100000185828_100000758301 [1,0,1,0,0,0|0,0,0]=2 169 B16R2.5347 CCC(C)Oc1ccc2cccnc2c1 34a_100011216045_100011215416 [1,0,1,0,0,0|1,0,0]=3 170 B16R2.5347 CCC(C)Oc1ccc2ccncc2c1 7a_100000752006_100000758301 [1,0,1,0,0,0|1,0,0]=3 171 B16R2.5347 CCC(C)Oc1ccc2cnccc2c1 34a_100000046372_100011215416 [1,0,1,0,0,0|1,0,0]=3 172 B16R2.5347 CCC(C)Oc1ccc2cnccc2c1 7a_100000046372_100000758301 [1,0,1,0,0,0|1,0,0]=3 173 B16R2.5347 CCC(C)Oc1ccc2ncccc2c1 34a_100011215586_100011215416 [1,0,1,0,0,0|1,0,0]=3 174 B16R2.5347 CCC(C)Oc1ccc2ncccc2c1 7a_100011215586_100000758301 [1,0,1,0,0,0|1,0,0]=3 175 B16R2.5347 CCC(C)Oc1ccc2nccnc2c1 34a_100000694412_100011215416 [1,0,1,0,0,0|2,0,0]=4 176 B16R2.5347 CCC(C)Oc1cnc2ccccc2c1 34a_100011934006_100011215416 [1,0,1,0,0,0|1,0,0]=3 177 B16R2.5347 CCC(C)Oc1cnc2ccccc2c1 7a_100011934006_100000758301 [1,0,1,0,0,0|1,0,0]=3 178 B16R2.5347 CCC(C)Sc1cc2ccccc2cn1 62a_100000758301_100000047361 [1,0,1,0,0,0|1,1,0]=4 179 B16R2.5347 CCC(C)Sc1cc2ccccc2cn1 62a_100009816522_100000758301 [1,0,1,0,0,0|1,1,0]=4 180 B16R2.5347 CCC(C)Sc1ccc2ccccc2c1 62a_100000758301_100000233703 [1,0,1,0,0,0|0,1,0]=3 181 B16R2.5347 CCC(C)Sc1ccc2ccccc2n1 62a_100000758301_100011291633 [1,0,1,0,0,0|1,1,0]=4 182 B16R2.5347 CCC(C)Sc1ccc2ccccc2n1 62a_100011291633_100000758301 [1,0,1,0,0,0|1,1,0]=4 183 B16R2.5347 CCC(C)Sc1ccc2cccnc2c1 62a_100000758301_100009816655 [1,0,1,0,0,0|1,1,0]=4 184 B16R2.5347 CCC(C)Sc1ccc2ccncc2c1 62a_100000686496_100000758301 [1,0,1,0,0,0|1,1,0]=4 185 B16R2.5347 CCC(C)Sc1ccc2ccncc2c1 62a_100000758301_100000686496 [1,0,1,0,0,0|1,1,0]=4 186 B16R2.5347 CCC(C)Sc1ccc2cnccc2c1 62a_100000758301_100009816743 [1,0,1,0,0,0|1,1,0]=4 187 B16R2.5347 CCC(C)Sc1ccc2cnccc2c1 62a_100009816743_100000758301 [1,0,1,0,0,0|1,1,0]=4 188 B16R2.5347 CCC(C)Sc1ccc2ncccc2c1 62a_100000758301_100011215947 [1,0,1,0,0,0|1,1,0]=4 189 B16R2.5347 CCC(C)Sc1ccc2ncccc2c1 62a_100011215947_100000758301 [1,0,1,0,0,0|1,1,0]=4 190 B16R2.5347 CCC(C)Sc1cnc2ccccc2c1 62a_100000758301_100000737414 [1,0,1,0,0,0|1,1,0]=4 191 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 2230a_100000185194_100000210202 [1,0,1,0,0,0|2,0,0]=4 192 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 2230a_100000201282_200000210301 [1,0,1,0,0,0|2,0,0]=4 193 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 2230a_100000225621_100011216711 [1,0,1,0,0,0|2,0,0]=4 194 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 269982a_100000185194_100000204670 [1,0,1,0,0,0|2,0,0]=4 195 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 269982a_100000201282_200000210301 [1,0,1,0,0,0|2,0,0]=4 196 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 269982a_100000225621_100011216711 [1,0,1,0,0,0|2,0,0]=4 197 B16R2.5347 CCN([13CH3])Cc1ccc2ccccc2c1 2230a_100000201282_200025704644 [1,0,1,0,0,0|2,0,0]=4 198 B16R2.5347 CCN([13CH3])Cc1ccc2ccccc2c1 269982a_100000201282_200025704644 [1,0,1,0,0,0|2,0,0]=4 199 B16R2.5347 CNC(C)Cc1ccc2ccccc2n1 270004a_106832991635_100011245913 [1,0,1,0,0,0|2,0,0]=4 200 B16R2.5347 COC(C)Sc1ccc2ccccc2c1 62a_100009879195_100000233703 [1,0,1,0,0,0|1,1,0]=4 201 B16R2.5347 C[C@H](CO)Sc1ccc2ccccc2c1 62a_100016084084_100000233703 [1,0,1,0,0,0|1,1,0]=4 202 B16R2.2073 C=C(C)c1c(ccc2c1cccc2)OC 271570a_100000694244_100000173347 [1,0,1,0,0,0|1,0,1]=4 203 B16R2.2073 CC(=O)c1c(ccc2c1cccc2)O[13CH3] 7a_100000011452_200025704644 [1,0,1,0,0,0|1,0,1]=4 204 B16R2.2073 COc1ccc2ccccc2c1C(=O)C 1458a_100011214975_200000210301 [1,0,1,0,0,0|1,0,1]=4 205 B16R2.2073 COc1ccc2ccccc2c1C(=O)C 7a_100000011452_200000210301 [1,0,1,0,0,0|1,0,1]=4 206 B16R2.2073 COc1ccc2ccccc2c1C(=O)[13CH3] 1458a_100011214975_200025704644 [1,0,1,0,0,0|1,0,1]=4 207 B16R2.28256 C=Cc1c(ccc2c1cccc2)OCC 271570a_100011290941_200000173018 [1,0,1,0,0,0|0,0,2]=4 208 B16R2.28256 CCOc1ccc2ccccc2c1N=O 34a_100000212102_100000210202 [1,0,1,0,0,0|2,0,0]=4 209 B16R2.28256 CCOc1ccc2ccccc2c1N=O 7a_100000212102_100000210202 [1,0,1,0,0,0|2,0,0]=4 210 B16R2.28256 CCOc1ccc2ccccc2c1SC 62a_200000210301_200000173018 [1,0,1,0,0,0|1,0,0]=3 211 B16R2.28256 CCOc1ccc2ccccc2c1S[13CH3] 62a_200025704644_200000173018 [1,0,1,0,0,0|1,0,0]=3 212 B16R2.28256 CCSc1ccc2ccccc2c1OC 62a_100000210202_100010089960 [1,0,1,0,0,0|1,1,0]=4 213 B16R2.83538 CC(C)Oc1ccc2ccccc2c1Br 34a_100000183829_100000210206 [1,0,1,0,0,0|2,0,0]=4 214 B16R2.83538 CC(C)Oc1ccc2ccccc2c1Br 7a_100000183829_100000210206 [1,0,1,0,0,0|2,0,0]=4 215 B16R2.83538 CC(C)Oc1ccc2ccccc2c1Cl 34a_100000029778_100000210206 [1,0,1,0,0,0|2,0,0]=4 216 B16R2.83538 CC(C)Oc1ccc2ccccc2c1Cl 7a_100000029778_100000210206 [1,0,1,0,0,0|2,0,0]=4 217 B16R2.83538 CC(C)Oc1ccc2ccccc2c1I 34a_100000041551_100000210206 [1,0,1,0,0,0|2,0,0]=4 218 B16R2.83538 CC(C)Oc1ccc2ccccc2c1I 7a_100000041551_100000210206 [1,0,1,0,0,0|2,0,0]=4 219 B16R2.83538 CC(C)Oc1ccc2ccccc2c1N 34a_100000007056_100000210206 [1,0,1,0,0,0|2,0,0]=4 220 B16R2.83538 CC(C)Oc1ccc2ccccc2c1N 7a_100000007056_100000210206 [1,0,1,0,0,0|2,0,0]=4 221 B16R2.83538 Cc1c(ccc2c1cccc2)OC(C)C 34a_100009830054_100000210206 [1,0,1,0,0,0|1,0,0]=3 222 B16R2.83538 Cc1c(ccc2c1cccc2)OC(C)C 7a_100009830054_100000210206 [1,0,1,0,0,0|1,0,0]=3 223 B16R2.83538 Cc1c(ccc2c1cccc2)SC(C)C 62a_100000210206_100010221197 [1,0,1,0,0,0|1,1,0]=4 224 B16R2.83538 Cc1c(ccc2c1cccc2)SC(C)C 62a_100010221197_100000210206 [1,0,1,0,0,0|1,1,0]=4 225 B16R2.30013 CCCCc1c(ccc2c1cccc2)Br 271570a_100020621405_100010090040 [1,0,1,0,0,0|2,0,0]=4 226 B16R2.30013 CCCCc1c(ccc2c1cccc2)C 271570a_100020621405_100000759710 [1,0,1,0,0,0|2,0,0]=4 227 B16R2.30013 CCCCc1c(ccc2c1cccc2)N 271570a_100020621405_100000705303 [1,0,1,0,0,0|2,0,0]=4 228 B16R2.30013 CCCCc1c(ccc2c1cccc2)O 271570a_100020621405_100000183829 [1,0,1,0,0,0|1,0,0]=3 229 B16R2.30013 CCCCc1c(ccc2c1cncc2)O 271570a_100020621405_200010115057 [1,0,1,0,0,0|2,0,0]=4 230 B16R2.30013 CCCCc1c(ccc2c1nccc2)O 271570a_100020621405_100010173343 [1,0,1,0,0,0|2,0,0]=4 231 B16R2.30013 CCCNc1c(ccc2c1cccc2)O 34a_100000007056_100000210303 [1,0,1,0,0,0|2,0,0]=4 232 B16R2.30013 CCCSc1c(ccc2c1cccc2)O 62a_100000210303_100000183829 [1,0,1,0,0,0|2,0,0]=4 233 B16R2.30013 CCNCc1c(ccc2c1cccc2)Br 207a_100015525214_100010090029 [1,0,1,0,0,0|1,0,0]=3 234 B16R2.30013 CCNCc1c(ccc2c1cccc2)Br 270004a_100015525214_100010090029 [1,0,1,0,0,0|1,0,0]=3 235 B16R2.30013 CCNCc1c(ccc2c1cccc2)C 207a_100015525214_100011361466 [1,0,1,0,0,0|1,0,0]=3 236 B16R2.30013 CCNCc1c(ccc2c1cccc2)C 2230a_100015525214_100000689653 [1,0,1,0,0,0|1,0,0]=3 237 B16R2.30013 CCNCc1c(ccc2c1cccc2)C 270004a_100015525214_100011361466 [1,0,1,0,0,0|1,0,0]=3 238 B16R2.30013 CCOCc1c(ccc2c1cccc2)C 34a_100121572206_100000689653 [1,0,1,0,0,0|2,0,0]=4 239 B16R2.30013 CCSCc1c(ccc2c1cccc2)C 62a_100000210202_100000689653 [1,0,1,0,0,0|2,0,0]=4 240 B16R2.30013 CCSCc1c(ccc2c1cccc2)C 62a_100000689653_100000210202 [1,0,1,0,0,0|2,0,0]=4 241 B16R2.34040 CCC(=O)c1c(ccc2c1cccc2)O 1458a_100011219592_100000210202 [1,0,1,0,0,0|1,0,1]=4 242 B16R2.34040 CNC(=O)c1c(ccc2c1cccc2)O 240690a_100102657272_100011219592 [1,0,1,0,0,0|1,0,1]=4 243 B16R2.160202 CCCN(C)c1cccc2c1cccc2 2230a_100000220138_100000210303 [1,0,1,0,0,0|2,0,0]=4 244 B16R2.160202 CCCN(C)c1cccc2c1cccc2 269982a_100000220138_100000210303 [1,0,1,0,0,0|2,0,0]=4 245 B16R2.160202 CCCN(C)c1cccc2c1cccc2 34a_100000220138_100000210303 [1,0,1,0,0,0|2,0,0]=4 246 B16R2.160202 CCNC(=O)c1cccc2c1cccc2 11a_100015525214_100000210949 [1,0,1,0,0,0|1,0,1]=4 247 B16R2.160202 CCNC(=O)c1cccc2c1cccc2 240690a_100015525214_100000210949 [1,0,1,0,0,0|1,0,1]=4 248 B16R2.160202 CCNC(=O)c1cccc2c1cccc2 527a_100015525214_100000210949 [1,0,1,0,0,0|1,0,1]=4 249 B16R2.160202 CCNC(C)c1cccc2c1cccc2 269862a_100015525214_100000210126 [1,0,1,0,0,0|0,0,0]=2 250 B16R2.160202 CCNC(C)c1cccc2c1nccc2 269862a_100015525214_100011995788 [1,0,1,0,0,0|1,0,0]=3 251 B16R2.160202 CCNC(C)c1cncc2c1cccc2 269862a_100015525214_100011951259 [1,0,1,0,0,0|1,0,0]=3 252 B16R2.160202 CCNC(C)c1nccc2c1cccc2 269862a_100015525214_100000742330 [1,0,1,0,0,0|1,0,0]=3 253 B16R2.160202 CCN[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100000210202 [1,0,1,0,0,0|0,0,0]=2 254 B16R2.160202 CCO[C@@H](C)c1cccc2c1cccc2 34a_100011852130_100000210202 [1,0,1,0,0,0|1,0,0]=3 255 B16R2.160202 CCO[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100000210202 [1,0,1,0,0,0|1,0,0]=3 256 B16R2.160202 CN(CCO)c1cccc2c1cccc2 2230a_100000220138_100000211926 [1,0,1,0,0,0|2,0,0]=4 257 B16R2.160202 CN(CCO)c1cccc2c1cccc2 269982a_100000220138_100000211926 [1,0,1,0,0,0|2,0,0]=4 258 B16R2.160202 CN(CCO)c1cccc2c1cccc2 34a_100000220138_100000211926 [1,0,1,0,0,0|2,0,0]=4 259 B16R2.160202 C[C@H](OCF)c1cccc2c1cccc2 34a_100011852130_100015361967 [1,0,1,0,0,0|2,0,0]=4 260 B16R2.160202 C[C@H](OCF)c1cccc2c1cccc2 7a_100011852130_100015361967 [1,0,1,0,0,0|2,0,0]=4 261 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 11a_100000753325_100015343762 [1,0,1,0,0,0|0,0,2]=4 262 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 1626a_100000753325_100015343762 [1,0,1,0,0,0|0,0,2]=4 263 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 240690a_100000753325_100015343762 [1,0,1,0,0,0|0,0,2]=4 264 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 527a_100000753325_100103153847 [1,0,1,0,0,0|0,0,2]=4 265 B16R2.179941 CC(C)NCc1cccc2c1cccc2 207a_100138425928_100000210074 [1,0,1,0,0,0|1,0,0]=3 266 B16R2.179941 CC(C)NCc1cccc2c1cccc2 2230a_100138425928_100011261445 [1,0,1,0,0,0|1,0,0]=3 267 B16R2.179941 CC(C)NCc1cccc2c1cccc2 34a_100000753325_100000210206 [1,0,1,0,0,0|1,0,0]=3 268 B16R2.179941 CC(C)NCc1cccc2c1cccc2 34a_100138425928_100011261445 [1,0,1,0,0,0|1,0,0]=3 269 B16R2.179941 CC(C)NCc1cccc2c1cccn2 207a_100138425928_100000708479 [1,0,1,0,0,0|2,0,0]=4 270 B16R2.179941 CC(C)NCc1cccc2c1ccnc2 207a_100138425928_100000750165 [1,0,1,0,0,0|2,0,0]=4 271 B16R2.179941 CC(C)NCc1cccc2c1ccnc2 2230a_100138425928_100016989825 [1,0,1,0,0,0|2,0,0]=4 272 B16R2.179941 CC(C)NCc1cccc2c1ccnc2 34a_100138425928_100016989825 [1,0,1,0,0,0|2,0,0]=4 273 B16R2.179941 CC(C)NCc1cccc2c1cncc2 207a_100138425928_100011934574 [1,0,1,0,0,0|2,0,0]=4 274 B16R2.179941 CC(C)NCc1cccc2c1nccc2 207a_100138425928_100000239888 [1,0,1,0,0,0|2,0,0]=4 275 B16R2.179941 CC(C)NCc1cccc2c1nccc2 2230a_100138425928_100000241032 [1,0,1,0,0,0|2,0,0]=4 276 B16R2.179941 CC(C)NCc1cccc2c1nccc2 34a_100138425928_100000241032 [1,0,1,0,0,0|2,0,0]=4 277 B16R2.179941 CC(C)NCc1ccnc2c1cccc2 2230a_100138425928_100015192512 [1,0,1,0,0,0|2,0,0]=4 278 B16R2.179941 CC(C)NCc1ccnc2c1cccc2 34a_100138425928_100015192512 [1,0,1,0,0,0|2,0,0]=4 279 B16R2.179941 CC(C)NCc1cncc2c1cccc2 207a_100138425928_100000684730 [1,0,1,0,0,0|2,0,0]=4 280 B16R2.179941 CC(C)NCc1nccc2c1cccc2 207a_100138425928_100011361464 [1,0,1,0,0,0|2,0,0]=4 281 B16R2.179941 CC(C)NCc1nccc2c1cccc2 2230a_100138425928_100000033776 [1,0,1,0,0,0|2,0,0]=4 282 B16R2.179941 CC(C)NCc1nccc2c1cccc2 34a_100138425928_100000033776 [1,0,1,0,0,0|2,0,0]=4 283 B16R2.179941 CC(C)OCc1cccc2c1cccc2 34a_100000212225_100011261445 [1,0,1,0,0,0|2,0,0]=4 284 B16R2.179941 CC(C)OCc1cccc2c1cccc2 34a_100011216843_100000210206 [1,0,1,0,0,0|2,0,0]=4 285 B16R2.179941 CC(C)OCc1cccc2c1cccc2 7a_100011216843_100000210206 [1,0,1,0,0,0|2,0,0]=4 286 B16R2.179941 CC(C)SCc1cccc2c1cccc2 62a_100000210206_100000188474 [1,0,1,0,0,0|2,0,0]=4 287 B16R2.179941 CC(C)SCc1cccc2c1cccc2 62a_100011261445_100000210206 [1,0,1,0,0,0|2,0,0]=4 288 B16R2.179941 CC(O)C=Cc1cccc2c1cccc2 271570a_200011019289_100000210605 [1,0,1,0,0,0|1,0,1]=4 289 B16R2.179941 CC(O)CNc1cccc2c1cccc2 34a_100000185869_100011218427 [1,0,1,0,0,0|2,0,0]=4 290 B16R2.179941 CC(O)COc1cccc2c1cccc2 34a_100000210388_100011218427 [1,0,1,0,0,0|2,0,0]=4 291 B16R2.179941 CC(O)COc1cccc2c1cccc2 7a_100000210388_100011218427 [1,0,1,0,0,0|2,0,0]=4 292 B16R2.179941 CC(O)CSc1cccc2c1cccc2 62a_100011218427_100000210605 [1,0,1,0,0,0|2,0,0]=4 293 B16R2.179941 C[C@@H](O)CNc1cccc2c1cccc2 34a_100000185869_100009817552 [1,0,1,0,0,0|2,0,0]=4 294 B16R2.179941 C[C@@H](O)COc1cccc2c1cccc2 34a_100000210388_100009817552 [1,0,1,0,0,0|2,0,0]=4 295 B16R2.179941 C[C@@H](O)COc1cccc2c1cccc2 7a_100000210388_100009817552 [1,0,1,0,0,0|2,0,0]=4 296 B16R2.179941 C[C@@H](O)CSc1cccc2c1cccc2 62a_100009817552_100000210605 [1,0,1,0,0,0|2,0,0]=4 297 B18R2.2032 CC(CCO)Oc1ccc2ccc(cc2c1)Br 34a_100009816537_100009893172 [0,1,1,0,0,0|2,0,0]=4 298 B18R2.2032 CC(CCO)Oc1ccc2ccc(cc2c1)Br 7a_100009816537_100009893172 [0,1,1,0,0,0|2,0,0]=4 299 B18R2.2032 CC(CCO)Oc1ccc2ccc(cc2c1)N 34a_100015378740_100009893172 [0,1,1,0,0,0|2,0,0]=4 300 B18R2.2032 CC(CCO)Oc1ccc2ccc(cc2c1)N 7a_100015378740_100009893172 [0,1,1,0,0,0|2,0,0]=4 301 B18R2.2032 CCCC(C)Nc1ccc2ccc(cc2c1)Br 34a_100010090036_100000766640 [0,1,1,0,0,0|2,0,0]=4 302 B18R2.2032 CCCC(C)Nc1ccc2ccc(cc2c1)Br 7a_100010090036_100000766640 [0,1,1,0,0,0|2,0,0]=4 303 B18R2.2032 CCCC(C)Nc1ccc2ccc(cc2c1)O 34a_100015378740_100000766640 [0,1,1,0,0,0|2,0,0]=4 304 B18R2.2032 CCCC(C)Nc1ccc2ccc(cc2c1)O 7a_100015378740_100000766640 [0,1,1,0,0,0|2,0,0]=4 305 B18R2.2032 CCCC(C)Oc1cc2cc(ccc2cn1)F 34a_200000101709_100000766640 [0,1,1,0,0,0|2,0,0]=4 306 B18R2.2032 CCCC(C)Oc1ccc2ccc(=O)oc2c1 34a_100000185914_100000766640 [0,1,1,0,0,0|2,0,0]=4 307 B18R2.2032 CCCC(C)Oc1ccc2ccc(=O)oc2c1 7a_100000185914_100000766640 [0,1,1,0,0,0|2,0,0]=4 308 B18R2.2032 CCCC(C)Oc1ccc2ccc(cc2c1)Br 34a_100009816537_100000766640 [0,1,1,0,0,0|1,0,0]=3 309 B18R2.2032 CCCC(C)Oc1ccc2ccc(cc2c1)Br 7a_100009816537_100000766640 [0,1,1,0,0,0|1,0,0]=3 310 B18R2.2032 CCCC(C)Oc1ccc2ccc(cc2c1)C 34a_100000091598_100000766640 [0,1,1,0,0,0|1,0,0]=3 311 B18R2.2032 CCCC(C)Oc1ccc2ccc(cc2c1)C 7a_100000091598_100000766640 [0,1,1,0,0,0|1,0,0]=3 312 B18R2.2032 CCCC(C)Oc1ccc2ccc(cc2c1)N 34a_100015378740_100000766640 [0,1,1,0,0,0|1,0,0]=3 313 B18R2.2032 CCCC(C)Oc1ccc2ccc(cc2c1)N 7a_100015378740_100000766640 [0,1,1,0,0,0|1,0,0]=3 314 B18R2.2032 CCCC(C)Oc1ccc2ccc(nc2c1)C 34a_100009867695_100000766640 [0,1,1,0,0,0|2,0,0]=4 315 B18R2.2032 CCCC(C)Oc1ccc2ccc(nc2c1)C 7a_100009867695_100000766640 [0,1,1,0,0,0|2,0,0]=4 316 B18R2.2032 CCCC(C)Oc1ccc2ccc(nc2c1)Cl 34a_100000079174_100000766640 [0,1,1,0,0,0|2,0,0]=4 317 B18R2.2032 CCCC(C)Oc1ccc2ccc(nc2c1)Cl 7a_100000079174_100000766640 [0,1,1,0,0,0|2,0,0]=4 318 B18R2.2032 CCCC(C)Oc1ccc2ncc(cc2c1)Br 34a_100010137430_100000766640 [0,1,1,0,0,0|2,0,0]=4 319 B18R2.2032 CCCC(C)Oc1ccc2ncc(cc2c1)Br 7a_100010137430_100000766640 [0,1,1,0,0,0|2,0,0]=4 320 B18R2.2032 CCCC(C)Oc1ccc2ncc(cc2c1)Cl 34a_100009869629_100000766640 [0,1,1,0,0,0|2,0,0]=4 321 B18R2.2032 CCCC(C)Oc1ccc2ncc(cc2c1)Cl 7a_100009869629_100000766640 [0,1,1,0,0,0|2,0,0]=4 322 B18R2.2032 CCCC(C)Oc1ccc2ncc(cc2c1)F 34a_100009845357_100000766640 [0,1,1,0,0,0|2,0,0]=4 323 B18R2.2032 CCCC(C)Oc1ccc2ncc(cc2c1)F 7a_100009845357_100000766640 [0,1,1,0,0,0|2,0,0]=4 324 B18R2.2032 CCCC(C)Oc1cnc2ccc(cc2c1)Br 34a_100000703654_100000766640 [0,1,1,0,0,0|2,0,0]=4 325 B18R2.2032 CCCC(C)Oc1cnc2ccc(cc2c1)Br 7a_100000703654_100000766640 [0,1,1,0,0,0|2,0,0]=4 326 B18R2.2032 CCCC(C)Sc1ccc2ccc(cc2c1)N 62a_100000766640_100010090036 [0,1,1,0,0,0|1,1,0]=4 327 B18R2.2032 CCCC(C)Sc1ccc2ccc(cc2c1)N 62a_100010090036_100000766640 [0,1,1,0,0,0|1,1,0]=4 328 B18R2.2032 CCCC(C)Sc1ccc2ccc(cc2c1)O 62a_100000766640_100009816537 [0,1,1,0,0,0|1,1,0]=4 329 B18R2.2032 COCC(C)Oc1ccc2ccc(cc2c1)Br 34a_100009816537_100000765312 [0,1,1,0,0,0|2,0,0]=4 330 B18R2.2032 COCC(C)Oc1ccc2ccc(cc2c1)Br 7a_100009816537_100000765312 [0,1,1,0,0,0|2,0,0]=4 331 B18R2.2032 COCC(C)Oc1ccc2ccc(cc2c1)C 34a_100000091598_100000765312 [0,1,1,0,0,0|2,0,0]=4 332 B18R2.2032 COCC(C)Oc1ccc2ccc(cc2c1)C 7a_100000091598_100000765312 [0,1,1,0,0,0|2,0,0]=4 333 B18R2.2032 COCC(C)Oc1ccc2ccc(cc2c1)N 34a_100015378740_100000765312 [0,1,1,0,0,0|2,0,0]=4 334 B18R2.2032 COCC(C)Oc1ccc2ccc(cc2c1)N 7a_100015378740_100000765312 [0,1,1,0,0,0|2,0,0]=4 335 B18R2.2032 Cc1ccc2ccc(cc2c1)OC(C)CCO 34a_100000091598_100009893172 [0,1,1,0,0,0|2,0,0]=4 336 B18R2.2032 Cc1ccc2ccc(cc2c1)OC(C)CCO 7a_100000091598_100009893172 [0,1,1,0,0,0|2,0,0]=4 337 B18R2.2040 CC(CCO)Oc1ccc2cccc(c2c1)Br 34a_100010169565_100009893172 [0,1,1,0,0,0|2,0,0]=4 338 B18R2.2040 CC(CCO)Oc1ccc2cccc(c2c1)Br 7a_100010169565_100009893172 [0,1,1,0,0,0|2,0,0]=4 339 B18R2.2040 CC(CCO)Oc1ccc2cccc(c2c1)F 34a_100000091619_100009893172 [0,1,1,0,0,0|2,0,0]=4 340 B18R2.2040 CC(CCO)Oc1ccc2cccc(c2c1)F 7a_100000091619_100009893172 [0,1,1,0,0,0|2,0,0]=4 341 B18R2.2040 CC(CCO)Oc1ccc2cccc(c2c1)N 34a_100000034012_100009893172 [0,1,1,0,0,0|2,0,0]=4 342 B18R2.2040 CC(CCO)Oc1ccc2cccc(c2c1)N 7a_100000034012_100009893172 [0,1,1,0,0,0|2,0,0]=4 343 B18R2.2040 CCCC(C)Nc1ccc2cccc(c2c1)O 34a_100132313934_100000766640 [0,1,1,0,0,0|2,0,0]=4 344 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)Br 34a_100010169565_100000766640 [0,1,1,0,0,0|1,0,0]=3 345 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)Br 7a_100010169565_100000766640 [0,1,1,0,0,0|1,0,0]=3 346 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)C 34a_200000091600_100000766640 [0,1,1,0,0,0|1,0,0]=3 347 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)C 7a_200000091600_100000766640 [0,1,1,0,0,0|1,0,0]=3 348 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)F 34a_100000091619_100000766640 [0,1,1,0,0,0|1,0,0]=3 349 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)F 7a_100000091619_100000766640 [0,1,1,0,0,0|1,0,0]=3 350 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)N 34a_100000034012_100000766640 [0,1,1,0,0,0|1,0,0]=3 351 B18R2.2040 CCCC(C)Oc1ccc2cccc(c2c1)N 7a_100000034012_100000766640 [0,1,1,0,0,0|1,0,0]=3 352 B18R2.2040 CCCC(C)Oc1ccc2ccnc(c2c1)Cl 34a_200009844553_100000766640 [0,1,1,0,0,0|2,0,0]=4 353 B18R2.2040 CCCC(C)Oc1ccc2ccnc(c2c1)Cl 7a_200009844553_100000766640 [0,1,1,0,0,0|2,0,0]=4 354 B18R2.2040 CCCC(C)Oc1ccc2nccc(c2c1)Br 34a_100010204251_100000766640 [0,1,1,0,0,0|2,0,0]=4 355 B18R2.2040 CCCC(C)Oc1ccc2nccc(c2c1)Br 7a_100010204251_100000766640 [0,1,1,0,0,0|2,0,0]=4 356 B18R2.2040 CCCC(C)Oc1ccc2nccc(c2c1)Cl 34a_100000075933_100000766640 [0,1,1,0,0,0|2,0,0]=4 357 B18R2.2040 CCCC(C)Oc1ccc2nccc(c2c1)Cl 7a_100000075933_100000766640 [0,1,1,0,0,0|2,0,0]=4 358 B18R2.2040 CCCC(C)Sc1ccc2cccc(c2c1)C 62a_100000766640_100010089936 [0,1,1,0,0,0|1,1,0]=4 359 B18R2.2040 CCCC(C)Sc1ccc2cccc(c2c1)N 62a_100000766640_100010090012 [0,1,1,0,0,0|1,1,0]=4 360 B18R2.2040 CCCC(C)Sc1ccc2cccc(c2c1)N 62a_100010090012_100000766640 [0,1,1,0,0,0|1,1,0]=4 361 B18R2.2040 CCCC(C)Sc1ccc2cccc(c2c1)O 62a_100000766640_100010089991 [0,1,1,0,0,0|1,1,0]=4 362 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)Br 34a_100010169565_100000765312 [0,1,1,0,0,0|2,0,0]=4 363 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)Br 7a_100010169565_100000765312 [0,1,1,0,0,0|2,0,0]=4 364 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)C 34a_200000091600_100000765312 [0,1,1,0,0,0|2,0,0]=4 365 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)C 7a_200000091600_100000765312 [0,1,1,0,0,0|2,0,0]=4 366 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)F 34a_100000091619_100000765312 [0,1,1,0,0,0|2,0,0]=4 367 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)F 7a_100000091619_100000765312 [0,1,1,0,0,0|2,0,0]=4 368 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)N 34a_100000034012_100000765312 [0,1,1,0,0,0|2,0,0]=4 369 B18R2.2040 COCC(C)Oc1ccc2cccc(c2c1)N 7a_100000034012_100000765312 [0,1,1,0,0,0|2,0,0]=4 370 B18R2.2040 Cc1cccc2c1cc(cc2)OC(C)CCO 34a_200000091600_100009893172 [0,1,1,0,0,0|2,0,0]=4 371 B18R2.2040 Cc1cccc2c1cc(cc2)OC(C)CCO 7a_200000091600_100009893172 [0,1,1,0,0,0|2,0,0]=4 372 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1Br 34a_100000183829_100009893172 [0,1,1,0,0,0|2,0,0]=4 373 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1Br 7a_100000183829_100009893172 [0,1,1,0,0,0|2,0,0]=4 374 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1Cl 34a_100000029778_100009893172 [0,1,1,0,0,0|2,0,0]=4 375 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1Cl 7a_100000029778_100009893172 [0,1,1,0,0,0|2,0,0]=4 376 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1I 34a_100000041551_100009893172 [0,1,1,0,0,0|2,0,0]=4 377 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1I 7a_100000041551_100009893172 [0,1,1,0,0,0|2,0,0]=4 378 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1N 34a_100000007056_100009893172 [0,1,1,0,0,0|2,0,0]=4 379 B18R2.2054 CC(CCO)Oc1ccc2ccccc2c1N 7a_100000007056_100009893172 [0,1,1,0,0,0|2,0,0]=4 380 B18R2.2054 CCCC(C)Nc1ccc2ccccc2c1Br 34a_100000705303_100000766640 [0,1,1,0,0,0|2,0,0]=4 381 B18R2.2054 CCCC(C)Nc1ccc2ccccc2c1Cl 34a_100000075557_100000766640 [0,1,1,0,0,0|2,0,0]=4 382 B18R2.2054 CCCC(C)Nc1ccc2ccccc2c1O 34a_100000007060_100000766640 [0,1,1,0,0,0|2,0,0]=4 383 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1Br 34a_100000183829_100000766640 [0,1,1,0,0,0|1,0,0]=3 384 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1Br 7a_100000183829_100000766640 [0,1,1,0,0,0|1,0,0]=3 385 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1C 34a_100009830054_100000766640 [0,1,1,0,0,0|1,0,0]=3 386 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1C 7a_100009830054_100000766640 [0,1,1,0,0,0|1,0,0]=3 387 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1Cl 34a_100000029778_100000766640 [0,1,1,0,0,0|1,0,0]=3 388 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1Cl 7a_100000029778_100000766640 [0,1,1,0,0,0|1,0,0]=3 389 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1I 34a_100000041551_100000766640 [0,1,1,0,0,0|1,0,0]=3 390 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1I 7a_100000041551_100000766640 [0,1,1,0,0,0|1,0,0]=3 391 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1N 34a_100000007056_100000766640 [0,1,1,0,0,0|1,0,0]=3 392 B18R2.2054 CCCC(C)Oc1ccc2ccccc2c1N 7a_100000007056_100000766640 [0,1,1,0,0,0|1,0,0]=3 393 B18R2.2054 CCCC(C)Oc1ccc2cccnc2c1Br 34a_100010173343_100000766640 [0,1,1,0,0,0|2,0,0]=4 394 B18R2.2054 CCCC(C)Oc1ccc2cccnc2c1Br 7a_100010173343_100000766640 [0,1,1,0,0,0|2,0,0]=4 395 B18R2.2054 CCCC(C)Oc1ccc2ccncc2c1Br 34a_200010115057_100000766640 [0,1,1,0,0,0|2,0,0]=4 396 B18R2.2054 CCCC(C)Oc1ccc2ccncc2c1Br 7a_200010115057_100000766640 [0,1,1,0,0,0|2,0,0]=4 397 B18R2.2054 CCCC(C)Oc1ccc2cnccc2c1Cl 34a_100009824633_100000766640 [0,1,1,0,0,0|2,0,0]=4 398 B18R2.2054 CCCC(C)Oc1ccc2cnccc2c1Cl 7a_100009824633_100000766640 [0,1,1,0,0,0|2,0,0]=4 399 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1Br 62a_100000766640_200010089984 [0,1,1,0,0,0|1,1,0]=4 400 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1Br 62a_200010089984_100000766640 [0,1,1,0,0,0|1,1,0]=4 401 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1C 62a_100000766640_100010221197 [0,1,1,0,0,0|1,1,0]=4 402 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1C 62a_100010221197_100000766640 [0,1,1,0,0,0|1,1,0]=4 403 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1F 62a_100000766640_100009832041 [0,1,1,0,0,0|1,1,0]=4 404 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1F 62a_100009832041_100000766640 [0,1,1,0,0,0|1,1,0]=4 405 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1N 62a_100009817101_100000766640 [0,1,1,0,0,0|1,1,0]=4 406 B18R2.2054 CCCC(C)Sc1ccc2ccccc2c1O 62a_100000766640_100009996032 [0,1,1,0,0,0|1,1,0]=4 407 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1Br 34a_100000183829_100000765312 [0,1,1,0,0,0|2,0,0]=4 408 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1Br 7a_100000183829_100000765312 [0,1,1,0,0,0|2,0,0]=4 409 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1C 34a_100009830054_100000765312 [0,1,1,0,0,0|2,0,0]=4 410 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1C 7a_100009830054_100000765312 [0,1,1,0,0,0|2,0,0]=4 411 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1Cl 34a_100000029778_100000765312 [0,1,1,0,0,0|2,0,0]=4 412 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1Cl 7a_100000029778_100000765312 [0,1,1,0,0,0|2,0,0]=4 413 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1I 34a_100000041551_100000765312 [0,1,1,0,0,0|2,0,0]=4 414 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1I 7a_100000041551_100000765312 [0,1,1,0,0,0|2,0,0]=4 415 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1N 34a_100000007056_100000765312 [0,1,1,0,0,0|2,0,0]=4 416 B18R2.2054 COCC(C)Oc1ccc2ccccc2c1N 7a_100000007056_100000765312 [0,1,1,0,0,0|2,0,0]=4 417 B18R2.2054 Cc1c(ccc2c1cccc2)OC(C)CCO 34a_100009830054_100009893172 [0,1,1,0,0,0|2,0,0]=4 418 B18R2.2054 Cc1c(ccc2c1cccc2)OC(C)CCO 7a_100009830054_100009893172 [0,1,1,0,0,0|2,0,0]=4 419 B18R2.14699 CCCC(C)C(=O)c1ccc2ccccc2c1 1458a_100000210637_100000766640 [0,1,1,0,0,0|2,0,0]=4 420 B18R2.14699 CCCC(C)N(C)c1ccc2ccccc2c1 2230a_100000181211_100000766640 [0,1,1,0,0,0|2,0,0]=4 421 B18R2.14699 CCCC(C)N(C)c1ccc2ccccc2c1 269982a_100000181211_100000766640 [0,1,1,0,0,0|2,0,0]=4 422 B18R2.14699 CCCC(C)N(C)c1ccc2ccccc2c1 34a_100000181211_100000766640 [0,1,1,0,0,0|2,0,0]=4 423 B18R2.30019 CCC(=O)C(C)Nc1ccc2ccccc2c1 7a_100000211940_100000742827 [0,1,1,0,0,0|2,0,0]=4 424 B18R2.30019 CCC(=O)C(C)Oc1ccc2ccccc2c1 7a_100000185828_100000742827 [0,1,1,0,0,0|1,0,0]=3 425 B18R2.30019 CCC(=O)C(C)Oc1ccc2ccncc2c1 7a_100000752006_100000742827 [0,1,1,0,0,0|2,0,0]=4 426 B18R2.30019 CCC(=O)C(C)Oc1ccc2cnccc2c1 7a_100000046372_100000742827 [0,1,1,0,0,0|2,0,0]=4 427 B18R2.30019 CCC(=O)C(C)Oc1ccc2ncccc2c1 7a_100011215586_100000742827 [0,1,1,0,0,0|2,0,0]=4 428 B18R2.30019 CCC(=O)C(C)Oc1cnc2ccccc2c1 7a_100011934006_100000742827 [0,1,1,0,0,0|2,0,0]=4 429 B18R2.30019 CCC(=O)C(C)Sc1ccc2ccccc2c1 62a_100000742827_100000233703 [0,1,1,0,0,0|1,1,0]=4 430 B18R2.30019 CNC(=O)C(C)Oc1ccc2ccccc2c1 34a_100000185828_100000731044 [0,1,1,0,0,0|2,0,0]=4 431 B18R2.30019 CNC(=O)C(C)Oc1ccc2ccccc2c1 7a_100000185828_100000209862 [0,1,1,0,0,0|2,0,0]=4 432 B18R2.30019 COC(=O)C(C)Oc1ccc2ccccc2c1 34a_100000185828_100000211248 [0,1,1,0,0,0|2,0,0]=4 433 B18R2.30019 COC(=O)C(C)Oc1ccc2ccccc2c1 7a_100000185828_100000211248 [0,1,1,0,0,0|2,0,0]=4 434 B18R2.33945 CC(Cc1ccc2ccccc2n1)NCCO 270004a_100000210304_100011245913 [0,1,1,0,0,0|2,0,0]=4 435 B18R2.33945 CCCCC(C)Nc1ccc2ccccc2c1 34a_100000211940_200011215066 [0,1,1,0,0,0|2,0,0]=4 436 B18R2.33945 CCCCC(C)Nc1ccc2ccccc2c1 7a_100000211940_200011215066 [0,1,1,0,0,0|2,0,0]=4 437 B18R2.33945 CCCCC(C)Oc1ccc2ccccc2c1 34a_100000185828_200011215066 [0,1,1,0,0,0|1,0,0]=3 438 B18R2.33945 CCCCC(C)Oc1ccc2ccccc2c1 7a_100000185828_200011215066 [0,1,1,0,0,0|1,0,0]=3 439 B18R2.33945 CCCCC(C)Oc1ccc2cccnc2c1 34a_100011216045_200011215066 [0,1,1,0,0,0|2,0,0]=4 440 B18R2.33945 CCCCC(C)Oc1ccc2ccncc2c1 7a_100000752006_200011215066 [0,1,1,0,0,0|2,0,0]=4 441 B18R2.33945 CCCCC(C)Oc1ccc2cnccc2c1 34a_100000046372_200011215066 [0,1,1,0,0,0|2,0,0]=4 442 B18R2.33945 CCCCC(C)Oc1ccc2cnccc2c1 7a_100000046372_200011215066 [0,1,1,0,0,0|2,0,0]=4 443 B18R2.33945 CCCCC(C)Oc1ccc2ncccc2c1 34a_100011215586_200011215066 [0,1,1,0,0,0|2,0,0]=4 444 B18R2.33945 CCCCC(C)Oc1ccc2ncccc2c1 7a_100011215586_200011215066 [0,1,1,0,0,0|2,0,0]=4 445 B18R2.33945 CCCCC(C)Oc1cnc2ccccc2c1 34a_100011934006_200011215066 [0,1,1,0,0,0|2,0,0]=4 446 B18R2.33945 CCCCC(C)Oc1cnc2ccccc2c1 7a_100011934006_200011215066 [0,1,1,0,0,0|2,0,0]=4 447 B18R2.33945 CCCCC(C)Sc1ccc2ccccc2c1 62a_200011215066_100000233703 [0,1,1,0,0,0|1,1,0]=4 448 B18R2.33945 CCCNC(C)Cc1ccc2ccccc2n1 270004a_100020643023_100011245913 [0,1,1,0,0,0|2,0,0]=4 449 B18R2.71948 CC(C)CC(C)Nc1ccc2ccccc2c1 34a_100000211940_100000731052 [0,1,1,0,0,0|2,0,0]=4 450 B18R2.71948 CC(C)CC(C)Nc1ccc2ccccc2c1 7a_100000211940_100000731052 [0,1,1,0,0,0|2,0,0]=4 451 B18R2.71948 CC(C)CC(C)Oc1ccc2ccccc2c1 34a_100000185828_100000731052 [0,1,1,0,0,0|1,0,0]=3 452 B18R2.71948 CC(C)CC(C)Oc1ccc2ccccc2c1 7a_100000185828_100000731052 [0,1,1,0,0,0|1,0,0]=3 453 B18R2.71948 CC(C)CC(C)Oc1ccc2cccnc2c1 34a_100011216045_100000731052 [0,1,1,0,0,0|2,0,0]=4 454 B18R2.71948 CC(C)CC(C)Oc1ccc2ccncc2c1 7a_100000752006_100000731052 [0,1,1,0,0,0|2,0,0]=4 455 B18R2.71948 CC(C)CC(C)Oc1ccc2cnccc2c1 34a_100000046372_100000731052 [0,1,1,0,0,0|2,0,0]=4 456 B18R2.71948 CC(C)CC(C)Oc1ccc2cnccc2c1 7a_100000046372_100000731052 [0,1,1,0,0,0|2,0,0]=4 457 B18R2.71948 CC(C)CC(C)Oc1ccc2ncccc2c1 34a_100011215586_100000731052 [0,1,1,0,0,0|2,0,0]=4 458 B18R2.71948 CC(C)CC(C)Oc1ccc2ncccc2c1 7a_100011215586_100000731052 [0,1,1,0,0,0|2,0,0]=4 459 B18R2.71948 CC(C)CC(C)Oc1cnc2ccccc2c1 34a_100011934006_100000731052 [0,1,1,0,0,0|2,0,0]=4 460 B18R2.71948 CC(C)CC(C)Oc1cnc2ccccc2c1 7a_100011934006_100000731052 [0,1,1,0,0,0|2,0,0]=4 461 B18R2.71948 CC(C)CC(C)Sc1ccc2ccccc2c1 62a_100000731052_100000233703 [0,1,1,0,0,0|1,1,0]=4 462 B18R2.124646 CC(CCO)Oc1ccc2cc(ccc2c1)Br 34a_100000185455_100009893172 [0,1,1,0,0,0|2,0,0]=4 463 B18R2.124646 CC(CCO)Oc1ccc2cc(ccc2c1)Br 7a_100000185455_100009893172 [0,1,1,0,0,0|2,0,0]=4 464 B18R2.124646 CC(CCO)Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_100009893172 [0,1,1,0,0,0|2,0,0]=4 465 B18R2.124646 CC(CCO)Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_100009893172 [0,1,1,0,0,0|2,0,0]=4 466 B18R2.124646 CC(CCO)Oc1ccc2cc(ccc2c1)F 34a_100009847029_100009893172 [0,1,1,0,0,0|2,0,0]=4 467 B18R2.124646 CC(CCO)Oc1ccc2cc(ccc2c1)F 7a_100009847029_100009893172 [0,1,1,0,0,0|2,0,0]=4 468 B18R2.124646 CCCC(C)Nc1ccc2cc(ccc2c1)Br 34a_100000185457_100000766640 [0,1,1,0,0,0|2,0,0]=4 469 B18R2.124646 CCCC(C)Nc1ccc2cc(ccc2c1)Br 7a_100000185457_100000766640 [0,1,1,0,0,0|2,0,0]=4 470 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)Br 34a_100000185455_100000766640 [0,1,1,0,0,0|1,0,0]=3 471 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)Br 7a_100000185455_100000766640 [0,1,1,0,0,0|1,0,0]=3 472 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)C 34a_100000074090_100000766640 [0,1,1,0,0,0|1,0,0]=3 473 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)C 7a_100000074090_100000766640 [0,1,1,0,0,0|1,0,0]=3 474 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_100000766640 [0,1,1,0,0,0|1,0,0]=3 475 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_100000766640 [0,1,1,0,0,0|1,0,0]=3 476 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)F 34a_100009847029_100000766640 [0,1,1,0,0,0|1,0,0]=3 477 B18R2.124646 CCCC(C)Oc1ccc2cc(ccc2c1)F 7a_100009847029_100000766640 [0,1,1,0,0,0|1,0,0]=3 478 B18R2.124646 CCCC(C)Oc1ccc2cc(cnc2c1)Br 34a_200010153753_100000766640 [0,1,1,0,0,0|2,0,0]=4 479 B18R2.124646 CCCC(C)Oc1ccc2cc(cnc2c1)Br 7a_200010153753_100000766640 [0,1,1,0,0,0|2,0,0]=4 480 B18R2.124646 CCCC(C)Oc1ccc2nc(ccc2c1)C 34a_100000037634_100000766640 [0,1,1,0,0,0|2,0,0]=4 481 B18R2.124646 CCCC(C)Oc1ccc2nc(ccc2c1)C 7a_100000037634_100000766640 [0,1,1,0,0,0|2,0,0]=4 482 B18R2.124646 CCCC(C)Oc1ccc2nc(ccc2c1)Cl 34a_100009849208_100000766640 [0,1,1,0,0,0|2,0,0]=4 483 B18R2.124646 CCCC(C)Oc1ccc2nc(ccc2c1)Cl 7a_100009849208_100000766640 [0,1,1,0,0,0|2,0,0]=4 484 B18R2.124646 CCCC(C)Oc1ccc2oc(=O)ccc2c1 34a_100000066265_100000766640 [0,1,1,0,0,0|2,0,0]=4 485 B18R2.124646 CCCC(C)Oc1ccc2oc(=O)ccc2c1 7a_100000066265_100000766640 [0,1,1,0,0,0|2,0,0]=4 486 B18R2.124646 CCCC(C)Oc1cnc2cc(ccc2c1)F 34a_100012184162_100000766640 [0,1,1,0,0,0|2,0,0]=4 487 B18R2.124646 CCCC(C)Oc1cnc2cc(ccc2c1)F 7a_100012184162_100000766640 [0,1,1,0,0,0|2,0,0]=4 488 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)Br 62a_100000766640_100012344972 [0,1,1,0,0,0|1,1,0]=4 489 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)Br 62a_100012344972_100000766640 [0,1,1,0,0,0|1,1,0]=4 490 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)F 62a_100000766640_100009817052 [0,1,1,0,0,0|1,1,0]=4 491 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)F 62a_100009817052_100000766640 [0,1,1,0,0,0|1,1,0]=4 492 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)N 62a_100000185457_100000766640 [0,1,1,0,0,0|1,1,0]=4 493 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)N 62a_100000766640_100000185457 [0,1,1,0,0,0|1,1,0]=4 494 B18R2.124646 CCCC(C)Sc1ccc2cc(ccc2c1)O 62a_100000766640_100000185455 [0,1,1,0,0,0|1,1,0]=4 495 B18R2.124646 CCOC(C)Oc1ccc2cc(ccc2c1)O 271570a_203496583355_100020605378 [0,1,1,0,0,0|1,0,0]=3 496 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)Br 34a_100000185455_100000765312 [0,1,1,0,0,0|2,0,0]=4 497 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)Br 7a_100000185455_100000765312 [0,1,1,0,0,0|2,0,0]=4 498 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)C 34a_100000074090_100000765312 [0,1,1,0,0,0|2,0,0]=4 499 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)C 7a_100000074090_100000765312 [0,1,1,0,0,0|2,0,0]=4 500 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_100000765312 [0,1,1,0,0,0|2,0,0]=4 501 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_100000765312 [0,1,1,0,0,0|2,0,0]=4 502 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)F 34a_100009847029_100000765312 [0,1,1,0,0,0|2,0,0]=4 503 B18R2.124646 COCC(C)Oc1ccc2cc(ccc2c1)F 7a_100009847029_100000765312 [0,1,1,0,0,0|2,0,0]=4 504 B18R2.124646 Cc1ccc2cc(ccc2c1)OC(C)CCO 34a_100000074090_100009893172 [0,1,1,0,0,0|2,0,0]=4 505 B18R2.124646 Cc1ccc2cc(ccc2c1)OC(C)CCO 7a_100000074090_100009893172 [0,1,1,0,0,0|2,0,0]=4 506 B18R2.124731 CC(CCO)Oc1cc(c2ccccc2c1)Br 34a_100010001680_100009893172 [0,1,1,0,0,0|2,0,0]=4 507 B18R2.124731 CC(CCO)Oc1cc(c2ccccc2c1)Br 7a_100010001680_100009893172 [0,1,1,0,0,0|2,0,0]=4 508 B18R2.124731 CCCC(C)Nc1cc(c2ccccc2c1)Br 34a_100010089974_100000766640 [0,1,1,0,0,0|2,0,0]=4 509 B18R2.124731 CCCC(C)Nc1cc(c2ccccc2c1)Br 7a_100010089974_100000766640 [0,1,1,0,0,0|2,0,0]=4 510 B18R2.124731 CCCC(C)Oc1cc(c2ccccc2c1)Br 34a_100010001680_100000766640 [0,1,1,0,0,0|1,0,0]=3 511 B18R2.124731 CCCC(C)Oc1cc(c2ccccc2c1)Br 7a_100010001680_100000766640 [0,1,1,0,0,0|1,0,0]=3 512 B18R2.124731 CCCC(C)Oc1cc(c2cnccc2c1)Br 34a_100011009069_100000766640 [0,1,1,0,0,0|2,0,0]=4 513 B18R2.124731 CCCC(C)Oc1cc(c2cnccc2c1)Br 7a_100011009069_100000766640 [0,1,1,0,0,0|2,0,0]=4 514 B18R2.124731 CCCC(C)Oc1cc(c2ncccc2c1)Cl 34a_100000097192_100000766640 [0,1,1,0,0,0|2,0,0]=4 515 B18R2.124731 CCCC(C)Oc1cc(c2ncccc2c1)Cl 7a_100000097192_100000766640 [0,1,1,0,0,0|2,0,0]=4 516 B18R2.124731 CCCC(C)Oc1cc(c2ncccc2c1)F 34a_100009888031_100000766640 [0,1,1,0,0,0|2,0,0]=4 517 B18R2.124731 CCCC(C)Oc1cc(c2ncccc2c1)F 7a_100009888031_100000766640 [0,1,1,0,0,0|2,0,0]=4 518 B18R2.124731 CCCC(C)Oc1cc(c2ncccc2c1)N 34a_100000083691_100000766640 [0,1,1,0,0,0|2,0,0]=4 519 B18R2.124731 CCCC(C)Sc1cc(c2ccccc2c1)N 62a_100000766640_100010171453 [0,1,1,0,0,0|1,1,0]=4 520 B18R2.124731 CCCC(C)Sc1cc(c2ccccc2c1)N 62a_100010171453_100000766640 [0,1,1,0,0,0|1,1,0]=4 521 B18R2.124731 CCCC(C)Sc1cc(c2ccccc2c1)O 62a_100000766640_100010089979 [0,1,1,0,0,0|1,1,0]=4 522 B18R2.124731 COCC(C)Oc1cc(c2ccccc2c1)Br 34a_100010001680_100000765312 [0,1,1,0,0,0|2,0,0]=4 523 B18R2.124731 COCC(C)Oc1cc(c2ccccc2c1)Br 7a_100010001680_100000765312 [0,1,1,0,0,0|2,0,0]=4 524 B18R2.124774 CC(CCO)Oc1cc2ccccc2cc1Br 34a_100009817189_100009893172 [0,1,1,0,0,0|2,0,0]=4 525 B18R2.124774 CC(CCO)Oc1cc2ccccc2cc1Br 7a_100009817189_100009893172 [0,1,1,0,0,0|2,0,0]=4 526 B18R2.124774 CC(CCO)Oc1cc2ccccc2cc1N 34a_106744474703_100009893172 [0,1,1,0,0,0|2,0,0]=4 527 B18R2.124774 CC(CCO)Oc1cc2ccccc2cc1N 7a_106744474703_100009893172 [0,1,1,0,0,0|2,0,0]=4 528 B18R2.124774 CCCC(C)Nc1cc2ccccc2cc1Br 34a_100009991566_100000766640 [0,1,1,0,0,0|2,0,0]=4 529 B18R2.124774 CCCC(C)Nc1cc2ccccc2cc1Br 7a_100009991566_100000766640 [0,1,1,0,0,0|2,0,0]=4 530 B18R2.124774 CCCC(C)Oc1cc2ccccc2cc1Br 34a_100009817189_100000766640 [0,1,1,0,0,0|1,0,0]=3 531 B18R2.124774 CCCC(C)Oc1cc2ccccc2cc1Br 7a_100009817189_100000766640 [0,1,1,0,0,0|1,0,0]=3 532 B18R2.124774 CCCC(C)Oc1cc2ccccc2cc1C 34a_100000091601_100000766640 [0,1,1,0,0,0|1,0,0]=3 533 B18R2.124774 CCCC(C)Oc1cc2ccccc2cc1C 7a_100000091601_100000766640 [0,1,1,0,0,0|1,0,0]=3 534 B18R2.124774 CCCC(C)Oc1cc2ccccc2cc1N 34a_106744474703_100000766640 [0,1,1,0,0,0|1,0,0]=3 535 B18R2.124774 CCCC(C)Oc1cc2ccccc2cc1N 7a_106744474703_100000766640 [0,1,1,0,0,0|1,0,0]=3 536 B18R2.124774 CCCC(C)Oc1cc2ccccc2nc1C 34a_200000079175_100000766640 [0,1,1,0,0,0|2,0,0]=4 537 B18R2.124774 CCCC(C)Oc1cc2ccccc2nc1C 7a_200000079175_100000766640 [0,1,1,0,0,0|2,0,0]=4 538 B18R2.124774 CCCC(C)Oc1cc2ccccc2nc1Cl 34a_200000100762_100000766640 [0,1,1,0,0,0|2,0,0]=4 539 B18R2.124774 CCCC(C)Oc1cc2ccccc2nc1Cl 7a_200000100762_100000766640 [0,1,1,0,0,0|2,0,0]=4 540 B18R2.124774 CCCC(C)Oc1cc2ccccc2oc1=O 7a_100000061252_100000766640 [0,1,1,0,0,0|2,0,0]=4 541 B18R2.124774 CCCC(C)Oc1cc2cccnc2cc1Br 34a_200010153759_100000766640 [0,1,1,0,0,0|2,0,0]=4 542 B18R2.124774 CCCC(C)Oc1cc2cccnc2cc1Br 7a_200010153759_100000766640 [0,1,1,0,0,0|2,0,0]=4 543 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1Br 62a_100000766640_200010169544 [0,1,1,0,0,0|1,1,0]=4 544 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1Br 62a_200010169544_100000766640 [0,1,1,0,0,0|1,1,0]=4 545 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1Cl 62a_100000766640_100010152806 [0,1,1,0,0,0|1,1,0]=4 546 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1Cl 62a_100010152806_100000766640 [0,1,1,0,0,0|1,1,0]=4 547 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1N 62a_100000766640_100009991566 [0,1,1,0,0,0|1,1,0]=4 548 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1N 62a_100009991566_100000766640 [0,1,1,0,0,0|1,1,0]=4 549 B18R2.124774 CCCC(C)Sc1cc2ccccc2cc1O 62a_100000766640_100009817189 [0,1,1,0,0,0|1,1,0]=4 550 B18R2.124774 COCC(C)Oc1cc2ccccc2cc1Br 34a_100009817189_100000765312 [0,1,1,0,0,0|2,0,0]=4 551 B18R2.124774 COCC(C)Oc1cc2ccccc2cc1Br 7a_100009817189_100000765312 [0,1,1,0,0,0|2,0,0]=4 552 B18R2.124774 COCC(C)Oc1cc2ccccc2cc1C 34a_100000091601_100000765312 [0,1,1,0,0,0|2,0,0]=4 553 B18R2.124774 COCC(C)Oc1cc2ccccc2cc1C 7a_100000091601_100000765312 [0,1,1,0,0,0|2,0,0]=4 554 B18R2.124774 COCC(C)Oc1cc2ccccc2cc1N 34a_106744474703_100000765312 [0,1,1,0,0,0|2,0,0]=4 555 B18R2.124774 COCC(C)Oc1cc2ccccc2cc1N 7a_106744474703_100000765312 [0,1,1,0,0,0|2,0,0]=4 556 B18R2.124774 Cc1cc2ccccc2cc1OC(C)CCO 34a_100000091601_100009893172 [0,1,1,0,0,0|2,0,0]=4 557 B18R2.124774 Cc1cc2ccccc2cc1OC(C)CCO 7a_100000091601_100009893172 [0,1,1,0,0,0|2,0,0]=4 558 B18R2.125209 CCCC(CC)Nc1ccc2ccccc2c1 7a_100000211940_100011219200 [0,1,1,0,0,0|2,0,0]=4 559 B18R2.125209 CCCC(CC)Oc1ccc2ccccc2c1 7a_100000185828_100011219200 [0,1,1,0,0,0|1,0,0]=3 560 B18R2.125209 CCCC(CC)Oc1ccc2ccncc2c1 7a_100000752006_100011219200 [0,1,1,0,0,0|2,0,0]=4 561 B18R2.125209 CCCC(CC)Oc1ccc2cnccc2c1 7a_100000046372_100011219200 [0,1,1,0,0,0|2,0,0]=4 562 B18R2.125209 CCCC(CC)Oc1ccc2ncccc2c1 7a_100011215586_100011219200 [0,1,1,0,0,0|2,0,0]=4 563 B18R2.125209 CCCC(CC)Oc1cnc2ccccc2c1 7a_100011934006_100011219200 [0,1,1,0,0,0|2,0,0]=4 564 B18R2.125209 CCCC(CC)Sc1ccc2ccccc2c1 62a_100011219200_100000233703 [0,1,1,0,0,0|1,1,0]=4 565 B18R2.584300 CCNC(C)(C)Cc1ccc2ccccc2c1 2230a_100000104098_100000210202 [0,1,1,0,0,0|1,0,0]=3 566 B18R2.895465 CC(CCO)Oc1ccc2c(cccc2c1)N 34a_100000034668_100009893172 [0,1,1,0,0,0|2,0,0]=4 567 B18R2.895465 CC(CCO)Oc1ccc2c(cccc2c1)N 7a_100000034668_100009893172 [0,1,1,0,0,0|2,0,0]=4 568 B18R2.895465 CCCC(C)Nc1ccc2c(cccc2c1)O 34a_100000035793_100000766640 [0,1,1,0,0,0|2,0,0]=4 569 B18R2.895465 CCCC(C)Nc1ccc2c(cccc2c1)O 7a_100000035793_100000766640 [0,1,1,0,0,0|2,0,0]=4 570 B18R2.895465 CCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000766640 [0,1,1,0,0,0|2,0,0]=4 571 B18R2.895465 CCCC(C)Oc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000766640 [0,1,1,0,0,0|2,0,0]=4 572 B18R2.895465 CCCC(C)Oc1ccc2c(=O)ccoc2c1 34a_200000065989_100000766640 [0,1,1,0,0,0|2,0,0]=4 573 B18R2.895465 CCCC(C)Oc1ccc2c(=O)ccoc2c1 7a_200000065989_100000766640 [0,1,1,0,0,0|2,0,0]=4 574 B18R2.895465 CCCC(C)Oc1ccc2c(cccc2c1)N 34a_100000034668_100000766640 [0,1,1,0,0,0|1,0,0]=3 575 B18R2.895465 CCCC(C)Oc1ccc2c(cccc2c1)N 7a_100000034668_100000766640 [0,1,1,0,0,0|1,0,0]=3 576 B18R2.895465 CCCC(C)Oc1ccc2c(ccnc2c1)Br 34a_100010204257_100000766640 [0,1,1,0,0,0|2,0,0]=4 577 B18R2.895465 CCCC(C)Oc1ccc2c(ccnc2c1)Br 7a_100010204257_100000766640 [0,1,1,0,0,0|2,0,0]=4 578 B18R2.895465 CCCC(C)Oc1ccc2c(ccnc2c1)C 34a_200009854145_100000766640 [0,1,1,0,0,0|2,0,0]=4 579 B18R2.895465 CCCC(C)Oc1ccc2c(ccnc2c1)C 7a_200009854145_100000766640 [0,1,1,0,0,0|2,0,0]=4 580 B18R2.895465 CCCC(C)Oc1ccc2c(ccnc2c1)Cl 34a_100000045489_100000766640 [0,1,1,0,0,0|2,0,0]=4 581 B18R2.895465 CCCC(C)Oc1ccc2c(ccnc2c1)Cl 7a_100000045489_100000766640 [0,1,1,0,0,0|2,0,0]=4 582 B18R2.895465 CCCC(C)Oc1ccc2c(nccc2c1)Cl 34a_100009867704_100000766640 [0,1,1,0,0,0|2,0,0]=4 583 B18R2.895465 CCCC(C)Oc1ccc2c(nccc2c1)Cl 7a_100009867704_100000766640 [0,1,1,0,0,0|2,0,0]=4 584 B18R2.895465 CCCC(C)Oc1cnc2c(cccc2c1)F 34a_100012184956_100000766640 [0,1,1,0,0,0|2,0,0]=4 585 B18R2.895465 CCCC(C)Oc1cnc2c(cccc2c1)F 7a_100012184956_100000766640 [0,1,1,0,0,0|2,0,0]=4 586 B18R2.895465 CCCC(C)Sc1ccc2c(cccc2c1)N 62a_100000766640_100010090037 [0,1,1,0,0,0|1,1,0]=4 587 B18R2.895465 CCCC(C)Sc1ccc2c(cccc2c1)N 62a_100010090037_100000766640 [0,1,1,0,0,0|1,1,0]=4 588 B18R2.895465 CCCC(C)Sc1ccc2c(cccc2c1)O 62a_100000766640_100010202202 [0,1,1,0,0,0|1,1,0]=4 589 B18R2.895465 COCC(C)Oc1ccc2c(cccc2c1)N 34a_100000034668_100000765312 [0,1,1,0,0,0|2,0,0]=4 590 B18R2.895465 COCC(C)Oc1ccc2c(cccc2c1)N 7a_100000034668_100000765312 [0,1,1,0,0,0|2,0,0]=4 591 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)CC 1458a_100011215926_100000210202 [0,1,1,0,0,0|1,0,1]=4 592 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)CF 1458a_100011215926_100015361967 [0,1,1,0,0,0|1,0,1]=4 593 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)NC 11a_106832991635_100011215926 [0,1,1,0,0,0|1,0,1]=4 594 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)NC 1626a_100102657272_100011215926 [0,1,1,0,0,0|1,0,1]=4 595 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)NC 240690a_100102657272_100011215926 [0,1,1,0,0,0|1,0,1]=4 596 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)NC 527a_100102657272_100011215926 [0,1,1,0,0,0|1,0,1]=4 597 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)OC 34a_200000042739_100000210202 [0,1,1,0,0,0|1,0,1]=4 598 B18R2.14527 CCOc1ccc2ccccc2c1C(=O)OC 7a_200000042739_100000210202 [0,1,1,0,0,0|1,0,1]=4 599 B18R2.32207 CC(=O)c1c(ccc2c1cccc2)OCCF 7a_100000011452_100011217306 [0,1,1,0,0,0|1,0,1]=4 600 B18R2.32207 CC(=O)c1c(ccc2c1cccc2)OCCO 7a_100000011452_100000211926 [0,1,1,0,0,0|1,0,1]=4 601 B18R2.32207 CCCOc1ccc2ccccc2c1C(=O)C 7a_100000011452_100000210303 [0,1,1,0,0,0|1,0,1]=4 602 B18R2.101056 CC(=O)c1c(ccc2c1cccc2)OC(C)C 7a_100000011452_100000210206 [0,1,1,0,0,0|1,0,1]=4 603 B18R2.361980 CCSc1c(ccc2c1cccc2)OC(=O)C 62a_100000210202_200103289829 [0,1,1,0,0,0|1,0,1]=4 604 B18R2.361980 CNCc1c(ccc2c1cccc2)OC(C)C 207a_100102657272_100000169850 [0,1,1,0,0,0|1,0,0]=3 605 B18R2.361980 CNCc1c(ccc2c1cccc2)OC(C)C 270004a_106832991635_100000169850 [0,1,1,0,0,0|1,0,0]=3 606 B18R2.361980 CNCc1c(ccc2c1cccc2)OC(F)F 207a_100102657272_100000179043 [0,1,1,0,0,0|2,0,0]=4 607 B18R2.361980 CNCc1c(ccc2c1cccc2)OC(F)F 270004a_106832991635_100000179043 [0,1,1,0,0,0|2,0,0]=4 608 B18R2.6550 CC(C)C[C@H](N)c1c(ccc2c1cccc2)O 271570a_100015190218_100000183829 [0,1,1,0,0,0|2,0,0]=4 609 B18R2.6550 CC(C)NC(=O)c1c(ccc2c1cccc2)O 240690a_100138425928_100011219592 [0,1,1,0,0,0|1,0,1]=4 610 B18R2.123922 CCCNC(=O)c1c(ccc2c1cccc2)O 240690a_100020643023_100011219592 [0,1,1,0,0,0|1,0,1]=4 611 B18R2.123922 CCNN=C(C)c1c(ccc2c1cccc2)O 4a_100000756455_100000011452 [0,1,1,0,0,0|0,0,1]=3 612 B18R2.123922 CCNNC(=O)c1c(ccc2c1cccc2)O 22a_100000756455_100011219592 [0,1,1,0,0,0|1,0,1]=4 613 B18R2.123922 O=C(NCCF)c1c(ccc2c1cccc2)O 240690a_100000724931_100011219592 [0,1,1,0,0,0|1,0,1]=4 614 B18R2.123922 O=C(NCCO)c1c(ccc2c1cccc2)O 240690a_100000210304_100011219592 [0,1,1,0,0,0|1,0,1]=4 615 B18R2.126352 CCC(=O)C(O)c1c(ccc2c1cccc2)O 1458a_100000068390_100000210202 [0,1,1,0,0,0|2,0,0]=4 616 B18R2.126352 CCN(C)C(=O)c1c(ccc2c1cccc2)O 240690a_100000225621_100011219592 [0,1,1,0,0,0|1,0,1]=4 617 B18R2.632484 CCNC(=O)c1c(ccc2c1cccc2)OC 11a_100015525214_100011214975 [0,1,1,0,0,0|1,0,1]=4 618 B18R2.632484 CCNC(=O)c1c(ccc2c1cccc2)OC 240690a_100015525214_100011214975 [0,1,1,0,0,0|1,0,1]=4 619 B18R2.632484 CCNC(=O)c1c(ccc2c1cccc2)OC 527a_100015525214_100011214975 [0,1,1,0,0,0|1,0,1]=4 620 B18R2.615197 C#CC(C)O[C@@H](C)c1cccc2c1cccc2 34a_100011852130_200000035995 [0,1,1,0,0,0|2,0,0]=4 621 B18R2.615197 CC(C#N)N[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100000184139 [0,1,1,0,0,0|1,0,0]=3 622 B18R2.615197 CC(C#N)O[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100000703298 [0,1,1,0,0,0|2,0,0]=4 623 B18R2.615197 CC(CO)N[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100012180447 [0,1,1,0,0,0|0,0,0]=2 624 B18R2.615197 CC(CO)O[C@@H](C)c1cccc2c1cccc2 34a_100011852130_100012180447 [0,1,1,0,0,0|1,0,0]=3 625 B18R2.615197 CC(CO)O[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100012180447 [0,1,1,0,0,0|1,0,0]=3 626 B18R2.615197 CC(N[C@H](C)CF)c1cccc2c1cccc2 269862a_100102880703_100000210126 [0,1,1,0,0,0|1,0,0]=3 627 B18R2.615197 CC(N[C@H](C)CF)c1cccc2c1nccc2 269862a_100102880703_100011995788 [0,1,1,0,0,0|2,0,0]=4 628 B18R2.615197 CC(N[C@H](C)CF)c1cncc2c1cccc2 269862a_100102880703_100011951259 [0,1,1,0,0,0|2,0,0]=4 629 B18R2.615197 CC(N[C@H](C)CF)c1nccc2c1cccc2 269862a_100102880703_100000742330 [0,1,1,0,0,0|2,0,0]=4 630 B18R2.615197 CC(N[C@H](C)CO)c1cccc2c1cccc2 269862a_100000737577_100000210126 [0,1,1,0,0,0|0,0,0]=2 631 B18R2.615197 CC(N[C@H](C)CO)c1cccc2c1nccc2 269862a_100000737577_100011995788 [0,1,1,0,0,0|1,0,0]=3 632 B18R2.615197 CC(N[C@H](C)CO)c1cncc2c1cccc2 269862a_100000737577_100011951259 [0,1,1,0,0,0|1,0,0]=3 633 B18R2.615197 CC(N[C@H](C)CO)c1nccc2c1cccc2 269862a_100000737577_100000742330 [0,1,1,0,0,0|1,0,0]=3 634 B18R2.615197 CCC(=O)N[C@@H](C)c1cccc2c1cccc2 11a_100011830313_100000210414 [0,1,1,0,0,0|0,0,2]=4 635 B18R2.615197 CCC(=O)N[C@@H](C)c1cccc2c1cccc2 1626a_100011830313_100000210414 [0,1,1,0,0,0|0,0,2]=4 636 B18R2.615197 CCC(=O)N[C@@H](C)c1cccc2c1cccc2 240690a_100011830313_100000210414 [0,1,1,0,0,0|0,0,2]=4 637 B18R2.615197 CCC(=O)N[C@@H](C)c1cccc2c1cccc2 527a_100011830313_100000210414 [0,1,1,0,0,0|0,0,2]=4 638 B18R2.615197 CCC(C)NC(C)c1cccc2c1cccc2 269862a_100000209981_100000210126 [0,1,1,0,0,0|1,0,0]=3 639 B18R2.615197 CCC(C)NC(C)c1cccc2c1nccc2 269862a_100000209981_100011995788 [0,1,1,0,0,0|2,0,0]=4 640 B18R2.615197 CCC(C)NC(C)c1cncc2c1cccc2 269862a_100000209981_100011951259 [0,1,1,0,0,0|2,0,0]=4 641 B18R2.615197 CCC(C)NC(C)c1nccc2c1cccc2 269862a_100000209981_100000742330 [0,1,1,0,0,0|2,0,0]=4 642 B18R2.615197 CCC(C)N[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100000758301 [0,1,1,0,0,0|1,0,0]=3 643 B18R2.615197 CCC(C)O[C@@H](C)c1cccc2c1cccc2 34a_100011852130_100011215416 [0,1,1,0,0,0|2,0,0]=4 644 B18R2.615197 CCC(C)O[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100000758301 [0,1,1,0,0,0|2,0,0]=4 645 B18R2.615197 CCC(O)CN(C)c1cccc2c1cccc2 2230a_100000220138_100011218378 [0,1,1,0,0,0|2,0,0]=4 646 B18R2.615197 CCC(O)CN(C)c1cccc2c1cccc2 269982a_100000220138_100011218378 [0,1,1,0,0,0|2,0,0]=4 647 B18R2.615197 CCC(O)CN(C)c1cccc2c1cccc2 34a_100000220138_100011218378 [0,1,1,0,0,0|2,0,0]=4 648 B18R2.615197 CN(CC(O)CO)c1cccc2c1cccc2 2230a_100000220138_100011219619 [0,1,1,0,0,0|2,0,0]=4 649 B18R2.615197 CN(CC(O)CO)c1cccc2c1cccc2 34a_100000220138_100011219619 [0,1,1,0,0,0|2,0,0]=4 650 B18R2.615197 CN(C[C@@H](O)CF)c1cccc2c1cccc2 2230a_100000220138_100015614560 [0,1,1,0,0,0|2,0,0]=4 651 B18R2.615197 CN(C[C@@H](O)CF)c1cccc2c1cccc2 34a_100000220138_100015614560 [0,1,1,0,0,0|2,0,0]=4 652 B18R2.615197 CN(C[C@@H](O)CO)c1cccc2c1cccc2 2230a_100000220138_100009815848 [0,1,1,0,0,0|2,0,0]=4 653 B18R2.615197 CN(C[C@@H](O)CO)c1cccc2c1cccc2 34a_100000220138_100009815848 [0,1,1,0,0,0|2,0,0]=4 654 B18R2.615197 CNC(=O)N[C@@H](C)c1cccc2c1cccc2 2708a_100011830313_106832991635 [0,1,1,0,0,0|0,0,2]=4 655 B18R2.615197 CNC(=O)N[C@@H](C)c1cccc2c1cccc2 2708a_100102657272_100011830313 [0,1,1,0,0,0|0,0,2]=4 656 B18R2.615197 CNC(=O)N[C@@H](C)c1cccc2c1cccc2 273464a_100011830313_100102657272 [0,1,1,0,0,0|0,0,2]=4 657 B18R2.615197 CNC(=O)N[C@@H](C)c1cccc2c1cccc2 273464a_100102657272_100011830313 [0,1,1,0,0,0|0,0,2]=4 658 B18R2.615197 CNC(=O)N[C@@H](C)c1cccc2c1cccc2 512a_106832991638_100011830313 [0,1,1,0,0,0|0,0,2]=4 659 B18R2.615197 C[C@@H](CO)CN(C)c1cccc2c1cccc2 2230a_100000220138_100000059175 [0,1,1,0,0,0|2,0,0]=4 660 B18R2.615197 C[C@@H](CO)CN(C)c1cccc2c1cccc2 269982a_100000220138_100000059175 [0,1,1,0,0,0|2,0,0]=4 661 B18R2.615197 C[C@@H](CO)CN(C)c1cccc2c1cccc2 34a_100000220138_100000059175 [0,1,1,0,0,0|2,0,0]=4 662 B18R2.615197 C[C@H](CO)NC(=O)c1cccc2c1cccc2 240690a_100000737577_100000210949 [0,1,1,0,0,0|1,0,1]=4 663 B18R2.615197 C[C@H](CO)NC(=O)c1cccc2c1cccc2 527a_100000737577_100000210949 [0,1,1,0,0,0|1,0,1]=4 664 B18R2.615197 C[C@H](NC(=O)CO)c1cccc2c1cccc2 240690a_100011830313_100000210174 [0,1,1,0,0,0|0,0,2]=4 665 B18R2.615197 C[C@H](NC(=O)CO)c1cccc2c1cccc2 527a_100011830313_100000210174 [0,1,1,0,0,0|0,0,2]=4 666 B18R2.1385121 CC(=O)NC(C)(C)c1cccc2c1cccc2 11a_100020603280_100015343762 [0,1,1,0,0,0|0,0,2]=4 667 B18R2.1385121 CC(=O)NC(C)(C)c1cccc2c1cccc2 1626a_100020603280_100015343762 [0,1,1,0,0,0|0,0,2]=4 668 B18R2.1385121 CC(=O)NC(C)(C)c1cccc2c1cccc2 240690a_100020603280_100015343762 [0,1,1,0,0,0|0,0,2]=4 669 B18R2.1385121 CC(=O)NC(C)(C)c1cccc2c1cccc2 527a_100020603280_100103153847 [0,1,1,0,0,0|0,0,2]=4 670 B18R2.1385121 CC(C)NC(C)(C)c1cccc2c1cccc2 2230a_100020603280_100000210206 [0,1,1,0,0,0|1,0,0]=3 671 B18R2.1385121 CC(C)OC(C)(C)c1cccc2c1cccc2 34a_100011753710_100000210206 [0,1,1,0,0,0|2,0,0]=4 672 B18R2.1385121 CC(C)OC(C)(C)c1cccc2c1cccc2 7a_100011753710_100000210206 [0,1,1,0,0,0|2,0,0]=4 673 B18R2.1408667 CN(CC(C)(C)O)c1cccc2c1cccc2 34a_100000220138_100000764493 [0,1,1,0,0,0|2,0,0]=4 674 B18R2.1408667 C[C@H](NS(=O)(=O)C)c1cccc2c1cccc2 40a_100011830313_100000738038 [0,1,1,0,0,0|1,0,1]=4 675 B18R2.1408667 C[C@H](OC(C)(C)C)c1cccc2c1cccc2 34a_100011852130_100000210625 [0,1,1,0,0,0|2,0,0]=4 676 B18R2.1411698 CC(=O)NC(CO)c1cccc2c1cccc2 240690a_200000704961_100015343762 [0,1,1,0,0,0|0,0,2]=4 677 B18R2.1411698 CC(=O)NC(CO)c1cccc2c1cccc2 527a_200000704961_100103153847 [0,1,1,0,0,0|0,0,2]=4 678 B18R2.1411698 CC(C)NC(CO)c1cccc2c1cccc2 2230a_200000704961_100000210206 [0,1,1,0,0,0|1,0,0]=3 679 B18R2.1411698 CC(C)NC(CO)c1cccc2c1cccc2 34a_200000704961_100000210206 [0,1,1,0,0,0|1,0,0]=3 680 B18R2.1411698 CCN(CC(C)O)c1cccc2c1cccc2 2230a_100000185437_100011218427 [0,1,1,0,0,0|2,0,0]=4 681 B18R2.1411698 CCN(CC(C)O)c1cccc2c1cccc2 269982a_100000185437_100011218427 [0,1,1,0,0,0|2,0,0]=4 682 B18R2.1411698 CCN(CC(C)O)c1cccc2c1cccc2 34a_100000185437_100011218427 [0,1,1,0,0,0|2,0,0]=4 683 B18R2.1411698 CCN(C[C@@H](C)O)c1cccc2c1cccc2 2230a_100000185437_100009817552 [0,1,1,0,0,0|2,0,0]=4 684 B18R2.1411698 CCN(C[C@@H](C)O)c1cccc2c1cccc2 269982a_100000185437_100009817552 [0,1,1,0,0,0|2,0,0]=4 685 B18R2.1411698 CCN(C[C@@H](C)O)c1cccc2c1cccc2 34a_100000185437_100009817552 [0,1,1,0,0,0|2,0,0]=4 686 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 11a_100009815097_100015343762 [0,1,1,0,0,0|0,0,2]=4 687 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 1626a_100009815097_100015343762 [0,1,1,0,0,0|0,0,2]=4 688 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 240690a_100009815097_100015343762 [0,1,1,0,0,0|0,0,2]=4 689 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 527a_100009815097_100103153847 [0,1,1,0,0,0|0,0,2]=4 690 B18R2.2912343 CC(C)N(C)[C@H](C)c1cccc2c1cccc2 2230a_100009815097_100000210206 [0,1,1,0,0,0|1,0,0]=3 691 B18R2.2912343 CC(C)N(C)[C@H](C)c1cccc2c1cccc2 269982a_100009815097_100000210206 [0,1,1,0,0,0|1,0,0]=3 692 B18R2.2912343 C[C@@H](O)C(=O)N(C)c1cccc2c1cccc2 22a_100000220138_100000717761 [0,1,1,0,0,0|2,0,0]=4 693 B18R2.2912343 C[C@H](O)C(=O)N(C)c1cccc2c1cccc2 1626a_100000220138_217856618621 [0,1,1,0,0,0|2,0,0]=4 694 B18R2.2912343 C[C@H](O)C(=O)N(C)c1cccc2c1cccc2 22a_100000220138_217856618621 [0,1,1,0,0,0|2,0,0]=4 695 B18R3.151612 CNC1CCCc2c1c3c(cc2)cccc3 269862a_106832991636_100000061332 [1,1,0,0,0,0|2,0,0]=4 696 B18R3.36580 c1cc2cc(ccc2cn1)OC3CCCC3 34a_100000046372_100000179811 [0,0,1,1,0,0|2,0,0]=4 697 B18R3.36580 c1cc2cc(ccc2cn1)OC3CCCC3 7a_100000046372_100000179811 [0,0,1,1,0,0|2,0,0]=4 698 B18R3.36580 c1cc2ccc(cc2cn1)OC3CCCC3 7a_100000752006_100000179811 [0,0,1,1,0,0|2,0,0]=4 699 B18R3.36580 c1ccc2cc(ccc2c1)NC3CCCC3 34a_100000211940_100000179811 [0,0,1,1,0,0|2,0,0]=4 700 B18R3.36580 c1ccc2cc(ccc2c1)NC3CCCC3 7a_100000211940_100000179811 [0,0,1,1,0,0|2,0,0]=4 701 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCCC3 34a_100000185828_100000179811 [0,0,1,1,0,0|1,0,0]=3 702 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCCC3 7a_100000185828_100000179811 [0,0,1,1,0,0|1,0,0]=3 703 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCOC3 34a_100000185828_100000690089 [0,0,1,1,0,0|2,0,0]=4 704 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCOC3 7a_100000185828_100000731011 [0,0,1,1,0,0|2,0,0]=4 705 B18R3.36580 c1ccc2cc(ccc2c1)SC3CCCC3 62a_100011217020_100000233703 [0,0,1,1,0,0|1,1,0]=4 706 B18R3.36580 c1ccc2ncc(cc2c1)OC3CCCC3 34a_100011934006_100000179811 [0,0,1,1,0,0|2,0,0]=4 707 B18R3.36580 c1ccc2ncc(cc2c1)OC3CCCC3 7a_100011934006_100000179811 [0,0,1,1,0,0|2,0,0]=4 708 B18R3.36580 c1cnc2cc(ccc2c1)OC3CCCC3 34a_100011216045_100000179811 [0,0,1,1,0,0|2,0,0]=4 709 B18R3.36580 c1cnc2ccc(cc2c1)OC3CCCC3 34a_100011215586_100000179811 [0,0,1,1,0,0|2,0,0]=4 710 B18R3.36580 c1cnc2ccc(cc2c1)OC3CCCC3 7a_100011215586_100000179811 [0,0,1,1,0,0|2,0,0]=4 711 B18R3.14325 CCOc1ccc2ccccc2c1C3CC3 271570a_100011220607_200000173018 [0,0,1,1,0,0|1,0,0]=3 712 B18R3.221 Oc1ccc2ccccc2c1C3=CCCC3 271570a_100000089523_100000183829 [0,0,1,1,0,0|1,0,1]=4 713 B18R3.115974 CC(C)OC1Cc2cccc3c2c1ccc3 34a_200000013446_100000210206 [0,0,1,1,0,0|2,0,0]=4 714 B18R3.115974 CC(C)OC1Cc2cccc3c2c1ccc3 7a_200000013446_100000210206 [0,0,1,1,0,0|2,0,0]=4 715 B18R3.118880 CN(CC1CO1)c2cccc3c2cccc3 2230a_100000220138_100011216344 [0,0,1,1,0,0|2,0,0]=4 716 B18R3.118880 CN(CC1CO1)c2cccc3c2cccc3 269982a_100000220138_102125554688 [0,0,1,1,0,0|2,0,0]=4 717 B18R3.118880 CN(CC1CO1)c2cccc3c2cccc3 34a_100000220138_102125554688 [0,0,1,1,0,0|2,0,0]=4 718 B18R3.118880 CN(C[C@@H]1CO1)c2cccc3c2cccc3 269982a_100000220138_100000745022 [0,0,1,1,0,0|2,0,0]=4 719 B18R3.118880 C[C@H](OC1CC1)c2cccc3c2cccc3 34a_100011852130_100000211595 [0,0,1,1,0,0|2,0,0]=4 720 B16R2.5 CCCC(C)Oc1csc2c1cccc2 34a_100000077758_100000766640 [0,0,1,0,1,0|2,0,0]=4 721 B16R2.5 CCCC(C)Oc1csc2c1cccc2 7a_100000077758_100000766640 [0,0,1,0,1,0|2,0,0]=4 722 B16R2.5 CCNC(C)Cc1c[nH]c2c1cccc2 270004a_100015525214_100000030300 [0,0,1,0,1,0|2,0,0]=4 723 B16R2.767 CC(OCF)c1ccc2ccccc2c1 34a_100011215343_100015361967 [0,0,1,0,1,0|2,0,0]=4 724 B16R2.767 CC(OCF)c1ccc2ccccc2c1 7a_100011215343_100015361967 [0,0,1,0,1,0|2,0,0]=4 725 B16R2.767 CCCN(C)c1ccc2ccccc2c1 2230a_100000181211_100000210303 [0,0,1,0,1,0|2,0,0]=4 726 B16R2.767 CCCN(C)c1ccc2ccccc2c1 269982a_100000181211_100000210303 [0,0,1,0,1,0|2,0,0]=4 727 B16R2.767 CCCN(C)c1ccc2ccccc2c1 34a_100000181211_100000210303 [0,0,1,0,1,0|2,0,0]=4 728 B16R2.767 CCNC(=O)c1ccc2ccccc2c1 11a_100015525214_100000210637 [0,0,1,0,1,0|1,0,1]=4 729 B16R2.767 CCNC(=O)c1ccc2ccccc2c1 240690a_100015525214_100000210637 [0,0,1,0,1,0|1,0,1]=4 730 B16R2.767 CCNC(=O)c1ccc2ccccc2c1 527a_100015525214_100000210637 [0,0,1,0,1,0|1,0,1]=4 731 B16R2.767 CCNC(C)c1cc2ccccc2cn1 269862a_100015525214_200000084103 [0,0,1,0,1,0|1,0,0]=3 732 B16R2.767 CCNC(C)c1ccc2ccccc2c1 2230a_100000737073_100000210202 [0,0,1,0,1,0|0,0,0]=2 733 B16R2.767 CCNC(C)c1ccc2ccccc2c1 269862a_100015525214_100000210793 [0,0,1,0,1,0|0,0,0]=2 734 B16R2.767 CCNC(C)c1ccc2ccccc2n1 269862a_100015525214_100000684817 [0,0,1,0,1,0|1,0,0]=3 735 B16R2.767 CCNC(C)c1ccc2ncccc2c1 269862a_100015525214_100011286481 [0,0,1,0,1,0|1,0,0]=3 736 B16R2.767 CCNC(C)c1ccc2nccnc2c1 269862a_100015525214_100012000623 [0,0,1,0,1,0|2,0,0]=4 737 B16R2.767 CCNC(C)c1cnc2ccccc2c1 269862a_100015525214_100011376191 [0,0,1,0,1,0|1,0,0]=3 738 B16R2.767 CCNC(C)c1cnc2ccccc2n1 269862a_100015525214_100011830413 [0,0,1,0,1,0|2,0,0]=4 739 B16R2.767 CCOC(C)c1ccc2ccccc2c1 34a_100011215343_100000210202 [0,0,1,0,1,0|1,0,0]=3 740 B16R2.767 CCOC(C)c1ccc2ccccc2c1 7a_100011215343_100000210202 [0,0,1,0,1,0|1,0,0]=3 741 B16R2.2151 CCCC(C)Oc1ccc2[nH]ccc2c1 34a_100000756620_100000766640 [0,0,1,0,1,0|2,0,0]=4 742 B16R2.2151 CCCC(C)Oc1ccc2cc[nH]c2c1 34a_100000036713_100000766640 [0,0,1,0,1,0|2,0,0]=4 743 B16R2.2151 CCCC(C)Oc1ccc2ccoc2c1 34a_100000089557_100000766640 [0,0,1,0,1,0|2,0,0]=4 744 B16R2.2151 CCCC(C)Oc1ccc2ccoc2c1 7a_100000089557_100000766640 [0,0,1,0,1,0|2,0,0]=4 745 B16R2.2151 CCCC(C)Oc1ccc2occc2c1 34a_100000070125_100000766640 [0,0,1,0,1,0|2,0,0]=4 746 B16R2.2151 CCCC(C)Oc1ccc2occc2c1 7a_100000070125_100000766640 [0,0,1,0,1,0|2,0,0]=4 747 B16R2.2151 CCCC(C)Oc1ccc2sccc2c1 34a_100012180905_100000766640 [0,0,1,0,1,0|2,0,0]=4 748 B16R2.2151 CCCC(C)Oc1ccc2sccc2c1 7a_100012180905_100000766640 [0,0,1,0,1,0|2,0,0]=4 749 B16R2.244415 CC(C)N(C)c1cccc2c1cccc2 2230a_100000220138_100000210206 [0,0,1,0,1,0|2,0,0]=4 750 B16R2.244415 CC(C)N(C)c1cccc2c1cccc2 269982a_100000220138_100000210206 [0,0,1,0,1,0|2,0,0]=4 751 B16R2.244415 CC(C)N(C)c1cccc2c1cccc2 34a_100000220138_100000210206 [0,0,1,0,1,0|2,0,0]=4 752 B16R2.244415 C[C@H](c1cccc2c1cccc2)N(C)C 2230a_100009815097_200000210301 [0,0,1,0,1,0|2,0,0]=4 753 B16R2.244415 C[C@H](c1cccc2c1cccc2)N(C)C 269982a_100009815097_200000210301 [0,0,1,0,1,0|2,0,0]=4 754 B16R2.244415 C[C@H](c1cccc2c1cccc2)N(C)[13CH3] 2230a_100009815097_200025704644 [0,0,1,0,1,0|2,0,0]=4 755 B16R2.244415 C[C@H](c1cccc2c1cccc2)N(C)[13CH3] 269982a_100009815097_200025704644 [0,0,1,0,1,0|2,0,0]=4 756 B18R2.8085 C/C=C/C(C)OCc1ccc2ccccc2c1 34a_200102604097_100011216711 [0,0,1,0,0,1|1,0,1]=4 757 B18R2.8085 CC#CC(C)OCc1ccc2ccccc2c1 34a_100011216543_100011216711 [0,0,1,0,0,1|1,0,1]=4 758 B18R2.8085 CC(CCBr)OCc1ccc2ccccc2c1 34a_100012276601_100011216711 [0,0,1,0,0,1|2,0,0]=4 759 B18R2.8085 CC(CCO)OCc1ccc2ccccc2c1 34a_100011215330_100009893172 [0,0,1,0,0,1|2,0,0]=4 760 B18R2.8085 CC(CCO)OCc1ccc2ccccc2c1 7a_100011215330_100009893172 [0,0,1,0,0,1|2,0,0]=4 761 B18R2.8085 CCCC(C)CNc1ccc2ccccc2c1 34a_100000211940_100011216630 [0,0,1,0,0,1|2,0,0]=4 762 B18R2.8085 CCCC(C)CNc1ccc2ccccc2c1 7a_100000211940_100011216630 [0,0,1,0,0,1|2,0,0]=4 763 B18R2.8085 CCCC(C)COc1ccc2ccccc2c1 34a_100000185828_100011216630 [0,0,1,0,0,1|1,0,0]=3 764 B18R2.8085 CCCC(C)COc1ccc2ccccc2c1 7a_100000185828_100011216630 [0,0,1,0,0,1|1,0,0]=3 765 B18R2.8085 CCCC(C)COc1ccc2cccnc2c1 34a_100011216045_100011216630 [0,0,1,0,0,1|2,0,0]=4 766 B18R2.8085 CCCC(C)COc1ccc2ccncc2c1 7a_100000752006_100011216630 [0,0,1,0,0,1|2,0,0]=4 767 B18R2.8085 CCCC(C)COc1ccc2cnccc2c1 34a_100000046372_100011216630 [0,0,1,0,0,1|2,0,0]=4 768 B18R2.8085 CCCC(C)COc1ccc2cnccc2c1 7a_100000046372_100011216630 [0,0,1,0,0,1|2,0,0]=4 769 B18R2.8085 CCCC(C)COc1ccc2ncccc2c1 34a_100011215586_100011216630 [0,0,1,0,0,1|2,0,0]=4 770 B18R2.8085 CCCC(C)COc1ccc2ncccc2c1 7a_100011215586_100011216630 [0,0,1,0,0,1|2,0,0]=4 771 B18R2.8085 CCCC(C)COc1cnc2ccccc2c1 34a_100011934006_100011216630 [0,0,1,0,0,1|2,0,0]=4 772 B18R2.8085 CCCC(C)COc1cnc2ccccc2c1 7a_100011934006_100011216630 [0,0,1,0,0,1|2,0,0]=4 773 B18R2.8085 CCCC(C)CSc1ccc2ccccc2c1 62a_100011216630_100000233703 [0,0,1,0,0,1|1,1,0]=4 774 B18R2.8085 CCCC(C)NCc1ccc2ccccc2c1 207a_100000741246_100000211584 [0,0,1,0,0,1|2,0,0]=4 775 B18R2.8085 CCCC(C)NCc1ccc2ccccc2c1 2230a_100000739491_100000766640 [0,0,1,0,0,1|2,0,0]=4 776 B18R2.8085 CCCC(C)NCc1ccc2ccccc2c1 2230a_100000741246_100011216711 [0,0,1,0,0,1|2,0,0]=4 777 B18R2.8085 CCCC(C)NCc1ccc2ccccc2c1 270004a_100000739491_100000211909 [0,0,1,0,0,1|2,0,0]=4 778 B18R2.8085 CCCC(C)NCc1ccc2ccccc2c1 270004a_100000741246_100000211584 [0,0,1,0,0,1|2,0,0]=4 779 B18R2.8085 CCCC(C)NCc1ccc2ccccc2c1 34a_100000739491_100000766640 [0,0,1,0,0,1|2,0,0]=4 780 B18R2.8085 CCCC(C)OCc1cc2ccccc2cn1 34a_100000764384_100009869231 [0,0,1,0,0,1|2,0,0]=4 781 B18R2.8085 CCCC(C)OCc1cc2ccccc2cn1 7a_100000764384_100009869231 [0,0,1,0,0,1|2,0,0]=4 782 B18R2.8085 CCCC(C)OCc1ccc2ccccc2c1 34a_100000764384_100011216711 [0,0,1,0,0,1|1,0,0]=3 783 B18R2.8085 CCCC(C)OCc1ccc2ccccc2c1 34a_100011215330_100000766640 [0,0,1,0,0,1|1,0,0]=3 784 B18R2.8085 CCCC(C)OCc1ccc2ccccc2c1 7a_100000764384_100011216711 [0,0,1,0,0,1|1,0,0]=3 785 B18R2.8085 CCCC(C)OCc1ccc2ccccc2c1 7a_100011215330_100000766640 [0,0,1,0,0,1|1,0,0]=3 786 B18R2.8085 CCCC(C)OCc1ccc2ccccc2n1 34a_100000764384_100000737579 [0,0,1,0,0,1|2,0,0]=4 787 B18R2.8085 CCCC(C)OCc1ccc2ccccc2n1 7a_100000764384_100000737579 [0,0,1,0,0,1|2,0,0]=4 788 B18R2.8085 CCCC(C)OCc1ccc2cnccc2c1 34a_100000764384_100020605334 [0,0,1,0,0,1|2,0,0]=4 789 B18R2.8085 CCCC(C)OCc1ccc2cnccc2c1 7a_100000764384_100020605334 [0,0,1,0,0,1|2,0,0]=4 790 B18R2.8085 CCCC(C)OCc1ccc2ncccc2c1 34a_100000764384_100000703657 [0,0,1,0,0,1|2,0,0]=4 791 B18R2.8085 CCCC(C)OCc1ccc2ncccc2c1 34a_100011315636_100000766640 [0,0,1,0,0,1|2,0,0]=4 792 B18R2.8085 CCCC(C)OCc1ccc2ncccc2c1 7a_100000764384_100000703657 [0,0,1,0,0,1|2,0,0]=4 793 B18R2.8085 CCCC(C)OCc1cnc2ccccc2c1 34a_100011258773_100000766640 [0,0,1,0,0,1|2,0,0]=4 794 B18R2.8085 CCCC(C)SCc1ccc2ccccc2c1 62a_100000766640_100011216711 [0,0,1,0,0,1|1,1,0]=4 795 B18R2.8085 CCCC(C)SCc1ccc2ccccc2c1 62a_100011216711_100000766640 [0,0,1,0,0,1|1,1,0]=4 796 B18R2.8085 CCNC(=O)COc1ccc2ccccc2c1 11a_100015525214_100000185456 [0,0,1,0,0,1|1,0,1]=4 797 B18R2.8085 CCNC(=O)COc1ccc2ccccc2c1 240690a_100015525214_100000185456 [0,0,1,0,0,1|1,0,1]=4 798 B18R2.8085 CCNC(=O)COc1ccc2ccccc2c1 34a_100000185828_100000183381 [0,0,1,0,0,1|1,0,1]=4 799 B18R2.8085 CCNC(=O)COc1ccc2ccccc2c1 527a_100015525214_100000185456 [0,0,1,0,0,1|1,0,1]=4 800 B18R2.8085 CCNC(=O)COc1ccc2ccccc2c1 7a_100000185828_100000183381 [0,0,1,0,0,1|1,0,1]=4 801 B18R2.8085 COCC(C)OCc1ccc2ccccc2c1 34a_100011215330_100000765312 [0,0,1,0,0,1|2,0,0]=4 802 B18R2.8085 COCC(C)OCc1ccc2ccccc2c1 7a_100011215330_100000765312 [0,0,1,0,0,1|2,0,0]=4 803 B18R2.8085 COC[C@@H](C)OCc1ccc2ccccc2c1 34a_100011934205_100011216711 [0,0,1,0,0,1|2,0,0]=4 804 B18R2.14525 CCOc1ccc2ccccc2c1C=C(C)C 271570a_100102525489_200000173018 [0,0,1,0,0,1|1,0,1]=4 805 B18R2.14525 CCOc1ccc2ccccc2c1CN(C)C 270004a_100102631434_100000169849 [0,0,1,0,0,1|2,0,0]=4 806 B18R2.14525 CCOc1ccc2ccccc2c1SC(C)C 62a_100000210206_200000173018 [0,0,1,0,0,1|1,0,0]=3 807 B18R2.23220 COc1c(ccc2c1cccc2)COC(C)C 34a_200000067034_100000210206 [0,0,1,0,0,1|2,0,0]=4 808 B18R2.23220 COc1c(ccc2c1cccc2)COC(C)C 7a_200000067034_100000210206 [0,0,1,0,0,1|2,0,0]=4 809 B18R2.124867 CC(CCO)Nc1c(ccc2c1cccc2)O 34a_100000007056_100009893172 [0,0,1,0,0,1|2,0,0]=4 810 B18R2.124867 CC(CCO)Sc1c(ccc2c1cccc2)O 62a_100009893172_100000183829 [0,0,1,0,0,1|2,0,0]=4 811 B18R2.124867 CCCC(C)Nc1c(ccc2c1cccc2)Br 34a_100009817101_100000766640 [0,0,1,0,0,1|2,0,0]=4 812 B18R2.124867 CCCC(C)Nc1c(ccc2c1cccc2)C 34a_100000688109_100000766640 [0,0,1,0,0,1|2,0,0]=4 813 B18R2.124867 CCCC(C)Nc1c(ccc2c1cccc2)Cl 34a_200009860907_100000766640 [0,0,1,0,0,1|2,0,0]=4 814 B18R2.124867 CCCC(C)Nc1c(ccc2c1cccc2)O 34a_100000007056_100000766640 [0,0,1,0,0,1|1,0,0]=3 815 B18R2.124867 CCCC(C)Oc1c(ccc2c1cccc2)Br 34a_100009996032_100000766640 [0,0,1,0,0,1|2,0,0]=4 816 B18R2.124867 CCCC(C)Oc1c(ccc2c1cccc2)Br 7a_100009996032_100000766640 [0,0,1,0,0,1|2,0,0]=4 817 B18R2.124867 CCCC(C)Oc1c(ccc2c1cccc2)C 34a_100000039261_100000766640 [0,0,1,0,0,1|2,0,0]=4 818 B18R2.124867 CCCC(C)Oc1c(ccc2c1cccc2)C 7a_100000039261_100000766640 [0,0,1,0,0,1|2,0,0]=4 819 B18R2.124867 CCCC(C)Oc1c(ccc2c1cccc2)N 34a_100000007060_100000766640 [0,0,1,0,0,1|2,0,0]=4 820 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)Br 62a_100000766640_100010090040 [0,0,1,0,0,1|2,0,0]=4 821 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)Br 62a_100010090040_100000766640 [0,0,1,0,0,1|2,0,0]=4 822 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)C 62a_100000759710_100000766640 [0,0,1,0,0,1|2,0,0]=4 823 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)C 62a_100000766640_100000759710 [0,0,1,0,0,1|2,0,0]=4 824 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)N 62a_100000705303_100000766640 [0,0,1,0,0,1|2,0,0]=4 825 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)N 62a_100000766640_100000705303 [0,0,1,0,0,1|2,0,0]=4 826 B18R2.124867 CCCC(C)Sc1c(ccc2c1cccc2)O 62a_100000766640_100000183829 [0,0,1,0,0,1|1,0,0]=3 827 B18R2.124867 CCCC(C)Sc1c(ccc2c1cncc2)O 62a_100000766640_200010115057 [0,0,1,0,0,1|2,0,0]=4 828 B18R2.124867 CCCC(C)Sc1c(ccc2c1nccc2)O 62a_100000766640_100010173343 [0,0,1,0,0,1|2,0,0]=4 829 B18R2.124867 COCC(C)Nc1c(ccc2c1cccc2)O 34a_100000007056_100000765312 [0,0,1,0,0,1|2,0,0]=4 830 B18R2.124867 COCC(C)Sc1c(ccc2c1cccc2)O 62a_100000765312_100000183829 [0,0,1,0,0,1|2,0,0]=4 831 B18R2.2459307 C=C(C)CN[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100000748629 [0,0,1,0,0,1|1,0,1]=4 832 B18R2.2459307 CC(=NNC(C)C)c1cccc2c1cccc2 4a_100000741168_100000210126 [0,0,1,0,0,1|1,0,1]=4 833 B18R2.2459307 CC(C)CNC(C)c1cccc2c1cccc2 269862a_100000210953_100000210126 [0,0,1,0,0,1|1,0,0]=3 834 B18R2.2459307 CC(C)CNC(C)c1cccc2c1nccc2 269862a_100000210953_100011995788 [0,0,1,0,0,1|2,0,0]=4 835 B18R2.2459307 CC(C)CNC(C)c1cncc2c1cccc2 269862a_100000210953_100011951259 [0,0,1,0,0,1|2,0,0]=4 836 B18R2.2459307 CC(C)CNC(C)c1nccc2c1cccc2 269862a_100000210953_100000742330 [0,0,1,0,0,1|2,0,0]=4 837 B18R2.2459307 CC(C)CN[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100000210760 [0,0,1,0,0,1|1,0,0]=3 838 B18R2.2459307 CC(C)CN[C@@H](C)c1cccc2c1cccc2 270004a_100011830313_100000210432 [0,0,1,0,0,1|1,0,0]=3 839 B18R2.2459307 CC(C)CO[C@@H](C)c1cccc2c1cccc2 34a_100011852130_100000210624 [0,0,1,0,0,1|2,0,0]=4 840 B18R2.2459307 CC(C)CO[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100000210760 [0,0,1,0,0,1|2,0,0]=4 841 B18R2.2459307 CC(O)CCN(C)c1cccc2c1cccc2 2230a_100000220138_100012276601 [0,0,1,0,0,1|2,0,0]=4 842 B18R2.2459307 CC(O)CCN(C)c1cccc2c1cccc2 269982a_100000220138_100012276601 [0,0,1,0,0,1|2,0,0]=4 843 B18R2.2459307 CC(O)CCN(C)c1cccc2c1cccc2 34a_100000220138_100012276601 [0,0,1,0,0,1|2,0,0]=4 844 B18R2.2459307 CC(O)CNC(=O)c1cccc2c1cccc2 11a_100000210904_100000210949 [0,0,1,0,0,1|1,0,1]=4 845 B18R2.2459307 CC(O)CNC(=O)c1cccc2c1cccc2 240690a_100000210904_100000210949 [0,0,1,0,0,1|1,0,1]=4 846 B18R2.2459307 CC(O)CNC(=O)c1cccc2c1cccc2 527a_100000210904_100000210949 [0,0,1,0,0,1|1,0,1]=4 847 B18R2.2459307 CC(O)CNC(C)c1cccc2c1cccc2 269862a_100000210904_100000210126 [0,0,1,0,0,1|0,0,0]=2 848 B18R2.2459307 CC(O)CNC(C)c1cccc2c1nccc2 269862a_100000210904_100011995788 [0,0,1,0,0,1|1,0,0]=3 849 B18R2.2459307 CC(O)CNC(C)c1cncc2c1cccc2 269862a_100000210904_100011951259 [0,0,1,0,0,1|1,0,0]=3 850 B18R2.2459307 CC(O)CNC(C)c1nccc2c1cccc2 269862a_100000210904_100000742330 [0,0,1,0,0,1|1,0,0]=3 851 B18R2.2459307 CC(O)CN[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100011218427 [0,0,1,0,0,1|0,0,0]=2 852 B18R2.2459307 CC(O)CO[C@@H](C)c1cccc2c1cccc2 34a_100011852130_100011218427 [0,0,1,0,0,1|1,0,0]=3 853 B18R2.2459307 CC(O)CO[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100011218427 [0,0,1,0,0,1|1,0,0]=3 854 B18R2.2459307 C[C@H](NCC(F)F)c1cccc2c1cccc2 2230a_100011830313_100011934356 [0,0,1,0,0,1|2,0,0]=4 855 B18R2.2459307 C[C@H](NC[C@@H](C)O)c1cccc2c1cccc2 2230a_100011830313_100009817552 [0,0,1,0,0,1|0,0,0]=2 856 B18R2.2459307 C[C@H](OC[C@@H](C)O)c1cccc2c1cccc2 34a_100011852130_100009817552 [0,0,1,0,0,1|1,0,0]=3 857 B18R2.2459307 C[C@H](OC[C@@H](C)O)c1cccc2c1cccc2 7a_100011852130_100009817552 [0,0,1,0,0,1|1,0,0]=3 858 B18R2.2880857 CC(C)CC(C)Nc1cccc2c1cccc2 34a_100000185869_100000731052 [0,0,1,0,0,1|2,0,0]=4 859 B18R2.2880857 CC(C)CC(C)Oc1cccc2c1cccc2 34a_100000210388_100000731052 [0,0,1,0,0,1|2,0,0]=4 860 B18R2.2880857 CC(C)CC(C)Oc1cccc2c1cccc2 7a_100000210388_100000731052 [0,0,1,0,0,1|2,0,0]=4 861 B18R2.2880857 CC(C)CC(C)Sc1cccc2c1cccc2 62a_100000731052_100000210605 [0,0,1,0,0,1|2,0,0]=4 862 B18R2.2880857 CC(O)CN(C)Cc1cccc2c1cccc2 2230a_100000227577_100011261445 [0,0,1,0,0,1|2,0,0]=4 863 B18R2.2880857 CC(O)CN(C)Cc1cccc2c1cccc2 2230a_100000741213_100011218427 [0,0,1,0,0,1|2,0,0]=4 864 B18R2.2880857 CC(O)CN(C)Cc1cccc2c1cccc2 269982a_100000227577_100000188474 [0,0,1,0,0,1|2,0,0]=4 865 B18R2.2880857 CC(O)CN(C)Cc1cccc2c1cccc2 269982a_100000741213_100011218427 [0,0,1,0,0,1|2,0,0]=4 866 B18R2.2880857 CC(O)CN(C)Cc1cccc2c1cccc2 270004a_100000227577_100000210074 [0,0,1,0,0,1|2,0,0]=4 867 B18R2.2880857 C[C@@H](O)CN(C)Cc1cccc2c1cccc2 2230a_100000741213_100009817552 [0,0,1,0,0,1|2,0,0]=4 868 B18R2.2880857 C[C@@H](O)CN(C)Cc1cccc2c1cccc2 269982a_100000741213_100009817552 [0,0,1,0,0,1|2,0,0]=4