0 B18R3.28 CNc1ccc2c(c1)ccc3c2cccc3 34a_200009881857_200000210301 [1,0,0,0,0,0|3,0,0]=4 1 B18R3.28 CNc1ccc2c(c1)ccc3c2cccc3 7a_200009881857_200000210301 [1,0,0,0,0,0|3,0,0]=4 2 B18R3.28 CNc1cnc2c(c1)ccc3c2nccc3 27a_100102657272_100010188720 [1,0,0,0,0,0|3,0,0]=4 3 B18R3.28 CSc1ccc2c(c1)ccc3c2cccc3 62a_200000210301_100010174298 [1,0,0,0,0,0|2,0,0]=3 4 B18R3.28 CSc1cnc2c(c1)ccc3c2nccc3 62a_200000210301_100010188720 [1,0,0,0,0,0|2,0,0]=3 5 B18R3.28 [13CH3]Nc1ccc2c(c1)ccc3c2cccc3 34a_200009881857_200025704644 [1,0,0,0,0,0|3,0,0]=4 6 B18R3.28 [13CH3]Nc1ccc2c(c1)ccc3c2cccc3 7a_200009881857_200025704644 [1,0,0,0,0,0|3,0,0]=4 7 B18R3.28 [13CH3]Sc1ccc2c(c1)ccc3c2cccc3 62a_200025704644_100010174298 [1,0,0,0,0,0|2,0,0]=3 8 B18R3.28 [13CH3]Sc1cnc2c(c1)ccc3c2nccc3 62a_200025704644_100010188720 [1,0,0,0,0,0|2,0,0]=3 9 B18R2.1465 CCc1cccc(c1O)C=Cc2ccccc2 271570a_100102527694_200010001580 [0,0,1,0,0,0|3,0,0]=4 10 B18R2.1465 CCc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_200010001580 [0,0,1,0,0,0|2,0,0]=3 11 B18R2.1465 CNc1cccc(c1N)C=Cc2cccnc2 271570a_100102525586_100000695761 [0,0,1,0,0,0|3,0,0]=4 12 B18R2.1465 COc1cccc(c1C)C=Cc2cccnc2 271570a_100102525586_100010002647 [0,0,1,0,0,0|2,1,0]=4 13 B18R2.1465 COc1cccc(c1Cl)C=Cc2cccnc2 271570a_100102525586_100010147677 [0,0,1,0,0,0|2,1,0]=4 14 B18R2.1465 COc1cccc(c1F)C=Cc2cccnc2 271570a_100102525586_100010185846 [0,0,1,0,0,0|2,1,0]=4 15 B18R2.1465 COc1cccc(c1N)C=Cc2cccnc2 271570a_100102525586_100000708083 [0,0,1,0,0,0|2,1,0]=4 16 B18R2.1465 COc1cccc(c1O)C=Cc2ccccc2 271570a_100102527694_100000686866 [0,0,1,0,0,0|2,1,0]=4 17 B18R2.1465 COc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100000686866 [0,0,1,0,0,0|1,1,0]=3 18 B18R2.1465 COc1cncc(c1C)C=Cc2ccccc2 271570a_100102527694_100010136163 [0,0,1,0,0,0|2,1,0]=4 19 B18R2.1465 COc1cncc(c1C)C=Cc2cccnc2 271570a_100102525586_100010136163 [0,0,1,0,0,0|1,1,0]=3 20 B18R2.1465 CSc1ccnc(c1F)C=Cc2cccnc2 271570a_100102525586_200021123860 [0,0,1,0,0,0|3,0,0]=4 21 B18R2.1465 Cc1c(cncc1C=Cc2cccnc2)C#N 271570a_100102525586_100009818027 [0,0,1,0,0,0|3,0,0]=4 22 B18R2.1465 Cc1c(cncc1C=Cc2cccnc2)C=O 271570a_100102525586_100010214934 [0,0,1,0,0,0|3,0,0]=4 23 B18R2.1465 N#Cc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100009817103 [0,0,1,0,0,0|3,0,0]=4 24 B18R2.1465 Nc1c(cncc1CO)C=Cc2cccnc2 271570a_100102525586_200010988789 [0,0,1,0,0,0|3,0,0]=4 25 B18R2.1465 O=Cc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100000737635 [0,0,1,0,0,0|3,0,0]=4 26 B18R2.12463 C=Cc1ccccc1c2cc(c(cn2)NC)N 271570a_100000037480_200015721873 [0,0,1,0,0,0|3,0,0]=4 27 B18R2.12463 C=Cc1ccccc1c2cc(c(cn2)OC)N 271570a_100000037480_100010896307 [0,0,1,0,0,0|2,1,0]=4 28 B18R2.12463 C=Cc1ccccc1c2cc(c(cn2)OC)O 271570a_100000037480_100010264082 [0,0,1,0,0,0|1,1,0]=3 29 B18R2.12463 C=Cc1ccccc1c2ccc(c(c2)Cl)SC 271570a_100000037480_206447510565 [0,0,1,0,0,0|3,0,0]=4 30 B18R2.12463 C=Cc1ccccc1c2ccc(c(c2)F)SC 271570a_100000037480_100010161220 [0,0,1,0,0,0|3,0,0]=4 31 B18R2.12463 C=Cc1ccccc1c2ccc(c(c2)O)OC 271570a_100000037480_100009816560 [0,0,1,0,0,0|2,1,0]=4 32 B18R2.12463 COc1ccc(cc1O)c2ccncc2C=O 271570a_100010199686_100000050567 [0,0,1,0,0,0|2,1,0]=4 33 B18R2.12463 COc1cnc(cc1O)c2ccccc2C=O 271570a_100000740022_100010264082 [0,0,1,0,0,0|2,1,0]=4 34 B18R2.12463 COc1cnc(cc1O)c2ccncc2C#N 271570a_200000062430_100010264082 [0,0,1,0,0,0|1,1,1]=4 35 B18R2.12463 COc1cnc(cc1O)c2ccncc2OC 271570a_100000084644_100010264082 [0,0,1,0,0,0|1,1,1]=4 36 B18R2.12463 CSc1ccc(cc1C)c2ccncc2C=O 271570a_100011102548_100000050567 [0,0,1,0,0,0|3,0,0]=4 37 B18R2.12463 CSc1ccc(cc1Cl)c2ccncc2C=O 271570a_100010713117_100000050567 [0,0,1,0,0,0|3,0,0]=4 38 B18R2.12463 CSc1ccc(cc1F)c2ccncc2C=O 271570a_200000118069_100000050567 [0,0,1,0,0,0|3,0,0]=4 39 B18R2.121083 COc1ccc(c(c1O)C=O)c2ccncc2 271570a_100000752145_100009813834 [0,0,1,0,0,0|2,1,0]=4 40 B17R2.1819 CCc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000684523 [1,0,1,0,0,0|2,0,0]=4 41 B17R2.1819 CCc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_200009819073 [1,0,1,0,0,0|2,0,0]=4 42 B17R2.1819 CCc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_200009819073 [1,0,1,0,0,0|1,0,0]=3 43 B17R2.1819 CNc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000219648 [1,0,1,0,0,0|2,0,0]=4 44 B17R2.1819 CNc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100012184536 [1,0,1,0,0,0|2,0,0]=4 45 B17R2.1819 CNc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100012184536 [1,0,1,0,0,0|1,0,0]=3 46 B17R2.1819 CNc1cncc(n1)C=Cc2cccnc2 271570a_100102525586_100011529438 [1,0,1,0,0,0|2,0,0]=4 47 B17R2.1819 COc1cccc(c1)C=Cc2cccnc2 271570a_100010186523_100000752921 [1,0,1,0,0,0|1,1,0]=4 48 B17R2.1819 COc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000170001 [1,0,1,0,0,0|1,1,0]=4 49 B17R2.1819 COc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000684773 [1,0,1,0,0,0|1,1,0]=4 50 B17R2.1819 COc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100000684773 [1,0,1,0,0,0|0,1,0]=3 51 B17R2.1819 COc1cncc(n1)C=Cc2cccnc2 271570a_100102525586_100000756030 [1,0,1,0,0,0|1,1,0]=4 52 B17R2.1819 COc1cnnc(c1)C=Cc2cccnc2 271570a_100102525586_100000087634 [1,0,1,0,0,0|1,1,0]=4 53 B17R2.1819 CSc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100011215954 [1,0,1,0,0,0|2,0,0]=4 54 B17R2.1819 CSc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100011215954 [1,0,1,0,0,0|1,0,0]=3 55 B17R2.1819 CSc1cccc(n1)C=Cc2cccnc2 271570a_100102525586_100011960944 [1,0,1,0,0,0|2,0,0]=4 56 B17R2.1819 CSc1ccnc(c1)C=Cc2cccnc2 271570a_100102525586_100010883326 [1,0,1,0,0,0|2,0,0]=4 57 B17R2.1819 CSc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100009816972 [1,0,1,0,0,0|1,0,0]=3 58 B17R2.1819 CSc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100009816972 [1,0,1,0,0,0|0,0,0]=2 59 B17R2.1819 CSc1cncc(c1)SCc2cccnc2 62a_100000741622_100009816972 [1,0,1,0,0,0|1,0,1]=4 60 B17R2.1819 CSc1cncc(c1)SCc2cccnc2 62a_100009816972_100000741622 [1,0,1,0,0,0|1,0,1]=4 61 B17R2.1819 N#Cc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100000686085 [1,0,1,0,0,0|2,0,0]=4 62 B17R2.1819 NCc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100011249555 [1,0,1,0,0,0|2,0,0]=4 63 B17R2.1819 NNc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100000727789 [1,0,1,0,0,0|2,0,0]=4 64 B17R2.1819 O=Cc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100000687066 [1,0,1,0,0,0|2,0,0]=4 65 B17R2.1819 OCc1cncc(c1)C=Cc2cccnc2 271570a_100102525586_100011259137 [1,0,1,0,0,0|2,0,0]=4 66 B17R2.5274 Cc1c(cncc1C=Cc2cccnc2)Br 271570a_100102525586_100010109657 [1,0,1,0,0,0|2,0,0]=4 67 B17R2.5274 Cc1c(cncc1C=Cc2cccnc2)F 271570a_100102525586_100009881546 [1,0,1,0,0,0|2,0,0]=4 68 B17R2.5274 Cc1c(cncc1C=Cc2cccnc2)N 271570a_100102525586_100011998293 [1,0,1,0,0,0|2,0,0]=4 69 B17R2.5274 Cc1cccc(c1C)C=Cc2cccnc2 271570a_100102525586_100011214922 [1,0,1,0,0,0|2,0,0]=4 70 B17R2.5274 Cc1cccc(c1Cl)C=Cc2cccnc2 271570a_100102525586_200012352035 [1,0,1,0,0,0|2,0,0]=4 71 B17R2.5274 Cc1cccc(c1F)C=Cc2cccnc2 271570a_100102525586_100000717567 [1,0,1,0,0,0|2,0,0]=4 72 B17R2.5274 Cc1cccc(c1N)C=Cc2cccnc2 271570a_100102525586_100011834072 [1,0,1,0,0,0|2,0,0]=4 73 B17R2.5274 Cc1cccc(c1O)C=Cc2ccccc2 271570a_100102527694_100009817157 [1,0,1,0,0,0|2,0,0]=4 74 B17R2.5274 Cc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100009817157 [1,0,1,0,0,0|1,0,0]=3 75 B17R2.5274 Cc1ccnc(c1O)C=Cc2cccnc2 271570a_100102525586_100000696282 [1,0,1,0,0,0|2,0,0]=4 76 B17R2.5274 Cc1cncc(c1C)C=Cc2ccccc2 271570a_100102527694_100009864703 [1,0,1,0,0,0|2,0,0]=4 77 B17R2.5274 Cc1cncc(c1C)C=Cc2cccnc2 271570a_100102525586_100009864703 [1,0,1,0,0,0|1,0,0]=3 78 B17R2.5274 Cc1cncc(c1N)C=Cc2ccccc2 271570a_100102527694_100009818025 [1,0,1,0,0,0|2,0,0]=4 79 B17R2.5274 Cc1cncc(c1N)C=Cc2cccnc2 271570a_100102525586_100009818025 [1,0,1,0,0,0|1,0,0]=3 80 B17R2.5274 Nc1c(cncc1C=Cc2cccnc2)Br 271570a_100102525586_100011290786 [1,0,1,0,0,0|2,0,0]=4 81 B17R2.5274 Nc1c(cncc1C=Cc2cccnc2)Cl 271570a_100102525586_100000684942 [1,0,1,0,0,0|2,0,0]=4 82 B17R2.5274 Nc1c(cncc1C=Cc2cccnc2)F 271570a_100102525586_100009880649 [1,0,1,0,0,0|2,0,0]=4 83 B17R2.5274 Nc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100011934915 [1,0,1,0,0,0|2,0,0]=4 84 B17R2.5274 Nc1cncc(c1N)C=Cc2cccnc2 271570a_100102525586_100000694774 [1,0,1,0,0,0|2,0,0]=4 85 B17R2.5274 Oc1c(cccc1C=Cc2cccnc2)Br 271570a_100102525586_100010084509 [1,0,1,0,0,0|2,0,0]=4 86 B17R2.5274 Oc1c(cccc1C=Cc2cccnc2)Cl 271570a_100102525586_100010202889 [1,0,1,0,0,0|2,0,0]=4 87 B17R2.5274 Oc1c(cccc1C=Cc2cccnc2)F 271570a_100102525586_100009813666 [1,0,1,0,0,0|2,0,0]=4 88 B17R2.5274 Oc1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100009815950 [1,0,1,0,0,0|1,1,0]=4 89 B17R2.62 C=Cc1ccccc1c2ccc(cc2)SC 271570a_100000037480_100011263217 [1,0,1,0,0,0|2,0,0]=4 90 B17R2.62 C=Cc1ccccc1c2ccc(cn2)CC 271570a_100000037480_100009843584 [1,0,1,0,0,0|2,0,0]=4 91 B17R2.62 C=Cc1ccccc1c2ccc(cn2)NC 271570a_100000037480_100000764248 [1,0,1,0,0,0|2,0,0]=4 92 B17R2.62 C=Cc1ccccc1c2ccc(cn2)OC 271570a_100000037480_100000755202 [1,0,1,0,0,0|1,1,0]=4 93 B17R2.62 C=Cc1ccccc1c2ccc(cn2)SC 271570a_100000037480_100009820866 [1,0,1,0,0,0|1,0,0]=3 94 B17R2.62 C=Cc1ccccc1c2cnc(cn2)SC 271570a_100000037480_200012356277 [1,0,1,0,0,0|2,0,0]=4 95 B17R2.62 C=Cc1ccccc1c2ncc(cn2)SC 271570a_100000037480_100000718988 [1,0,1,0,0,0|2,0,0]=4 96 B17R2.62 COc1cnccc1c2ccc(cn2)SC 271570a_100000084644_100009820866 [1,0,1,0,0,0|1,0,1]=4 97 B17R2.62 CSc1ccc(cc1)c2ccncc2C=O 271570a_100000703477_100000050567 [1,0,1,0,0,0|2,0,0]=4 98 B17R2.62 CSc1ccc(nc1)c2ccccc2C=O 271570a_100000740022_100009820866 [1,0,1,0,0,0|2,0,0]=4 99 B17R2.62 CSc1ccc(nc1)c2ccncc2C#N 271570a_200000062430_100009820866 [1,0,1,0,0,0|1,0,1]=4 100 B17R2.8840 C=Cc1ccccc1c2cc(c(cn2)C)C 271570a_100000037480_100009850809 [1,0,1,0,0,0|2,0,0]=4 101 B17R2.8840 C=Cc1ccccc1c2cc(c(cn2)C)F 271570a_100000037480_100009841206 [1,0,1,0,0,0|2,0,0]=4 102 B17R2.8840 C=Cc1ccccc1c2cc(c(cn2)C)N 271570a_100000037480_100000690170 [1,0,1,0,0,0|2,0,0]=4 103 B17R2.8840 C=Cc1ccccc1c2cc(c(cn2)C)O 271570a_100000037480_100000704368 [1,0,1,0,0,0|1,0,0]=3 104 B17R2.8840 C=Cc1ccccc1c2cc(c(cn2)F)O 271570a_100000037480_100009854642 [1,0,1,0,0,0|2,0,0]=4 105 B17R2.8840 C=Cc1ccccc1c2ccc(c(c2)O)C 271570a_100000037480_100000766334 [1,0,1,0,0,0|2,0,0]=4 106 B17R2.8840 COc1cnccc1c2cc(c(cn2)C)O 271570a_100000084644_100000704368 [1,0,1,0,0,0|1,0,1]=4 107 B17R2.8840 Cc1ccc(cc1O)c2ccncc2C=O 271570a_100000077161_100000050567 [1,0,1,0,0,0|2,0,0]=4 108 B17R2.8840 Cc1cnc(cc1O)c2ccccc2C=O 271570a_100000740022_100000704368 [1,0,1,0,0,0|2,0,0]=4 109 B17R2.8840 Cc1cnc(cc1O)c2ccncc2C#N 271570a_200000062430_100000704368 [1,0,1,0,0,0|1,0,1]=4 110 B17R2.9451 COc1cnc(cc1O)c2ccncc2C 271570a_100000701363_100010264082 [1,0,1,0,0,0|0,1,1]=4 111 B17R2.9451 COc1cnc(cc1O)c2ccncc2Cl 271570a_100000062318_100010264082 [1,0,1,0,0,0|1,1,0]=4 112 B17R2.9451 COc1cnc(cc1O)c2ccncc2F 271570a_100011290801_100010264082 [1,0,1,0,0,0|1,1,0]=4 113 B17R2.73270 CSc1cnc(c(c1)C)c2ccncc2C 271570a_100000701363_203440288091 [1,0,1,0,0,0|0,0,2]=4 114 B17R2.73270 CSc1cnc(c(c1)C)c2ccncc2Cl 271570a_100000062318_203440288091 [1,0,1,0,0,0|1,0,1]=4 115 B17R2.73270 CSc1cnc(c(c1)C)c2ccncc2F 271570a_100011290801_203440288091 [1,0,1,0,0,0|1,0,1]=4 116 B17R2.73270 CSc1cnc(c(c1)F)c2ccncc2C 271570a_100000701363_100010884644 [1,0,1,0,0,0|1,0,1]=4 117 B17R2.73270 CSc1cnc(c(c1)F)c2ccncc2Cl 271570a_100000062318_100010884644 [1,0,1,0,0,0|2,0,0]=4 118 B17R2.73270 CSc1cnc(c(c1)F)c2ccncc2F 271570a_100011290801_100010884644 [1,0,1,0,0,0|2,0,0]=4 119 B17R3.4465 Oc1ccnc2c1ccc3c2nccc3 271570a_203496583355_100010235877 [2,0,0,0,0,0|2,0,0]=4 120 B19R2.7796 COc1cc(cc(c1O)C=Cc2cccnc2)F 271570a_100102525586_200010391102 [0,1,1,0,0,0|1,1,0]=4 121 B19R2.35052 CSc1c(ccc(c1F)C=Cc2cccnc2)F 271570a_100102525586_202125771753 [0,1,1,0,0,0|2,0,0]=4 122 B19R2.49831 CC(=O)c1cccc(c1O)C=Cc2cccnc2 271570a_100102525586_100009815558 [0,1,1,0,0,0|2,0,0]=4 123 B19R2.172157 COc1c(cncc1C=Cc2cccnc2)C#N 271570a_100102525586_100016142170 [0,1,1,0,0,0|2,0,0]=4 124 B19R2.172157 COc1c(cncc1C=Cc2cccnc2)C=O 271570a_100102525586_100015834815 [0,1,1,0,0,0|2,0,0]=4 125 B19R2.172157 COc1cccc(c1OC)C=Cc2cccnc2 271570a_100102525586_100009815961 [0,1,1,0,0,0|1,1,0]=4 126 B19R2.6118 C=CCc1ccccc1c2cc(c(cn2)OC)O 271570a_200010742005_100010264082 [0,1,1,0,0,0|1,1,0]=4 127 B19R2.223225 C=Cc1ccccc1c2ccc(c(c2)OC)SC 271570a_100000037480_200011001119 [0,1,1,0,0,0|2,0,0]=4 128 B19R3.376 CCSc1ccc2c(c1)ccc3c2cccc3 62a_100000210202_100010174298 [1,1,0,0,0,0|2,0,0]=4 129 B19R3.376 CCSc1cnc2c(c1)ccc3c2nccc3 62a_100000210202_100010188720 [1,1,0,0,0,0|2,0,0]=4 130 B19R3.376 FCSc1ccc2c(c1)ccc3c2cccc3 62a_100015361967_100010174298 [1,1,0,0,0,0|2,0,0]=4 131 B19R3.376 FCSc1cnc2c(c1)ccc3c2nccc3 62a_100015361967_100010188720 [1,1,0,0,0,0|2,0,0]=4 132 B19R3.19245 C(=Cc1cccc2c1OCC2)c3cccnc3 271570a_100102525586_100009818991 [0,0,1,1,0,0|2,0,0]=4 133 B19R3.19245 C(=Cc1cccc2c1OCO2)c3cccnc3 271570a_100102525586_100009814252 [0,0,1,1,0,0|1,1,0]=4 134 B19R2.14499 C=Cc1ccccc1Sc2cc(c(cn2)OC)O 62a_100011218376_100010264082 [0,0,1,0,0,1|1,1,0]=4 135 B19R2.14499 COc1cnc(cc1O)Sc2ccncc2C=O 62a_100000050567_100010264082 [0,0,1,0,0,1|1,1,0]=4