0 B10R1.4 C=C=Cc1c[nH]ccc1=O 271570a_100015277604_100009998708 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.4 C=C=Cc1c[nH]ccc1=S 271570a_100015277604_200012280681 [0,0,0,0,0,0|1,1,2]=4 2 B10R1.4 C=C=Cc1ccc[nH]c1=O 271570a_100015277604_100000050042 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.4 C=C=Cc1cccc[n+]1C 271570a_100015277604_100000212160 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.4 C=C=Cc1cccc[n+]1[O-] 271570a_100015277604_200000042595 [0,0,0,0,0,0|1,0,3]=4 5 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [0,0,0,0,0,0|1,0,2]=3 6 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [0,0,0,0,0,0|1,0,2]=3 8 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [0,0,0,0,0,0|1,0,2]=3 9 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [0,0,0,0,0,0|1,0,2]=3 10 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [0,0,0,0,0,0|0,0,2]=2 11 B10R1.4 C=C=Cc1cccnc1Br 271570a_100015277604_100010202626 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.4 C=C=Cc1cccnc1C 271570a_100015277604_100000751574 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.4 C=C=Cc1cccnc1Cl 271570a_100015277604_100000036424 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.4 C=C=Cc1cccnc1F 271570a_100015277604_100009816115 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.4 C=C=Cc1cccnc1N 271570a_100015277604_100000045569 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.4 C=C=Cc1ccncc1Br 271570a_100015277604_100000726257 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.4 C=C=Cc1ccncc1C 271570a_100015277604_100015191297 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.4 C=C=Cc1ccncc1Cl 271570a_100015277604_100000708259 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.4 C=C=Cc1ccncc1F 271570a_100015277604_100000047030 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.4 C=C=Cc1ccncc1N 271570a_100015277604_100009815883 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [0,0,0,0,0,0|1,0,2]=3 22 B10R1.4 C=C=Cc1cnccc1Br 271570a_100015277604_100010138639 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.4 C=C=Cc1cnccc1C 271570a_100015277604_100000761580 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.4 C=C=Cc1cnccc1Cl 271570a_100015277604_100009995489 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.4 C=C=Cc1cnccc1F 271570a_100015277604_100009820683 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.4 C=C=Cc1cnccc1N 271570a_100015277604_100000047001 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.4 C=C=Cc1cncnc1O 271570a_100015277604_100000751107 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.4 C=C=Cc1ncccc1Br 271570a_100015277604_100000696092 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.4 C=C=Cc1ncccc1C 271570a_100015277604_100000751373 [0,0,0,0,0,0|2,0,2]=4 30 B10R1.4 C=C=Cc1ncccc1Cl 271570a_100015277604_100011356963 [0,0,0,0,0,0|2,0,2]=4 31 B10R1.4 C=C=Cc1ncccc1F 271570a_100015277604_100000685392 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.4 C=C=Cc1ncccc1N 271570a_100015277604_100000688686 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [0,0,0,0,0,0|1,0,2]=3 34 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [0,0,0,0,0,0|0,0,0]=0 35 B10R1.4 CC=Cc1c[nH]ccc1=O 271570a_100016259895_100009998708 [0,0,0,0,0,0|1,0,3]=4 36 B10R1.4 CC=Cc1c[nH]ccc1=S 271570a_100016259895_200012280681 [0,0,0,0,0,0|1,1,2]=4 37 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [0,0,0,0,0,0|1,0,3]=4 38 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.4 CC=Cc1cccc[n+]1[O-] 271570a_100016259895_200000042595 [0,0,0,0,0,0|1,0,3]=4 40 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [0,0,0,0,0,0|1,0,2]=3 41 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [0,0,0,0,0,0|1,0,2]=3 42 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [0,0,0,0,0,0|1,0,2]=3 43 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [0,0,0,0,0,0|1,0,2]=3 44 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [0,0,0,0,0,0|1,0,2]=3 45 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [0,0,0,0,0,0|0,0,2]=2 46 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [0,0,0,0,0,0|2,0,2]=4 47 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [0,0,0,0,0,0|2,0,2]=4 48 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [0,0,0,0,0,0|2,0,2]=4 49 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [0,0,0,0,0,0|2,0,2]=4 50 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [0,0,0,0,0,0|2,0,2]=4 51 B10R1.4 CC=Cc1ccncc1Br 271570a_100016259895_100000726257 [0,0,0,0,0,0|2,0,2]=4 52 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [0,0,0,0,0,0|2,0,2]=4 53 B10R1.4 CC=Cc1ccncc1Cl 271570a_100016259895_100000708259 [0,0,0,0,0,0|2,0,2]=4 54 B10R1.4 CC=Cc1ccncc1F 271570a_100016259895_100000047030 [0,0,0,0,0,0|2,0,2]=4 55 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [0,0,0,0,0,0|2,0,2]=4 56 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [0,0,0,0,0,0|1,0,2]=3 57 B10R1.4 CC=Cc1cnccc1Br 271570a_100016259895_100010138639 [0,0,0,0,0,0|2,0,2]=4 58 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [0,0,0,0,0,0|2,0,2]=4 59 B10R1.4 CC=Cc1cnccc1Cl 271570a_100016259895_100009995489 [0,0,0,0,0,0|2,0,2]=4 60 B10R1.4 CC=Cc1cnccc1F 271570a_100016259895_100009820683 [0,0,0,0,0,0|2,0,2]=4 61 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [0,0,0,0,0,0|2,0,2]=4 62 B10R1.4 CC=Cc1cncnc1O 271570a_100016259895_100000751107 [0,0,0,0,0,0|2,0,2]=4 63 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [0,0,0,0,0,0|2,0,2]=4 64 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [0,0,0,0,0,0|2,0,2]=4 65 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [0,0,0,0,0,0|2,0,2]=4 66 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [0,0,0,0,0,0|2,0,2]=4 67 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [0,0,0,0,0,0|1,0,2]=3 69 B10R1.4 CCCc1ncncc1O 271570a_203496583355_100009816987 [0,0,0,0,0,0|2,0,2]=4 70 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [0,0,0,0,0,0|2,0,2]=4 71 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [0,0,0,0,0,0|2,0,2]=4 72 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [0,0,0,0,0,0|2,0,2]=4 73 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [0,0,0,0,0,0|2,0,2]=4 74 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [0,0,0,0,0,0|2,0,2]=4 75 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [0,0,0,0,0,0|1,0,2]=3 76 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [0,0,0,0,0,0|1,0,2]=3 77 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [0,0,0,0,0,0|2,0,2]=4 78 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [0,0,0,0,0,0|2,0,2]=4 79 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [0,0,0,0,0,0|2,0,2]=4 80 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [0,0,0,0,0,0|2,0,2]=4 81 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [0,0,0,0,0,0|2,0,2]=4 82 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [0,0,0,0,0,0|2,0,2]=4 83 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [0,0,0,0,0,0|2,0,2]=4 84 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [0,0,0,0,0,0|2,0,2]=4 85 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [0,0,0,0,0,0|2,0,2]=4 86 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [0,0,0,0,0,0|2,0,2]=4 87 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [0,0,0,0,0,0|2,0,2]=4 88 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [0,0,0,0,0,0|2,0,2]=4 89 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [0,0,0,0,0,0|1,0,2]=3 90 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [0,0,0,0,0,0|2,0,2]=4 91 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [0,0,0,0,0,0|2,0,2]=4 92 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [0,0,0,0,0,0|2,0,2]=4 93 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [0,0,0,0,0,0|2,0,2]=4 94 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [0,0,0,0,0,0|2,0,2]=4 95 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [0,0,0,0,0,0|2,0,2]=4 96 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [0,0,0,0,0,0|2,0,2]=4 97 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [0,0,0,0,0,0|2,0,2]=4 98 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [0,0,0,0,0,0|2,0,2]=4 99 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [0,0,0,0,0,0|2,0,2]=4 100 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [0,0,0,0,0,0|2,0,2]=4 101 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [0,0,0,0,0,0|2,0,2]=4 102 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [0,0,0,0,0,0|1,0,2]=3 103 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [0,0,0,0,0,0|1,0,2]=3 104 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [0,0,0,0,0,0|1,0,2]=3 105 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [0,0,0,0,0,0|2,0,2]=4 106 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [0,0,0,0,0,0|2,0,2]=4 107 B10R1.4 CCSc1ccncc1O 62a_100000210202_100009817591 [0,0,0,0,0,0|2,0,2]=4 108 B10R1.4 CCSc1ccncc1O 62a_100009817591_100000210202 [0,0,0,0,0,0|2,0,2]=4 109 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [0,0,0,0,0,0|2,0,2]=4 110 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [0,0,0,0,0,0|2,0,2]=4 111 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [0,0,0,0,0,0|2,0,1]=3 112 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [0,0,0,0,0,0|2,0,1]=3 113 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [0,0,0,0,0,0|2,0,1]=3 114 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [0,0,0,0,0,0|2,0,1]=3 115 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [0,0,0,0,0,0|2,0,1]=3 116 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [0,0,0,0,0,0|2,0,1]=3 117 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [0,0,0,0,0,0|2,0,1]=3 118 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [0,0,0,0,0,0|2,0,1]=3 119 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [0,0,0,0,0,0|2,0,1]=3 120 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [0,0,0,0,0,0|2,0,1]=3 121 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [0,0,0,0,0,0|2,0,1]=3 122 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [0,0,0,0,0,0|2,0,1]=3 123 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [0,0,0,0,0,0|2,0,1]=3 124 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [0,0,0,0,0,0|2,0,1]=3 125 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [0,0,0,0,0,0|2,0,1]=3 126 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [0,0,0,0,0,0|2,0,1]=3 127 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [0,0,0,0,0,0|2,0,1]=3 128 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [0,0,0,0,0,0|2,0,1]=3 129 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [0,0,0,0,0,0|2,0,1]=3 130 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [0,0,0,0,0,0|2,0,1]=3 131 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [0,0,0,0,0,0|2,0,1]=3 132 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [0,0,0,0,0,0|2,0,1]=3 133 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [0,0,0,0,0,0|2,0,1]=3 134 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [0,0,0,0,0,0|2,0,1]=3 135 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [0,0,0,0,0,0|2,0,1]=3 137 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [0,0,0,0,0,0|2,0,1]=3 138 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [0,0,0,0,0,0|2,0,1]=3 139 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [0,0,0,0,0,0|2,0,1]=3 140 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [0,0,0,0,0,0|2,0,1]=3 141 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [0,0,0,0,0,0|2,0,1]=3 142 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [0,0,0,0,0,0|2,0,1]=3 143 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [0,0,0,0,0,0|2,0,1]=3 144 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [0,0,0,0,0,0|1,0,1]=2 145 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [0,0,0,0,0,0|1,0,1]=2 146 B10R1.4 CNCc1cccnc1Br 2230a_100009818023_200000210301 [0,0,0,0,0,0|3,0,1]=4 147 B10R1.4 CNCc1cccnc1Br 2230a_106832991635_100010140945 [0,0,0,0,0,0|3,0,1]=4 148 B10R1.4 CNCc1cccnc1Br 34a_100009818023_200000210301 [0,0,0,0,0,0|3,0,1]=4 149 B10R1.4 CNCc1cccnc1Br 34a_100102657272_100010140945 [0,0,0,0,0,0|3,0,1]=4 150 B10R1.4 CNCc1cccnc1Br 7a_106832991635_100010140945 [0,0,0,0,0,0|3,0,1]=4 151 B10R1.4 CNCc1cccnc1C 207a_100102657272_100000751968 [0,0,0,0,0,0|3,0,1]=4 152 B10R1.4 CNCc1cccnc1C 2230a_106832991635_100000732876 [0,0,0,0,0,0|3,0,1]=4 153 B10R1.4 CNCc1cccnc1C 270004a_106832991635_100000751968 [0,0,0,0,0,0|3,0,1]=4 154 B10R1.4 CNCc1cccnc1C 34a_100102657272_100000732876 [0,0,0,0,0,0|3,0,1]=4 155 B10R1.4 CNCc1cccnc1C 7a_106832991635_100000732876 [0,0,0,0,0,0|3,0,1]=4 156 B10R1.4 CNCc1cccnc1Cl 2230a_100015189234_200000210301 [0,0,0,0,0,0|3,0,1]=4 157 B10R1.4 CNCc1cccnc1Cl 2230a_106832991635_100000045678 [0,0,0,0,0,0|3,0,1]=4 158 B10R1.4 CNCc1cccnc1Cl 34a_100015189234_200000210301 [0,0,0,0,0,0|3,0,1]=4 159 B10R1.4 CNCc1cccnc1Cl 34a_100102657272_100000045678 [0,0,0,0,0,0|3,0,1]=4 160 B10R1.4 CNCc1cccnc1Cl 7a_106832991635_100000045678 [0,0,0,0,0,0|3,0,1]=4 161 B10R1.4 CNCc1cccnc1F 2230a_106832991635_100000099810 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.4 CNCc1cccnc1F 34a_100000724633_200000210301 [0,0,0,0,0,0|3,0,1]=4 163 B10R1.4 CNCc1cccnc1F 34a_100102657272_100000099810 [0,0,0,0,0,0|3,0,1]=4 164 B10R1.4 CNCc1cccnc1F 7a_106832991635_100000099810 [0,0,0,0,0,0|3,0,1]=4 165 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [0,0,0,0,0,0|2,0,1]=3 166 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [0,0,0,0,0,0|2,0,1]=3 167 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [0,0,0,0,0,0|2,0,1]=3 168 B10R1.4 CNCc1ccncc1Br 270004a_106832991635_100000755692 [0,0,0,0,0,0|3,0,1]=4 169 B10R1.4 CNCc1ccncc1C 2230a_106832991635_100020672808 [0,0,0,0,0,0|3,0,1]=4 170 B10R1.4 CNCc1ccncc1C 34a_100102657272_100020672809 [0,0,0,0,0,0|3,0,1]=4 171 B10R1.4 CNCc1ccncc1C 7a_106832991635_100020672808 [0,0,0,0,0,0|3,0,1]=4 172 B10R1.4 CNCc1ccncc1Cl 207a_100102657272_100011934409 [0,0,0,0,0,0|3,0,1]=4 173 B10R1.4 CNCc1ccncc1Cl 2230a_106832991635_100000763264 [0,0,0,0,0,0|3,0,1]=4 174 B10R1.4 CNCc1ccncc1Cl 270004a_106832991635_100011934409 [0,0,0,0,0,0|3,0,1]=4 175 B10R1.4 CNCc1ccncc1Cl 7a_106832991635_100000763264 [0,0,0,0,0,0|3,0,1]=4 176 B10R1.4 CNCc1ccncc1F 34a_100011935246_200000210301 [0,0,0,0,0,0|3,0,1]=4 177 B10R1.4 CNCc1cnccc1Br 270004a_106832991635_100009816821 [0,0,0,0,0,0|3,0,1]=4 178 B10R1.4 CNCc1cnccc1C 207a_100102657272_100000685662 [0,0,0,0,0,0|3,0,1]=4 179 B10R1.4 CNCc1cnccc1C 2230a_106832991635_100000690890 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.4 CNCc1cnccc1C 270004a_106832991635_100000685662 [0,0,0,0,0,0|3,0,1]=4 181 B10R1.4 CNCc1cnccc1C 34a_100102657272_100000690890 [0,0,0,0,0,0|3,0,1]=4 182 B10R1.4 CNCc1cnccc1C 7a_106832991635_100000690890 [0,0,0,0,0,0|3,0,1]=4 183 B10R1.4 CNCc1cnccc1Cl 270004a_106832991635_100000050567 [0,0,0,0,0,0|3,0,1]=4 184 B10R1.4 CNCc1ncccc1Br 207a_100102657272_100011934733 [0,0,0,0,0,0|3,0,1]=4 185 B10R1.4 CNCc1ncccc1Br 2230a_106832991635_100025702911 [0,0,0,0,0,0|3,0,1]=4 186 B10R1.4 CNCc1ncccc1Br 270004a_106832991635_100011934733 [0,0,0,0,0,0|3,0,1]=4 187 B10R1.4 CNCc1ncccc1Br 34a_100102657272_100025702911 [0,0,0,0,0,0|3,0,1]=4 188 B10R1.4 CNCc1ncccc1Br 7a_106832991635_100025702911 [0,0,0,0,0,0|3,0,1]=4 189 B10R1.4 CNCc1ncccc1C 207a_100102657272_100000698913 [0,0,0,0,0,0|3,0,1]=4 190 B10R1.4 CNCc1ncccc1C 2230a_106832991635_100000696600 [0,0,0,0,0,0|3,0,1]=4 191 B10R1.4 CNCc1ncccc1C 270004a_106832991635_100000698913 [0,0,0,0,0,0|3,0,1]=4 192 B10R1.4 CNCc1ncccc1C 34a_100011223789_200000210301 [0,0,0,0,0,0|3,0,1]=4 193 B10R1.4 CNCc1ncccc1C 34a_100102657272_100000696600 [0,0,0,0,0,0|3,0,1]=4 194 B10R1.4 CNCc1ncccc1C 7a_106832991635_100000696600 [0,0,0,0,0,0|3,0,1]=4 195 B10R1.4 CNCc1ncccc1Cl 207a_100102657272_100012001307 [0,0,0,0,0,0|3,0,1]=4 196 B10R1.4 CNCc1ncccc1Cl 2230a_100015189233_200000210301 [0,0,0,0,0,0|3,0,1]=4 197 B10R1.4 CNCc1ncccc1Cl 2230a_106832991635_100000099807 [0,0,0,0,0,0|3,0,1]=4 198 B10R1.4 CNCc1ncccc1Cl 270004a_106832991635_100012001307 [0,0,0,0,0,0|3,0,1]=4 199 B10R1.4 CNCc1ncccc1Cl 7a_106832991635_100000099807 [0,0,0,0,0,0|3,0,1]=4 200 B10R1.4 CNCc1ncccc1F 207a_100102657272_100011934734 [0,0,0,0,0,0|3,0,1]=4 201 B10R1.4 CNCc1ncccc1F 2230a_106832991635_100000104219 [0,0,0,0,0,0|3,0,1]=4 202 B10R1.4 CNCc1ncccc1F 270004a_106832991635_100011934734 [0,0,0,0,0,0|3,0,1]=4 203 B10R1.4 CNCc1ncccc1F 34a_100000690088_200000210301 [0,0,0,0,0,0|3,0,1]=4 204 B10R1.4 CNCc1ncccc1F 34a_100102657272_100000104219 [0,0,0,0,0,0|3,0,1]=4 205 B10R1.4 CNCc1ncccc1F 7a_106832991635_100000104219 [0,0,0,0,0,0|3,0,1]=4 206 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [0,0,0,0,0,0|2,0,1]=3 207 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [0,0,0,0,0,0|2,0,1]=3 208 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [0,0,0,0,0,0|2,0,1]=3 209 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [0,0,0,0,0,0|2,0,1]=3 210 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [0,0,0,0,0,0|2,0,1]=3 211 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [0,0,0,0,0,0|2,0,1]=3 212 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [0,0,0,0,0,0|2,0,1]=3 213 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [0,0,0,0,0,0|2,0,1]=3 214 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [0,0,0,0,0,0|2,0,1]=3 215 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [0,0,0,0,0,0|2,0,1]=3 216 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [0,0,0,0,0,0|2,0,1]=3 217 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [0,0,0,0,0,0|2,0,1]=3 218 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [0,0,0,0,0,0|2,0,1]=3 219 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [0,0,0,0,0,0|2,0,1]=3 220 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [0,0,0,0,0,0|2,0,1]=3 221 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [0,0,0,0,0,0|2,0,1]=3 222 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [0,0,0,0,0,0|2,0,1]=3 223 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [0,0,0,0,0,0|2,0,1]=3 224 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [0,0,0,0,0,0|1,0,1]=2 225 B10R1.4 COCc1cccnc1Br 34a_100000719692_200000210301 [0,0,0,0,0,0|3,0,1]=4 226 B10R1.4 COCc1cccnc1Br 34a_100138415774_100010140945 [0,0,0,0,0,0|3,0,1]=4 227 B10R1.4 COCc1cccnc1Br 7a_100000719692_200000210301 [0,0,0,0,0,0|3,0,1]=4 228 B10R1.4 COCc1cccnc1C 34a_100000729262_200000210301 [0,0,0,0,0,0|3,0,1]=4 229 B10R1.4 COCc1cccnc1C 34a_100138415774_100000732876 [0,0,0,0,0,0|3,0,1]=4 230 B10R1.4 COCc1cccnc1C 7a_100000729262_200000210301 [0,0,0,0,0,0|3,0,1]=4 231 B10R1.4 COCc1cccnc1Cl 34a_100000748726_200000210301 [0,0,0,0,0,0|3,0,1]=4 232 B10R1.4 COCc1cccnc1Cl 34a_100138415774_100000045678 [0,0,0,0,0,0|3,0,1]=4 233 B10R1.4 COCc1cccnc1Cl 7a_100000748726_200000210301 [0,0,0,0,0,0|3,0,1]=4 234 B10R1.4 COCc1cccnc1F 34a_100000079888_200000210301 [0,0,0,0,0,0|3,0,1]=4 235 B10R1.4 COCc1cccnc1F 34a_100138415774_100000099810 [0,0,0,0,0,0|3,0,1]=4 236 B10R1.4 COCc1cccnc1F 7a_100000079888_200000210301 [0,0,0,0,0,0|3,0,1]=4 237 B10R1.4 COCc1ccncc1C 34a_100011997032_200000210301 [0,0,0,0,0,0|3,0,1]=4 238 B10R1.4 COCc1ccncc1C 34a_100138415774_100020672809 [0,0,0,0,0,0|3,0,1]=4 239 B10R1.4 COCc1ccncc1F 34a_100012172863_200000210301 [0,0,0,0,0,0|3,0,1]=4 240 B10R1.4 COCc1cnccc1C 34a_100011996381_200000210301 [0,0,0,0,0,0|3,0,1]=4 241 B10R1.4 COCc1cnccc1C 34a_100138415774_100000690890 [0,0,0,0,0,0|3,0,1]=4 242 B10R1.4 COCc1cnccc1Cl 34a_100000117392_200000210301 [0,0,0,0,0,0|3,0,1]=4 243 B10R1.4 COCc1ncccc1Br 34a_100011996772_200000210301 [0,0,0,0,0,0|3,0,1]=4 244 B10R1.4 COCc1ncccc1Br 34a_100138415774_100025702911 [0,0,0,0,0,0|3,0,1]=4 245 B10R1.4 COCc1ncccc1C 34a_100000698912_200000210301 [0,0,0,0,0,0|3,0,1]=4 246 B10R1.4 COCc1ncccc1C 34a_100138415774_100000696600 [0,0,0,0,0,0|3,0,1]=4 247 B10R1.4 COCc1ncccc1Cl 34a_100012002383_200000210301 [0,0,0,0,0,0|3,0,1]=4 248 B10R1.4 COCc1ncccc1F 34a_100011934865_200000210301 [0,0,0,0,0,0|3,0,1]=4 249 B10R1.4 COCc1ncccc1F 34a_100138415774_100000104219 [0,0,0,0,0,0|3,0,1]=4 250 B10R1.4 COCc1ncccc1N 34a_114873767017_200000210301 [0,0,0,0,0,0|3,0,1]=4 251 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [0,0,0,0,0,0|2,0,1]=3 252 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [0,0,0,0,0,0|2,0,1]=3 253 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [0,0,0,0,0,0|2,0,1]=3 254 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [0,0,0,0,0,0|2,0,1]=3 255 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [0,0,0,0,0,0|2,0,1]=3 256 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [0,0,0,0,0,0|2,0,1]=3 257 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [0,0,0,0,0,0|2,0,1]=3 258 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [0,0,0,0,0,0|2,0,1]=3 259 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [0,0,0,0,0,0|2,0,1]=3 260 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [0,0,0,0,0,0|2,0,1]=3 261 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [0,0,0,0,0,0|2,0,1]=3 262 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [0,0,0,0,0,0|1,0,1]=2 263 B10R1.4 CSCc1cccnc1Br 62a_100010140945_200000210301 [0,0,0,0,0,0|3,0,1]=4 264 B10R1.4 CSCc1cccnc1Br 62a_200000210301_100010140945 [0,0,0,0,0,0|3,0,1]=4 265 B10R1.4 CSCc1cccnc1C 62a_100000732876_200000210301 [0,0,0,0,0,0|3,0,1]=4 266 B10R1.4 CSCc1cccnc1C 62a_200000210301_100000732876 [0,0,0,0,0,0|3,0,1]=4 267 B10R1.4 CSCc1cccnc1Cl 62a_100000045678_200000210301 [0,0,0,0,0,0|3,0,1]=4 268 B10R1.4 CSCc1cccnc1Cl 62a_200000210301_100000045678 [0,0,0,0,0,0|3,0,1]=4 269 B10R1.4 CSCc1cccnc1F 62a_100000099810_200000210301 [0,0,0,0,0,0|3,0,1]=4 270 B10R1.4 CSCc1cccnc1F 62a_200000210301_100000099810 [0,0,0,0,0,0|3,0,1]=4 271 B10R1.4 CSCc1ccncc1C 62a_100020672808_200000210301 [0,0,0,0,0,0|3,0,1]=4 272 B10R1.4 CSCc1ccncc1C 62a_200000210301_100020672808 [0,0,0,0,0,0|3,0,1]=4 273 B10R1.4 CSCc1ccncc1Cl 62a_100000763264_200000210301 [0,0,0,0,0,0|3,0,1]=4 274 B10R1.4 CSCc1ccncc1Cl 62a_200000210301_100000763264 [0,0,0,0,0,0|3,0,1]=4 275 B10R1.4 CSCc1cnccc1C 62a_100000690890_200000210301 [0,0,0,0,0,0|3,0,1]=4 276 B10R1.4 CSCc1cnccc1C 62a_200000210301_100000690890 [0,0,0,0,0,0|3,0,1]=4 277 B10R1.4 CSCc1ncccc1Br 62a_100025702911_200000210301 [0,0,0,0,0,0|3,0,1]=4 278 B10R1.4 CSCc1ncccc1Br 62a_200000210301_100025702911 [0,0,0,0,0,0|3,0,1]=4 279 B10R1.4 CSCc1ncccc1C 62a_100000696600_200000210301 [0,0,0,0,0,0|3,0,1]=4 280 B10R1.4 CSCc1ncccc1C 62a_200000210301_100000696600 [0,0,0,0,0,0|3,0,1]=4 281 B10R1.4 CSCc1ncccc1Cl 62a_100000099807_200000210301 [0,0,0,0,0,0|3,0,1]=4 282 B10R1.4 CSCc1ncccc1Cl 62a_200000210301_100000099807 [0,0,0,0,0,0|3,0,1]=4 283 B10R1.4 CSCc1ncccc1F 62a_100000104219_200000210301 [0,0,0,0,0,0|3,0,1]=4 284 B10R1.4 CSCc1ncccc1F 62a_200000210301_100000104219 [0,0,0,0,0,0|3,0,1]=4 285 B10R1.4 CSCc1ncccc1O 62a_200000210301_200020655725 [0,0,0,0,0,0|2,0,1]=3 286 B10R1.4 CSCc1ncccc1O 62a_200020655725_200000210301 [0,0,0,0,0,0|2,0,1]=3 287 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [0,0,0,0,0,0|2,0,1]=3 288 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [0,0,0,0,0,0|2,0,1]=3 289 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [0,0,0,0,0,0|2,0,1]=3 290 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [0,0,0,0,0,0|2,0,1]=3 291 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [0,0,0,0,0,0|2,0,1]=3 292 B10R1.4 Cc1ccccc1NCF 34a_100015192222_100015361967 [0,0,0,0,0,0|3,0,1]=4 293 B10R1.4 Cc1ccccc1OCF 34a_100000210338_100015361967 [0,0,0,0,0,0|3,0,1]=4 294 B10R1.4 Cc1ccccc1OCF 7a_100000210338_100015361967 [0,0,0,0,0,0|3,0,1]=4 295 B10R1.4 Cc1ccccc1SCF 62a_100000210755_100015361967 [0,0,0,0,0,0|3,0,1]=4 296 B10R1.4 Cc1ccccc1SCF 62a_100015361967_100000210755 [0,0,0,0,0,0|3,0,1]=4 297 B10R1.4 Cc1cccnc1CN[13CH3] 34a_100011223789_200025704644 [0,0,0,0,0,0|3,0,1]=4 298 B10R1.4 Cc1cccnc1CO[13CH3] 34a_100000698912_200025704644 [0,0,0,0,0,0|3,0,1]=4 299 B10R1.4 Cc1cccnc1CS[13CH3] 62a_100000696600_200025704644 [0,0,0,0,0,0|3,0,1]=4 300 B10R1.4 Cc1cccnc1CS[13CH3] 62a_200025704644_100000696600 [0,0,0,0,0,0|3,0,1]=4 301 B10R1.4 Cc1ccncc1CO[13CH3] 34a_100011996381_200025704644 [0,0,0,0,0,0|3,0,1]=4 302 B10R1.4 Cc1ccncc1CS[13CH3] 62a_100000690890_200025704644 [0,0,0,0,0,0|3,0,1]=4 303 B10R1.4 Cc1ccncc1CS[13CH3] 62a_200025704644_100000690890 [0,0,0,0,0,0|3,0,1]=4 304 B10R1.4 Cc1cnccc1CO[13CH3] 34a_100011997032_200025704644 [0,0,0,0,0,0|3,0,1]=4 305 B10R1.4 Cc1cnccc1CS[13CH3] 62a_100020672808_200025704644 [0,0,0,0,0,0|3,0,1]=4 306 B10R1.4 Cc1cnccc1CS[13CH3] 62a_200025704644_100020672808 [0,0,0,0,0,0|3,0,1]=4 307 B10R1.4 Cc1ncccc1CO[13CH3] 34a_100000729262_200025704644 [0,0,0,0,0,0|3,0,1]=4 308 B10R1.4 Cc1ncccc1CO[13CH3] 7a_100000729262_200025704644 [0,0,0,0,0,0|3,0,1]=4 309 B10R1.4 Cc1ncccc1CS[13CH3] 62a_100000732876_200025704644 [0,0,0,0,0,0|3,0,1]=4 310 B10R1.4 Cc1ncccc1CS[13CH3] 62a_200025704644_100000732876 [0,0,0,0,0,0|3,0,1]=4 311 B10R1.4 FCNc1ccccc1Br 34a_100000210017_100015361967 [0,0,0,0,0,0|3,0,1]=4 312 B10R1.4 FCNc1ccccc1Cl 34a_100000185783_100015361967 [0,0,0,0,0,0|3,0,1]=4 313 B10R1.4 FCNc1ccccc1F 34a_100000210422_100015361967 [0,0,0,0,0,0|3,0,1]=4 314 B10R1.4 FCNc1ccccc1I 34a_100000210053_100015361967 [0,0,0,0,0,0|3,0,1]=4 315 B10R1.4 FCOc1ccccc1Br 34a_100000181306_100015361967 [0,0,0,0,0,0|3,0,1]=4 316 B10R1.4 FCOc1ccccc1Br 7a_100000181306_100015361967 [0,0,0,0,0,0|3,0,1]=4 317 B10R1.4 FCOc1ccccc1Cl 34a_100000210172_100015361967 [0,0,0,0,0,0|3,0,1]=4 318 B10R1.4 FCOc1ccccc1Cl 7a_100000210172_100015361967 [0,0,0,0,0,0|3,0,1]=4 319 B10R1.4 FCOc1ccccc1F 34a_100000210171_100015361967 [0,0,0,0,0,0|3,0,1]=4 320 B10R1.4 FCOc1ccccc1F 7a_100000210171_100015361967 [0,0,0,0,0,0|3,0,1]=4 321 B10R1.4 FCOc1ccccc1I 34a_100000739446_100015361967 [0,0,0,0,0,0|3,0,1]=4 322 B10R1.4 FCOc1ccccc1I 7a_100000739446_100015361967 [0,0,0,0,0,0|3,0,1]=4 323 B10R1.4 FCSc1ccccc1Br 62a_100000695589_100015361967 [0,0,0,0,0,0|3,0,1]=4 324 B10R1.4 FCSc1ccccc1Br 62a_100015361967_100000695589 [0,0,0,0,0,0|3,0,1]=4 325 B10R1.4 FCSc1ccccc1Cl 62a_100000764095_100015361967 [0,0,0,0,0,0|3,0,1]=4 326 B10R1.4 FCSc1ccccc1Cl 62a_100015361967_100000764095 [0,0,0,0,0,0|3,0,1]=4 327 B10R1.4 FCSc1ccccc1F 62a_100011215700_100015361967 [0,0,0,0,0,0|3,0,1]=4 328 B10R1.4 FCSc1ccccc1F 62a_100015361967_100011215700 [0,0,0,0,0,0|3,0,1]=4 329 B10R1.4 N#CCc1ccccc1O 271570a_203496583355_100000033512 [0,0,0,0,0,0|1,0,1]=2 330 B10R1.4 N#CCc1cccnc1O 271570a_203496583355_100000096391 [0,0,0,0,0,0|2,0,1]=3 331 B10R1.4 N#CCc1ncccc1O 271570a_203496583355_100011824415 [0,0,0,0,0,0|2,0,1]=3 332 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [0,0,0,0,0,0|1,0,1]=2 333 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [0,0,0,0,0,0|2,0,0]=2 334 B10R1.4 Nc1ccccc1OCF 34a_100000185747_100015361967 [0,0,0,0,0,0|3,0,1]=4 335 B10R1.4 Nc1ccccc1OCF 7a_100000185747_100015361967 [0,0,0,0,0,0|3,0,1]=4 336 B10R1.4 Nc1ccccc1SCF 62a_100000210017_100015361967 [0,0,0,0,0,0|3,0,1]=4 337 B10R1.4 Nc1ccccc1SCF 62a_100015361967_100000210017 [0,0,0,0,0,0|3,0,1]=4 338 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [0,0,0,0,0,0|1,0,1]=2 339 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [0,0,0,0,0,0|2,0,1]=3 340 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [0,0,0,0,0,0|2,0,1]=3 341 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [0,0,0,0,0,0|2,0,1]=3 342 B10R1.4 Oc1cccnc1SCF 62a_100000034122_100015361967 [0,0,0,0,0,0|3,0,1]=4 343 B10R1.4 Oc1cccnc1SCF 62a_100015361967_100000034122 [0,0,0,0,0,0|3,0,1]=4 344 B10R1.4 Oc1cnccc1SCF 62a_100009817591_100015361967 [0,0,0,0,0,0|3,0,1]=4 345 B10R1.4 Oc1cnccc1SCF 62a_100015361967_100009817591 [0,0,0,0,0,0|3,0,1]=4 346 B10R1.4 Oc1ncccc1SCF 62a_100000760158_100015361967 [0,0,0,0,0,0|3,0,1]=4 347 B10R1.4 Oc1ncccc1SCF 62a_100015361967_100000760158 [0,0,0,0,0,0|3,0,1]=4 348 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [0,0,0,0,0,0|2,0,1]=3 349 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [0,0,0,0,0,0|2,0,1]=3 350 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [0,0,0,0,0,0|2,0,1]=3 351 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [0,0,0,0,0,0|2,0,1]=3 352 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [0,0,0,0,0,0|2,0,1]=3 353 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [0,0,0,0,0,0|1,0,1]=2 354 B10R1.4 [13CH3]NCc1cccnc1Br 2230a_100009818023_200025704644 [0,0,0,0,0,0|3,0,1]=4 355 B10R1.4 [13CH3]NCc1cccnc1Br 34a_100009818023_200025704644 [0,0,0,0,0,0|3,0,1]=4 356 B10R1.4 [13CH3]NCc1cccnc1Cl 2230a_100015189234_200025704644 [0,0,0,0,0,0|3,0,1]=4 357 B10R1.4 [13CH3]NCc1cccnc1Cl 34a_100015189234_200025704644 [0,0,0,0,0,0|3,0,1]=4 358 B10R1.4 [13CH3]NCc1cccnc1F 34a_100000724633_200025704644 [0,0,0,0,0,0|3,0,1]=4 359 B10R1.4 [13CH3]NCc1ccncc1F 34a_100011935246_200025704644 [0,0,0,0,0,0|3,0,1]=4 360 B10R1.4 [13CH3]NCc1ncccc1Cl 2230a_100015189233_200025704644 [0,0,0,0,0,0|3,0,1]=4 361 B10R1.4 [13CH3]NCc1ncccc1F 34a_100000690088_200025704644 [0,0,0,0,0,0|3,0,1]=4 362 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [0,0,0,0,0,0|2,0,1]=3 363 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [0,0,0,0,0,0|2,0,1]=3 364 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [0,0,0,0,0,0|2,0,1]=3 365 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [0,0,0,0,0,0|2,0,1]=3 366 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [0,0,0,0,0,0|2,0,1]=3 367 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [0,0,0,0,0,0|2,0,1]=3 368 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [0,0,0,0,0,0|2,0,1]=3 369 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [0,0,0,0,0,0|2,0,1]=3 370 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [0,0,0,0,0,0|2,0,1]=3 371 B10R1.4 [13CH3]OCc1cccnc1Br 34a_100000719692_200025704644 [0,0,0,0,0,0|3,0,1]=4 372 B10R1.4 [13CH3]OCc1cccnc1Br 7a_100000719692_200025704644 [0,0,0,0,0,0|3,0,1]=4 373 B10R1.4 [13CH3]OCc1cccnc1Cl 34a_100000748726_200025704644 [0,0,0,0,0,0|3,0,1]=4 374 B10R1.4 [13CH3]OCc1cccnc1Cl 7a_100000748726_200025704644 [0,0,0,0,0,0|3,0,1]=4 375 B10R1.4 [13CH3]OCc1cccnc1F 34a_100000079888_200025704644 [0,0,0,0,0,0|3,0,1]=4 376 B10R1.4 [13CH3]OCc1cccnc1F 7a_100000079888_200025704644 [0,0,0,0,0,0|3,0,1]=4 377 B10R1.4 [13CH3]OCc1ccncc1F 34a_100012172863_200025704644 [0,0,0,0,0,0|3,0,1]=4 378 B10R1.4 [13CH3]OCc1cnccc1Cl 34a_100000117392_200025704644 [0,0,0,0,0,0|3,0,1]=4 379 B10R1.4 [13CH3]OCc1ncccc1Br 34a_100011996772_200025704644 [0,0,0,0,0,0|3,0,1]=4 380 B10R1.4 [13CH3]OCc1ncccc1Cl 34a_100012002383_200025704644 [0,0,0,0,0,0|3,0,1]=4 381 B10R1.4 [13CH3]OCc1ncccc1F 34a_100011934865_200025704644 [0,0,0,0,0,0|3,0,1]=4 382 B10R1.4 [13CH3]OCc1ncccc1N 34a_114873767017_200025704644 [0,0,0,0,0,0|3,0,1]=4 383 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [0,0,0,0,0,0|2,0,1]=3 384 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [0,0,0,0,0,0|2,0,1]=3 385 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [0,0,0,0,0,0|2,0,1]=3 386 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [0,0,0,0,0,0|2,0,1]=3 387 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [0,0,0,0,0,0|2,0,1]=3 388 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [0,0,0,0,0,0|2,0,1]=3 389 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [0,0,0,0,0,0|2,0,1]=3 390 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [0,0,0,0,0,0|2,0,1]=3 391 B10R1.4 [13CH3]SCc1cccnc1Br 62a_100010140945_200025704644 [0,0,0,0,0,0|3,0,1]=4 392 B10R1.4 [13CH3]SCc1cccnc1Br 62a_200025704644_100010140945 [0,0,0,0,0,0|3,0,1]=4 393 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_100000045678_200025704644 [0,0,0,0,0,0|3,0,1]=4 394 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_200025704644_100000045678 [0,0,0,0,0,0|3,0,1]=4 395 B10R1.4 [13CH3]SCc1cccnc1F 62a_100000099810_200025704644 [0,0,0,0,0,0|3,0,1]=4 396 B10R1.4 [13CH3]SCc1cccnc1F 62a_200025704644_100000099810 [0,0,0,0,0,0|3,0,1]=4 397 B10R1.4 [13CH3]SCc1ccncc1Cl 62a_100000763264_200025704644 [0,0,0,0,0,0|3,0,1]=4 398 B10R1.4 [13CH3]SCc1ccncc1Cl 62a_200025704644_100000763264 [0,0,0,0,0,0|3,0,1]=4 399 B10R1.4 [13CH3]SCc1ncccc1Br 62a_100025702911_200025704644 [0,0,0,0,0,0|3,0,1]=4 400 B10R1.4 [13CH3]SCc1ncccc1Br 62a_200025704644_100025702911 [0,0,0,0,0,0|3,0,1]=4 401 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_100000099807_200025704644 [0,0,0,0,0,0|3,0,1]=4 402 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_200025704644_100000099807 [0,0,0,0,0,0|3,0,1]=4 403 B10R1.4 [13CH3]SCc1ncccc1F 62a_100000104219_200025704644 [0,0,0,0,0,0|3,0,1]=4 404 B10R1.4 [13CH3]SCc1ncccc1F 62a_200025704644_100000104219 [0,0,0,0,0,0|3,0,1]=4 405 B10R1.4 [13CH3]SCc1ncccc1O 62a_200020655725_200025704644 [0,0,0,0,0,0|2,0,1]=3 406 B10R1.4 [13CH3]SCc1ncccc1O 62a_200025704644_200020655725 [0,0,0,0,0,0|2,0,1]=3 407 B10R1.4 [N-]=[N+]=Nc1ccccc1O 271570a_203496583355_100000762926 [0,0,0,0,0,0|3,0,0]=3 408 B10R1.4 [N-]=[N+]=Nc1ncccc1O 271570a_203496583355_100012787798 [0,0,0,0,0,0|4,0,0]=4 409 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,0,0,0,0|0,0,2]=3 410 B9R1.8 C=C=Cc1ccccn1 271570a_100015277604_100011216584 [1,0,0,0,0,0|1,0,2]=4 411 B9R1.8 C=C=Cc1cccnc1 271570a_100015277604_100000752921 [1,0,0,0,0,0|1,0,2]=4 412 B9R1.8 C=C=Cc1ccncc1 271570a_100015277604_100000035832 [1,0,0,0,0,0|1,0,2]=4 413 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,0,0,0,0|0,0,2]=3 414 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,0,0,0,0|1,0,2]=4 415 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,0,0,0,0|1,0,2]=4 416 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,0,0,0,0|1,0,2]=4 417 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,0,0,0,0|1,0,2]=4 418 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,0,0,0,0|1,0,2]=4 419 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,0,0,0,0|1,0,2]=4 420 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,0,0,0,0|1,0,2]=4 421 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,0,0,0,0|1,0,2]=4 422 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,0,0,0,0|1,0,1]=3 423 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,0,0,0,0|1,0,1]=3 424 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,0,0,0,0|1,0,1]=3 425 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,0,0,0,0|1,0,1]=3 426 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,0,0,0,0|1,0,1]=3 427 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,0,0,0,0|1,0,1]=3 428 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,0,0,0,0|1,0,1]=3 429 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [1,0,0,0,0,0|2,0,1]=4 430 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [1,0,0,0,0,0|2,0,1]=4 431 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [1,0,0,0,0,0|2,0,1]=4 432 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [1,0,0,0,0,0|2,0,1]=4 433 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [1,0,0,0,0,0|2,0,1]=4 434 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [1,0,0,0,0,0|2,0,1]=4 435 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [1,0,0,0,0,0|2,0,1]=4 436 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [1,0,0,0,0,0|2,0,1]=4 437 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [1,0,0,0,0,0|2,0,1]=4 438 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [1,0,0,0,0,0|2,0,1]=4 439 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [1,0,0,0,0,0|2,0,1]=4 440 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [1,0,0,0,0,0|2,0,1]=4 441 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [1,0,0,0,0,0|2,0,1]=4 442 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,0,0,0,0|1,0,1]=3 443 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,0,0,0,0|1,0,1]=3 444 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,0,0,0,0|1,0,1]=3 445 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [1,0,0,0,0,0|2,0,1]=4 446 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [1,0,0,0,0,0|2,0,1]=4 447 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,0,0,0,0|1,0,1]=3 448 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,0,0,0,0|1,0,1]=3 449 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [1,0,0,0,0,0|2,0,1]=4 450 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [1,0,0,0,0,0|2,0,1]=4 451 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [1,0,0,0,0,0|2,0,1]=4 452 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [1,0,0,0,0,0|2,0,1]=4 453 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [1,0,0,0,0,0|2,0,1]=4 454 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [1,0,0,0,0,0|2,0,1]=4 455 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [1,0,0,0,0,0|2,0,1]=4 456 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,0,0,0,0|2,0,1]=4 457 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,0,0,0,0|2,0,1]=4 458 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [1,0,0,0,0,0|2,0,1]=4 459 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [1,0,0,0,0,0|2,0,1]=4 460 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,0,0,0,0|1,0,1]=3 461 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,0,0,0,0|1,0,1]=3 462 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,0,0,0,0|1,0,1]=3 463 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,0,0,0,0|1,0,1]=3 464 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,0,0,0,0|1,0,1]=3 465 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,0,0,0,0|1,0,1]=3 466 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [1,0,0,0,0,0|2,0,1]=4 467 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [1,0,0,0,0,0|2,0,1]=4 468 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [1,0,0,0,0,0|2,0,1]=4 469 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [1,0,0,0,0,0|2,0,1]=4 470 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [1,0,0,0,0,0|2,0,1]=4 471 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [1,0,0,0,0,0|2,0,1]=4 472 B9R1.15 C=Cc1c[nH]ccc1=O 271570a_100011290941_100009998708 [1,0,0,0,0,0|1,0,1]=3 473 B9R1.15 C=Cc1c[nH]ccc1=S 271570a_100011290941_200012280681 [1,0,0,0,0,0|1,1,0]=3 474 B9R1.15 C=Cc1ccc[nH]c1=O 271570a_100011290941_100000050042 [1,0,0,0,0,0|1,0,1]=3 475 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [1,0,0,0,0,0|2,0,0]=3 476 B9R1.15 C=Cc1cccc[n+]1[O-] 271570a_100011290941_200000042595 [1,0,0,0,0,0|1,0,1]=3 477 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,0,0,0,0|1,0,0]=2 478 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,0,0,0,0|1,0,0]=2 479 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,0,0,0,0|1,0,0]=2 480 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,0,0,0,0|1,0,0]=2 481 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,0,0,0,0|1,0,0]=2 482 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,0,0,0,0|0,0,0]=1 483 B9R1.15 C=Cc1cccnc1Br 271570a_100011290941_100010202626 [1,0,0,0,0,0|2,0,0]=3 484 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [1,0,0,0,0,0|2,0,0]=3 485 B9R1.15 C=Cc1cccnc1Cl 271570a_100011290941_100000036424 [1,0,0,0,0,0|2,0,0]=3 486 B9R1.15 C=Cc1cccnc1F 271570a_100011290941_100009816115 [1,0,0,0,0,0|2,0,0]=3 487 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [1,0,0,0,0,0|2,0,0]=3 488 B9R1.15 C=Cc1ccn[nH]c1=O 271570a_100011290941_100000087129 [1,0,0,0,0,0|2,0,1]=4 489 B9R1.15 C=Cc1ccncc1Br 271570a_100011290941_100000726257 [1,0,0,0,0,0|2,0,0]=3 490 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [1,0,0,0,0,0|2,0,0]=3 491 B9R1.15 C=Cc1ccncc1Cl 271570a_100011290941_100000708259 [1,0,0,0,0,0|2,0,0]=3 492 B9R1.15 C=Cc1ccncc1F 271570a_100011290941_100000047030 [1,0,0,0,0,0|2,0,0]=3 493 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [1,0,0,0,0,0|2,0,0]=3 494 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [1,0,0,0,0,0|1,0,0]=2 495 B9R1.15 C=Cc1cnccc1Br 271570a_100011290941_100010138639 [1,0,0,0,0,0|2,0,0]=3 496 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [1,0,0,0,0,0|2,0,0]=3 497 B9R1.15 C=Cc1cnccc1Cl 271570a_100011290941_100009995489 [1,0,0,0,0,0|2,0,0]=3 498 B9R1.15 C=Cc1cnccc1F 271570a_100011290941_100009820683 [1,0,0,0,0,0|2,0,0]=3 499 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [1,0,0,0,0,0|2,0,0]=3 500 B9R1.15 C=Cc1cncnc1Br 271570a_100011290941_200012461658 [1,0,0,0,0,0|3,0,0]=4 501 B9R1.15 C=Cc1cncnc1C 271570a_100011290941_100009819671 [1,0,0,0,0,0|3,0,0]=4 502 B9R1.15 C=Cc1cncnc1Cl 271570a_100011290941_100000758962 [1,0,0,0,0,0|3,0,0]=4 503 B9R1.15 C=Cc1cncnc1N 271570a_100011290941_100011996079 [1,0,0,0,0,0|3,0,0]=4 504 B9R1.15 C=Cc1cncnc1O 271570a_100011290941_100000751107 [1,0,0,0,0,0|2,0,0]=3 505 B9R1.15 C=Cc1cnncc1N 271570a_100011290941_100009829405 [1,0,0,0,0,0|3,0,0]=4 506 B9R1.15 C=Cc1ncc[nH]c1=O 271570a_100011290941_100000763361 [1,0,0,0,0,0|2,0,1]=4 507 B9R1.15 C=Cc1ncccc1Br 271570a_100011290941_100000696092 [1,0,0,0,0,0|2,0,0]=3 508 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [1,0,0,0,0,0|2,0,0]=3 509 B9R1.15 C=Cc1ncccc1Cl 271570a_100011290941_100011356963 [1,0,0,0,0,0|2,0,0]=3 510 B9R1.15 C=Cc1ncccc1F 271570a_100011290941_100000685392 [1,0,0,0,0,0|2,0,0]=3 511 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [1,0,0,0,0,0|2,0,0]=3 512 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [1,0,0,0,0,0|1,0,0]=2 513 B9R1.15 C=Cc1nccnc1C 271570a_100011290941_100011999405 [1,0,0,0,0,0|3,0,0]=4 514 B9R1.15 C=Cc1nccnc1F 271570a_100011290941_200010125657 [1,0,0,0,0,0|3,0,0]=4 515 B9R1.15 C=Cc1nccnc1N 271570a_100011290941_100000747729 [1,0,0,0,0,0|3,0,0]=4 516 B9R1.15 C=Cc1ncncc1C 271570a_100011290941_100011998708 [1,0,0,0,0,0|3,0,0]=4 517 B9R1.15 C=Cc1ncncc1F 271570a_100011290941_100000069762 [1,0,0,0,0,0|3,0,0]=4 518 B9R1.15 C=Cc1ncncc1N 271570a_100011290941_100000709731 [1,0,0,0,0,0|3,0,0]=4 519 B9R1.15 C=Cc1nnccc1C 271570a_100011290941_100000089043 [1,0,0,0,0,0|3,0,0]=4 520 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,0,0,0,0|0,0,1]=2 521 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [1,0,0,0,0,0|1,0,1]=3 522 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [1,0,0,0,0,0|1,0,1]=3 523 B9R1.15 CCc1cncnc1O 271570a_203496583355_200000100055 [1,0,0,0,0,0|2,0,1]=4 524 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [1,0,0,0,0,0|1,0,1]=3 525 B9R1.15 CCc1nccnc1O 271570a_203496583355_100011995844 [1,0,0,0,0,0|2,0,1]=4 526 B9R1.15 CCc1ncncc1O 271570a_203496583355_100009816992 [1,0,0,0,0,0|2,0,1]=4 527 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [1,0,0,0,0,0|2,0,1]=4 528 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [1,0,0,0,0,0|2,0,1]=4 529 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [1,0,0,0,0,0|2,0,1]=4 530 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [1,0,0,0,0,0|2,0,1]=4 531 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [1,0,0,0,0,0|2,0,1]=4 532 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,0,0,0,0|1,0,1]=3 533 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,0,0,0,0|1,0,1]=3 534 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [1,0,0,0,0,0|2,0,1]=4 535 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [1,0,0,0,0,0|2,0,1]=4 536 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [1,0,0,0,0,0|2,0,1]=4 537 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [1,0,0,0,0,0|2,0,1]=4 538 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [1,0,0,0,0,0|2,0,1]=4 539 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [1,0,0,0,0,0|2,0,1]=4 540 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [1,0,0,0,0,0|2,0,1]=4 541 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [1,0,0,0,0,0|2,0,1]=4 542 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [1,0,0,0,0,0|2,0,1]=4 543 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [1,0,0,0,0,0|2,0,1]=4 544 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [1,0,0,0,0,0|2,0,1]=4 545 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [1,0,0,0,0,0|2,0,1]=4 546 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [1,0,0,0,0,0|2,0,1]=4 547 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [1,0,0,0,0,0|2,0,1]=4 548 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [1,0,0,0,0,0|2,0,1]=4 549 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [1,0,0,0,0,0|1,0,1]=3 550 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [1,0,0,0,0,0|2,0,1]=4 551 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [1,0,0,0,0,0|2,0,1]=4 552 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [1,0,0,0,0,0|2,0,1]=4 553 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [1,0,0,0,0,0|2,0,1]=4 554 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [1,0,0,0,0,0|2,0,1]=4 555 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [1,0,0,0,0,0|2,0,1]=4 556 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [1,0,0,0,0,0|2,0,1]=4 557 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [1,0,0,0,0,0|2,0,1]=4 558 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [1,0,0,0,0,0|2,0,1]=4 559 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [1,0,0,0,0,0|2,0,1]=4 560 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [1,0,0,0,0,0|2,0,1]=4 561 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [1,0,0,0,0,0|2,0,1]=4 562 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [1,0,0,0,0,0|2,0,1]=4 563 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [1,0,0,0,0,0|2,0,1]=4 564 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,0,0,0,0|1,0,1]=3 565 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,0,0,0,0|1,0,1]=3 566 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,0,0,0,0|1,0,1]=3 567 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [1,0,0,0,0,0|2,0,1]=4 568 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [1,0,0,0,0,0|2,0,1]=4 569 B9R1.15 CSc1ccncc1O 62a_100009817591_200000210301 [1,0,0,0,0,0|2,0,1]=4 570 B9R1.15 CSc1ccncc1O 62a_200000210301_100009817591 [1,0,0,0,0,0|2,0,1]=4 571 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [1,0,0,0,0,0|2,0,1]=4 572 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [1,0,0,0,0,0|2,0,1]=4 573 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [1,0,0,0,0,0|2,0,1]=4 574 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [1,0,0,0,0,0|2,0,1]=4 575 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [1,0,0,0,0,0|2,0,1]=4 576 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [1,0,0,0,0,0|2,0,1]=4 577 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [1,0,0,0,0,0|2,0,1]=4 578 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [1,0,0,0,0,0|2,0,1]=4 579 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [1,0,0,0,0,0|1,0,1]=3 580 B9R1.15 N#Cc1cccnc1O 271570a_203496583355_100000211984 [1,0,0,0,0,0|2,0,1]=4 581 B9R1.15 N#Cc1ccncc1O 271570a_203496583355_100000684818 [1,0,0,0,0,0|2,0,1]=4 582 B9R1.15 N#Cc1cnccc1O 271570a_203496583355_100000687039 [1,0,0,0,0,0|2,0,1]=4 583 B9R1.15 N#Cc1ncccc1O 271570a_203496583355_100000685805 [1,0,0,0,0,0|2,0,1]=4 584 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [1,0,0,0,0,0|1,0,0]=2 585 B9R1.15 NCc1cccnc1O 271570a_203496583355_100015189234 [1,0,0,0,0,0|2,0,0]=3 586 B9R1.15 NCc1ccncc1O 271570a_203496583355_100020640021 [1,0,0,0,0,0|2,0,0]=3 587 B9R1.15 NCc1ncccc1O 271570a_203496583355_100020591323 [1,0,0,0,0,0|2,0,0]=3 588 B9R1.15 NCc1nccnc1O 271570a_203496583355_100000729963 [1,0,0,0,0,0|3,0,0]=4 589 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,0,0,0,0|2,0,0]=3 590 B9R1.15 NNc1ccncc1O 271570a_203496583355_100013404636 [1,0,0,0,0,0|3,0,0]=4 591 B9R1.15 NNc1ncccc1O 271570a_203496583355_100011464834 [1,0,0,0,0,0|3,0,0]=4 592 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,0,0,0,0|1,0,0]=2 593 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [1,0,0,0,0,0|2,0,0]=3 594 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [1,0,0,0,0,0|2,0,0]=3 595 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [1,0,0,0,0,0|2,0,0]=3 596 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [1,0,0,0,0,0|2,0,0]=3 597 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,0,0,0,0|1,0,0]=2 598 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,0,0,0,0,0|2,0,0]=3 599 B9R1.15 OCc1ccncc1O 271570a_203496583355_100009873359 [1,0,0,0,0,0|2,0,0]=3 600 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,0,0,0,0,0|2,0,0]=3 601 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [1,0,0,0,0,0|2,0,0]=3 602 B9R1.15 OCc1nccnc1O 271570a_203496583355_100000057004 [1,0,0,0,0,0|3,0,0]=4 603 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [1,0,0,0,0,0|2,0,1]=4 604 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [1,0,0,0,0,0|2,0,1]=4 605 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [1,0,0,0,0,0|2,0,1]=4 606 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [1,0,0,0,0,0|2,0,1]=4 607 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,0,0,0,0|1,0,1]=3 608 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [1,0,0,0,0,0|2,0,1]=4 609 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [1,0,0,0,0,0|2,0,1]=4 610 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [1,0,0,0,0,0|2,0,1]=4 611 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [1,0,0,0,0,0|2,0,1]=4 612 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [1,0,0,0,0,0|2,0,1]=4 613 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [1,0,0,0,0,0|2,0,1]=4 614 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [1,0,0,0,0,0|2,0,1]=4 615 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [1,0,0,0,0,0|2,0,1]=4 616 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [1,0,0,0,0,0|2,0,1]=4 617 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [1,0,0,0,0,0|2,0,1]=4 618 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [1,0,0,0,0,0|2,0,1]=4 619 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [1,0,0,0,0,0|2,0,1]=4 620 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [1,0,0,0,0,0|2,0,1]=4 621 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [1,0,0,0,0,0|2,0,1]=4 622 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [1,0,0,0,0,0|2,0,1]=4 623 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [1,0,0,0,0,0|2,0,1]=4 624 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [1,0,0,0,0,0|2,0,1]=4 625 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [1,0,0,0,0,0|2,0,1]=4 626 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,0,0,0,0|1,0,1]=3 627 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,0,0,0,0|1,0,1]=3 628 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [1,0,0,0,0,0|2,0,1]=4 629 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [1,0,0,0,0,0|2,0,1]=4 630 B9R1.15 [13CH3]Sc1ccncc1O 62a_100009817591_200025704644 [1,0,0,0,0,0|2,0,1]=4 631 B9R1.15 [13CH3]Sc1ccncc1O 62a_200025704644_100009817591 [1,0,0,0,0,0|2,0,1]=4 632 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [1,0,0,0,0,0|2,0,1]=4 633 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [1,0,0,0,0,0|2,0,1]=4 634 B11R1.13 C=C=Cc1cccc(c1Br)O 271570a_100015277604_100010187914 [0,1,0,0,0,0|1,0,2]=4 635 B11R1.13 C=C=Cc1cccc(c1C)Br 271570a_100015277604_100012353703 [0,1,0,0,0,0|1,0,2]=4 636 B11R1.13 C=C=Cc1cccc(c1C)C 271570a_100015277604_100011214922 [0,1,0,0,0,0|1,0,2]=4 637 B11R1.13 C=C=Cc1cccc(c1C)Cl 271570a_100015277604_100000726075 [0,1,0,0,0,0|1,0,2]=4 638 B11R1.13 C=C=Cc1cccc(c1C)F 271570a_100015277604_100011216893 [0,1,0,0,0,0|1,0,2]=4 639 B11R1.13 C=C=Cc1cccc(c1C)N 271570a_100015277604_100000761887 [0,1,0,0,0,0|1,0,2]=4 640 B11R1.13 C=C=Cc1cccc(c1C)O 271570a_100015277604_100012002258 [0,1,0,0,0,0|1,0,2]=4 641 B11R1.13 C=C=Cc1cccc(c1Cl)Br 271570a_100015277604_100010142854 [0,1,0,0,0,0|1,0,2]=4 642 B11R1.13 C=C=Cc1cccc(c1Cl)C 271570a_100015277604_200012352035 [0,1,0,0,0,0|1,0,2]=4 643 B11R1.13 C=C=Cc1cccc(c1Cl)Cl 271570a_100015277604_100011215384 [0,1,0,0,0,0|1,0,2]=4 644 B11R1.13 C=C=Cc1cccc(c1Cl)F 271570a_100015277604_200010234923 [0,1,0,0,0,0|1,0,2]=4 645 B11R1.13 C=C=Cc1cccc(c1Cl)O 271570a_100015277604_100000049636 [0,1,0,0,0,0|1,0,2]=4 646 B11R1.13 C=C=Cc1cccc(c1F)Br 271570a_100015277604_100000702267 [0,1,0,0,0,0|1,0,2]=4 647 B11R1.13 C=C=Cc1cccc(c1F)C 271570a_100015277604_100000717567 [0,1,0,0,0,0|1,0,2]=4 648 B11R1.13 C=C=Cc1cccc(c1F)Cl 271570a_100015277604_100011217346 [0,1,0,0,0,0|1,0,2]=4 649 B11R1.13 C=C=Cc1cccc(c1F)F 271570a_100015277604_100000694657 [0,1,0,0,0,0|1,0,2]=4 650 B11R1.13 C=C=Cc1cccc(c1F)N 271570a_100015277604_100011935091 [0,1,0,0,0,0|1,0,2]=4 651 B11R1.13 C=C=Cc1cccc(c1F)O 271570a_100015277604_100009817021 [0,1,0,0,0,0|1,0,2]=4 652 B11R1.13 C=C=Cc1cccc(c1N)Br 271570a_100015277604_100010146558 [0,1,0,0,0,0|1,0,2]=4 653 B11R1.13 C=C=Cc1cccc(c1N)C 271570a_100015277604_100011834072 [0,1,0,0,0,0|1,0,2]=4 654 B11R1.13 C=C=Cc1cccc(c1N)Cl 271570a_100015277604_100010190421 [0,1,0,0,0,0|1,0,2]=4 655 B11R1.13 C=C=Cc1cccc(c1N)F 271570a_100015277604_100000042321 [0,1,0,0,0,0|1,0,2]=4 656 B11R1.13 C=C=Cc1cccc(c1N)N 271570a_100015277604_100015191791 [0,1,0,0,0,0|1,0,2]=4 657 B11R1.13 C=C=Cc1cccc(c1N)O 271570a_100015277604_100011934926 [0,1,0,0,0,0|1,0,2]=4 658 B11R1.13 C=C=Cc1cccc(c1O)Br 271570a_100015277604_100010084509 [0,1,0,0,0,0|0,0,2]=3 659 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [0,1,0,0,0,0|0,0,2]=3 660 B11R1.13 C=C=Cc1cccc(c1O)Cl 271570a_100015277604_100010202889 [0,1,0,0,0,0|0,0,2]=3 661 B11R1.13 C=C=Cc1cccc(c1O)F 271570a_100015277604_100009813666 [0,1,0,0,0,0|0,0,2]=3 662 B11R1.13 C=C=Cc1cccc(c1O)N 271570a_100015277604_100011934915 [0,1,0,0,0,0|0,0,2]=3 663 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [0,1,0,0,0,0|0,0,2]=3 664 B11R1.13 C=C=Cc1nccc(c1O)C 271570a_100015277604_100000696282 [0,1,0,0,0,0|1,0,2]=4 665 B11R1.13 C=C=Cc1nccc(c1O)F 271570a_100015277604_100009867227 [0,1,0,0,0,0|1,0,2]=4 666 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [0,1,0,0,0,0|1,0,2]=4 667 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [0,1,0,0,0,0|1,0,2]=4 668 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [0,1,0,0,0,0|1,0,2]=4 669 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [0,1,0,0,0,0|1,0,2]=4 670 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [0,1,0,0,0,0|1,0,2]=4 671 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [0,1,0,0,0,0|1,0,2]=4 672 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [0,1,0,0,0,0|1,0,2]=4 673 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [0,1,0,0,0,0|1,0,2]=4 674 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [0,1,0,0,0,0|1,0,2]=4 675 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [0,1,0,0,0,0|1,0,2]=4 676 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [0,1,0,0,0,0|1,0,2]=4 677 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [0,1,0,0,0,0|1,0,2]=4 678 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [0,1,0,0,0,0|1,0,2]=4 679 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [0,1,0,0,0,0|1,0,2]=4 680 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [0,1,0,0,0,0|1,0,2]=4 681 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [0,1,0,0,0,0|1,0,2]=4 682 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [0,1,0,0,0,0|1,0,2]=4 683 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [0,1,0,0,0,0|1,0,2]=4 684 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [0,1,0,0,0,0|1,0,2]=4 685 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,1,0,0,0,0|1,0,2]=4 686 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [0,1,0,0,0,0|1,0,2]=4 687 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [0,1,0,0,0,0|1,0,2]=4 688 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [0,1,0,0,0,0|1,0,2]=4 689 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [0,1,0,0,0,0|1,0,2]=4 690 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [0,1,0,0,0,0|0,0,2]=3 691 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [0,1,0,0,0,0|0,0,2]=3 692 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [0,1,0,0,0,0|0,0,2]=3 693 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [0,1,0,0,0,0|0,0,2]=3 694 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [0,1,0,0,0,0|0,0,2]=3 695 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [0,1,0,0,0,0|0,0,2]=3 696 B11R1.13 CC=Cc1nccc(c1O)C 271570a_100016259895_100000696282 [0,1,0,0,0,0|1,0,2]=4 697 B11R1.13 CC=Cc1nccc(c1O)F 271570a_100016259895_100009867227 [0,1,0,0,0,0|1,0,2]=4 698 B11R1.13 CCNc1cccc(c1O)Br 34a_100011934915_100000210202 [0,1,0,0,0,0|1,0,2]=4 699 B11R1.13 CCNc1cccc(c1O)C 34a_100000756359_100000210202 [0,1,0,0,0,0|1,0,2]=4 700 B11R1.13 CCNc1cccc(c1O)Cl 34a_100000754742_100000210202 [0,1,0,0,0,0|1,0,2]=4 701 B11R1.13 CCNc1cccc(c1O)F 34a_100011934987_100000210202 [0,1,0,0,0,0|1,0,2]=4 702 B11R1.13 CCSc1cccc(c1O)Br 62a_100000210202_100010084509 [0,1,0,0,0,0|1,0,2]=4 703 B11R1.13 CCSc1cccc(c1O)Br 62a_100010084509_100000210202 [0,1,0,0,0,0|1,0,2]=4 704 B11R1.13 CCSc1cccc(c1O)C 62a_100000210202_100009817157 [0,1,0,0,0,0|1,0,2]=4 705 B11R1.13 CCSc1cccc(c1O)C 62a_100009817157_100000210202 [0,1,0,0,0,0|1,0,2]=4 706 B11R1.13 CCSc1cccc(c1O)Cl 62a_100000210202_100010202889 [0,1,0,0,0,0|1,0,2]=4 707 B11R1.13 CCSc1cccc(c1O)Cl 62a_100010202889_100000210202 [0,1,0,0,0,0|1,0,2]=4 708 B11R1.13 CCSc1cccc(c1O)F 62a_100000210202_100009813666 [0,1,0,0,0,0|1,0,2]=4 709 B11R1.13 CCSc1cccc(c1O)F 62a_100009813666_100000210202 [0,1,0,0,0,0|1,0,2]=4 710 B11R1.13 CCSc1cccc(c1O)N 62a_100000210202_100010084371 [0,1,0,0,0,0|1,0,2]=4 711 B11R1.13 CCSc1cccc(c1O)N 62a_100011934915_100000210202 [0,1,0,0,0,0|1,0,2]=4 712 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [0,1,0,0,0,0|1,0,2]=4 713 B11R1.13 CNCc1cccc(c1Br)Br 207a_100102657272_100010240334 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.13 CNCc1cccc(c1Br)Br 26a_100102657272_100010187966 [0,1,0,0,0,0|2,0,1]=4 715 B11R1.13 CNCc1cccc(c1Br)Br 270004a_106832991635_100010240334 [0,1,0,0,0,0|2,0,1]=4 716 B11R1.13 CNCc1cccc(c1Br)C 207a_100102657272_100012186367 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.13 CNCc1cccc(c1Br)C 2230a_106832991635_200012349612 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.13 CNCc1cccc(c1Br)C 26a_100102657272_100000686692 [0,1,0,0,0,0|2,0,1]=4 719 B11R1.13 CNCc1cccc(c1Br)C 270004a_106832991635_100012186367 [0,1,0,0,0,0|2,0,1]=4 720 B11R1.13 CNCc1cccc(c1Br)C 34a_100102657272_200012349612 [0,1,0,0,0,0|2,0,1]=4 721 B11R1.13 CNCc1cccc(c1Br)C 7a_106832991635_200012349612 [0,1,0,0,0,0|2,0,1]=4 722 B11R1.13 CNCc1cccc(c1Br)Cl 207a_100102657272_100010232083 [0,1,0,0,0,0|2,0,1]=4 723 B11R1.13 CNCc1cccc(c1Br)Cl 2230a_106832991635_100010145525 [0,1,0,0,0,0|2,0,1]=4 724 B11R1.13 CNCc1cccc(c1Br)Cl 26a_100102657272_100012348804 [0,1,0,0,0,0|2,0,1]=4 725 B11R1.13 CNCc1cccc(c1Br)Cl 270004a_106832991635_100010232083 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.13 CNCc1cccc(c1Br)Cl 34a_100102657272_100010145525 [0,1,0,0,0,0|2,0,1]=4 727 B11R1.13 CNCc1cccc(c1Br)Cl 7a_106832991635_100010145525 [0,1,0,0,0,0|2,0,1]=4 728 B11R1.13 CNCc1cccc(c1Br)F 207a_100102657272_100011934749 [0,1,0,0,0,0|2,0,1]=4 729 B11R1.13 CNCc1cccc(c1Br)F 2230a_100020638964_200000210301 [0,1,0,0,0,0|2,0,1]=4 730 B11R1.13 CNCc1cccc(c1Br)F 2230a_106832991635_100012351116 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.13 CNCc1cccc(c1Br)F 26a_100102657272_100009820682 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.13 CNCc1cccc(c1Br)F 270004a_106832991635_100011934749 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.13 CNCc1cccc(c1Br)F 34a_100020638964_200000210301 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.13 CNCc1cccc(c1Br)F 34a_100102657272_100012351116 [0,1,0,0,0,0|2,0,1]=4 735 B11R1.13 CNCc1cccc(c1Br)F 7a_106832991635_100012351116 [0,1,0,0,0,0|2,0,1]=4 736 B11R1.13 CNCc1cccc(c1Br)I 2230a_106832991635_100010254545 [0,1,0,0,0,0|2,0,1]=4 737 B11R1.13 CNCc1cccc(c1Br)I 26a_100102657272_100010187914 [0,1,0,0,0,0|2,0,1]=4 738 B11R1.13 CNCc1cccc(c1Br)I 34a_100102657272_100010254545 [0,1,0,0,0,0|2,0,1]=4 739 B11R1.13 CNCc1cccc(c1Br)I 7a_106832991635_100010254545 [0,1,0,0,0,0|2,0,1]=4 740 B11R1.13 CNCc1cccc(c1C)Br 207a_100102657272_100012179384 [0,1,0,0,0,0|2,0,1]=4 741 B11R1.13 CNCc1cccc(c1C)Br 2230a_106832991635_100000694682 [0,1,0,0,0,0|2,0,1]=4 742 B11R1.13 CNCc1cccc(c1C)Br 26a_100102657272_100012002258 [0,1,0,0,0,0|2,0,1]=4 743 B11R1.13 CNCc1cccc(c1C)Br 270004a_106832991635_100012179384 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.13 CNCc1cccc(c1C)Br 34a_100000724210_200000210301 [0,1,0,0,0,0|2,0,1]=4 745 B11R1.13 CNCc1cccc(c1C)Br 34a_100102657272_100000694682 [0,1,0,0,0,0|2,0,1]=4 746 B11R1.13 CNCc1cccc(c1C)Br 7a_106832991635_100000694682 [0,1,0,0,0,0|2,0,1]=4 747 B11R1.13 CNCc1cccc(c1C)C 207a_100102657272_100000229941 [0,1,0,0,0,0|2,0,1]=4 748 B11R1.13 CNCc1cccc(c1C)C 2230a_100011211637_200000210301 [0,1,0,0,0,0|2,0,1]=4 749 B11R1.13 CNCc1cccc(c1C)C 2230a_106832991635_100011515928 [0,1,0,0,0,0|2,0,1]=4 750 B11R1.13 CNCc1cccc(c1C)C 270004a_106832991635_100000229941 [0,1,0,0,0,0|2,0,1]=4 751 B11R1.13 CNCc1cccc(c1C)C 34a_100011211637_200000210301 [0,1,0,0,0,0|2,0,1]=4 752 B11R1.13 CNCc1cccc(c1C)C 34a_100102657272_100011273979 [0,1,0,0,0,0|2,0,1]=4 753 B11R1.13 CNCc1cccc(c1C)C 7a_106832991635_100011515928 [0,1,0,0,0,0|2,0,1]=4 754 B11R1.13 CNCc1cccc(c1C)Cl 207a_100102657272_100012002129 [0,1,0,0,0,0|2,0,1]=4 755 B11R1.13 CNCc1cccc(c1C)Cl 2230a_100020639605_200000210301 [0,1,0,0,0,0|2,0,1]=4 756 B11R1.13 CNCc1cccc(c1C)Cl 2230a_106832991635_100012186920 [0,1,0,0,0,0|2,0,1]=4 757 B11R1.13 CNCc1cccc(c1C)Cl 270004a_106832991635_100012002129 [0,1,0,0,0,0|2,0,1]=4 758 B11R1.13 CNCc1cccc(c1C)Cl 34a_100020639605_200000210301 [0,1,0,0,0,0|2,0,1]=4 759 B11R1.13 CNCc1cccc(c1C)Cl 34a_100102657272_100012186920 [0,1,0,0,0,0|2,0,1]=4 760 B11R1.13 CNCc1cccc(c1C)Cl 7a_106832991635_100012186920 [0,1,0,0,0,0|2,0,1]=4 761 B11R1.13 CNCc1cccc(c1C)F 207a_100102657272_100000037668 [0,1,0,0,0,0|2,0,1]=4 762 B11R1.13 CNCc1cccc(c1C)F 2230a_100132306986_200000210301 [0,1,0,0,0,0|2,0,1]=4 763 B11R1.13 CNCc1cccc(c1C)F 2230a_106832991635_100009813626 [0,1,0,0,0,0|2,0,1]=4 764 B11R1.13 CNCc1cccc(c1C)F 270004a_106832991635_100000037668 [0,1,0,0,0,0|2,0,1]=4 765 B11R1.13 CNCc1cccc(c1C)F 34a_100102657272_100009813626 [0,1,0,0,0,0|2,0,1]=4 766 B11R1.13 CNCc1cccc(c1C)F 34a_100132306986_200000210301 [0,1,0,0,0,0|2,0,1]=4 767 B11R1.13 CNCc1cccc(c1C)F 7a_106832991635_100009813626 [0,1,0,0,0,0|2,0,1]=4 768 B11R1.13 CNCc1cccc(c1C)I 2230a_106832991635_100010150147 [0,1,0,0,0,0|2,0,1]=4 769 B11R1.13 CNCc1cccc(c1C)I 34a_100102657272_100010150147 [0,1,0,0,0,0|2,0,1]=4 770 B11R1.13 CNCc1cccc(c1C)I 7a_106832991635_100010150147 [0,1,0,0,0,0|2,0,1]=4 771 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [0,1,0,0,0,0|2,0,1]=4 772 B11R1.13 CNCc1cccc(c1Cl)Br 207a_100102657272_100012362481 [0,1,0,0,0,0|2,0,1]=4 773 B11R1.13 CNCc1cccc(c1Cl)Br 2230a_106832991635_100012349491 [0,1,0,0,0,0|2,0,1]=4 774 B11R1.13 CNCc1cccc(c1Cl)Br 26a_100102657272_100010187913 [0,1,0,0,0,0|2,0,1]=4 775 B11R1.13 CNCc1cccc(c1Cl)Br 270004a_106832991635_100012362481 [0,1,0,0,0,0|2,0,1]=4 776 B11R1.13 CNCc1cccc(c1Cl)Br 34a_100102657272_100012349491 [0,1,0,0,0,0|2,0,1]=4 777 B11R1.13 CNCc1cccc(c1Cl)Br 7a_106832991635_100012349491 [0,1,0,0,0,0|2,0,1]=4 778 B11R1.13 CNCc1cccc(c1Cl)C 207a_100102657272_100012017286 [0,1,0,0,0,0|2,0,1]=4 779 B11R1.13 CNCc1cccc(c1Cl)C 2230a_100025705714_200000210301 [0,1,0,0,0,0|2,0,1]=4 780 B11R1.13 CNCc1cccc(c1Cl)C 26a_100102657272_100000695629 [0,1,0,0,0,0|2,0,1]=4 781 B11R1.13 CNCc1cccc(c1Cl)C 270004a_106832991635_100012017286 [0,1,0,0,0,0|2,0,1]=4 782 B11R1.13 CNCc1cccc(c1Cl)C 34a_100025705714_200000210301 [0,1,0,0,0,0|2,0,1]=4 783 B11R1.13 CNCc1cccc(c1Cl)Cl 207a_100102657272_100000210504 [0,1,0,0,0,0|2,0,1]=4 784 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_100011211633_200000210301 [0,1,0,0,0,0|2,0,1]=4 785 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_106832991635_100000723366 [0,1,0,0,0,0|2,0,1]=4 786 B11R1.13 CNCc1cccc(c1Cl)Cl 26a_100102657272_100000211076 [0,1,0,0,0,0|2,0,1]=4 787 B11R1.13 CNCc1cccc(c1Cl)Cl 270004a_106832991635_100000210504 [0,1,0,0,0,0|2,0,1]=4 788 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100011211633_200000210301 [0,1,0,0,0,0|2,0,1]=4 789 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100102657272_100000723366 [0,1,0,0,0,0|2,0,1]=4 790 B11R1.13 CNCc1cccc(c1Cl)Cl 7a_106832991635_100000723366 [0,1,0,0,0,0|2,0,1]=4 791 B11R1.13 CNCc1cccc(c1Cl)F 207a_100102657272_100011998484 [0,1,0,0,0,0|2,0,1]=4 792 B11R1.13 CNCc1cccc(c1Cl)F 2230a_100012001614_200000210301 [0,1,0,0,0,0|2,0,1]=4 793 B11R1.13 CNCc1cccc(c1Cl)F 2230a_106832991635_100000696688 [0,1,0,0,0,0|2,0,1]=4 794 B11R1.13 CNCc1cccc(c1Cl)F 26a_100102657272_100000087408 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.13 CNCc1cccc(c1Cl)F 270004a_106832991635_100011998484 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.13 CNCc1cccc(c1Cl)F 34a_100012001614_200000210301 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.13 CNCc1cccc(c1Cl)F 34a_100102657272_100000696688 [0,1,0,0,0,0|2,0,1]=4 798 B11R1.13 CNCc1cccc(c1Cl)F 7a_106832991635_100000696688 [0,1,0,0,0,0|2,0,1]=4 799 B11R1.13 CNCc1cccc(c1Cl)I 26a_100102657272_100000049636 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [0,1,0,0,0,0|2,0,1]=4 801 B11R1.13 CNCc1cccc(c1F)Br 207a_100102657272_100011361543 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.13 CNCc1cccc(c1F)Br 2230a_100015189953_200000210301 [0,1,0,0,0,0|2,0,1]=4 803 B11R1.13 CNCc1cccc(c1F)Br 2230a_106832991635_100012356506 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.13 CNCc1cccc(c1F)Br 26a_100102657272_100009817021 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.13 CNCc1cccc(c1F)Br 270004a_106832991635_100011361543 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.13 CNCc1cccc(c1F)Br 34a_100015189953_200000210301 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.13 CNCc1cccc(c1F)Br 34a_100102657272_100012356506 [0,1,0,0,0,0|2,0,1]=4 808 B11R1.13 CNCc1cccc(c1F)Br 7a_106832991635_100012356506 [0,1,0,0,0,0|2,0,1]=4 809 B11R1.13 CNCc1cccc(c1F)C 207a_100102657272_100011219516 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.13 CNCc1cccc(c1F)C 2230a_100012002060_200000210301 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.13 CNCc1cccc(c1F)C 2230a_106832991635_100011216058 [0,1,0,0,0,0|2,0,1]=4 812 B11R1.13 CNCc1cccc(c1F)C 270004a_106832991635_100011219516 [0,1,0,0,0,0|2,0,1]=4 813 B11R1.13 CNCc1cccc(c1F)C 34a_100012002060_200000210301 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.13 CNCc1cccc(c1F)C 34a_100102657272_100011216058 [0,1,0,0,0,0|2,0,1]=4 815 B11R1.13 CNCc1cccc(c1F)C 7a_106832991635_100011216058 [0,1,0,0,0,0|2,0,1]=4 816 B11R1.13 CNCc1cccc(c1F)Cl 207a_100102657272_100000766533 [0,1,0,0,0,0|2,0,1]=4 817 B11R1.13 CNCc1cccc(c1F)Cl 2230a_100000764326_200000210301 [0,1,0,0,0,0|2,0,1]=4 818 B11R1.13 CNCc1cccc(c1F)Cl 2230a_106832991635_100000716733 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.13 CNCc1cccc(c1F)Cl 26a_100102657272_100000687438 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.13 CNCc1cccc(c1F)Cl 270004a_106832991635_100000766533 [0,1,0,0,0,0|2,0,1]=4 821 B11R1.13 CNCc1cccc(c1F)Cl 34a_100000764326_200000210301 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.13 CNCc1cccc(c1F)Cl 34a_100102657272_100000716733 [0,1,0,0,0,0|2,0,1]=4 823 B11R1.13 CNCc1cccc(c1F)Cl 7a_106832991635_100000716733 [0,1,0,0,0,0|2,0,1]=4 824 B11R1.13 CNCc1cccc(c1F)F 207a_100102657272_100000753312 [0,1,0,0,0,0|2,0,1]=4 825 B11R1.13 CNCc1cccc(c1F)F 2230a_100011199105_200000210301 [0,1,0,0,0,0|2,0,1]=4 826 B11R1.13 CNCc1cccc(c1F)F 2230a_106832991635_100000217499 [0,1,0,0,0,0|2,0,1]=4 827 B11R1.13 CNCc1cccc(c1F)F 270004a_106832991635_100000753312 [0,1,0,0,0,0|2,0,1]=4 828 B11R1.13 CNCc1cccc(c1F)F 34a_100011199105_200000210301 [0,1,0,0,0,0|2,0,1]=4 829 B11R1.13 CNCc1cccc(c1F)F 34a_100102657272_100000217499 [0,1,0,0,0,0|2,0,1]=4 830 B11R1.13 CNCc1cccc(c1F)F 7a_106832991635_100000217499 [0,1,0,0,0,0|2,0,1]=4 831 B11R1.13 CNCc1cccc(c1F)I 207a_100102657272_100010202174 [0,1,0,0,0,0|2,0,1]=4 832 B11R1.13 CNCc1cccc(c1F)I 270004a_106832991635_100010202174 [0,1,0,0,0,0|2,0,1]=4 833 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [0,1,0,0,0,0|2,0,1]=4 835 B11R1.13 CNCc1cccc(c1I)Br 26a_100102657272_100010187912 [0,1,0,0,0,0|2,0,1]=4 836 B11R1.13 CNCc1cccc(c1I)F 207a_100102657272_100010186293 [0,1,0,0,0,0|2,0,1]=4 837 B11R1.13 CNCc1cccc(c1I)F 2230a_106832991635_100010149603 [0,1,0,0,0,0|2,0,1]=4 838 B11R1.13 CNCc1cccc(c1I)F 270004a_106832991635_100010186293 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.13 CNCc1cccc(c1I)F 34a_100102657272_100010149603 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.13 CNCc1cccc(c1I)F 7a_106832991635_100010149603 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [0,1,0,0,0,0|1,0,1]=3 842 B11R1.13 COCc1cccc(c1Br)C 34a_100011659289_200000210301 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.13 COCc1cccc(c1Br)C 34a_100138415774_200012349612 [0,1,0,0,0,0|2,0,1]=4 844 B11R1.13 COCc1cccc(c1Br)C 7a_100011659289_200000210301 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.13 COCc1cccc(c1Br)Cl 34a_100010168166_200000210301 [0,1,0,0,0,0|2,0,1]=4 846 B11R1.13 COCc1cccc(c1Br)Cl 34a_100138415774_100010145525 [0,1,0,0,0,0|2,0,1]=4 847 B11R1.13 COCc1cccc(c1Br)Cl 7a_100010168166_200000210301 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.13 COCc1cccc(c1Br)F 34a_100012351117_200000210301 [0,1,0,0,0,0|2,0,1]=4 849 B11R1.13 COCc1cccc(c1Br)F 34a_100138415774_100012351116 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.13 COCc1cccc(c1Br)F 7a_100012351117_200000210301 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.13 COCc1cccc(c1Br)I 34a_100010240205_200000210301 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.13 COCc1cccc(c1Br)I 34a_100138415774_100010254545 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.13 COCc1cccc(c1Br)I 7a_100010240205_200000210301 [0,1,0,0,0,0|2,0,1]=4 854 B11R1.13 COCc1cccc(c1C)Br 34a_100000694458_200000210301 [0,1,0,0,0,0|2,0,1]=4 855 B11R1.13 COCc1cccc(c1C)Br 34a_100138415774_100000694682 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.13 COCc1cccc(c1C)Br 7a_100000694458_200000210301 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.13 COCc1cccc(c1C)C 34a_100011219135_200000210301 [0,1,0,0,0,0|2,0,1]=4 858 B11R1.13 COCc1cccc(c1C)C 34a_100138415774_100011273979 [0,1,0,0,0,0|2,0,1]=4 859 B11R1.13 COCc1cccc(c1C)C 7a_100011219135_200000210301 [0,1,0,0,0,0|2,0,1]=4 860 B11R1.13 COCc1cccc(c1C)Cl 34a_100012000165_200000210301 [0,1,0,0,0,0|2,0,1]=4 861 B11R1.13 COCc1cccc(c1C)Cl 34a_100138415774_100012186920 [0,1,0,0,0,0|2,0,1]=4 862 B11R1.13 COCc1cccc(c1C)Cl 7a_100012000165_200000210301 [0,1,0,0,0,0|2,0,1]=4 863 B11R1.13 COCc1cccc(c1C)F 34a_100000042775_200000210301 [0,1,0,0,0,0|2,0,1]=4 864 B11R1.13 COCc1cccc(c1C)F 34a_100138415774_100009813626 [0,1,0,0,0,0|2,0,1]=4 865 B11R1.13 COCc1cccc(c1C)F 7a_100000042775_200000210301 [0,1,0,0,0,0|2,0,1]=4 866 B11R1.13 COCc1cccc(c1C)I 34a_100010150139_200000210301 [0,1,0,0,0,0|2,0,1]=4 867 B11R1.13 COCc1cccc(c1C)I 34a_100138415774_100010150147 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.13 COCc1cccc(c1C)I 7a_100010150139_200000210301 [0,1,0,0,0,0|2,0,1]=4 869 B11R1.13 COCc1cccc(c1C)N 34a_102495339961_200000210301 [0,1,0,0,0,0|2,0,1]=4 870 B11R1.13 COCc1cccc(c1C)N 7a_102495339961_200000210301 [0,1,0,0,0,0|2,0,1]=4 871 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [0,1,0,0,0,0|2,0,1]=4 872 B11R1.13 COCc1cccc(c1Cl)Br 34a_100012351182_200000210301 [0,1,0,0,0,0|2,0,1]=4 873 B11R1.13 COCc1cccc(c1Cl)Br 34a_100138415774_100012349491 [0,1,0,0,0,0|2,0,1]=4 874 B11R1.13 COCc1cccc(c1Cl)Br 7a_100012351182_200000210301 [0,1,0,0,0,0|2,0,1]=4 875 B11R1.13 COCc1cccc(c1Cl)C 34a_100000710031_200000210301 [0,1,0,0,0,0|2,0,1]=4 876 B11R1.13 COCc1cccc(c1Cl)C 7a_100000710031_200000210301 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100000720469_200000210301 [0,1,0,0,0,0|2,0,1]=4 878 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100138415774_100000723366 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.13 COCc1cccc(c1Cl)Cl 7a_100000720469_200000210301 [0,1,0,0,0,0|2,0,1]=4 880 B11R1.13 COCc1cccc(c1Cl)F 34a_100000696319_200000210301 [0,1,0,0,0,0|2,0,1]=4 881 B11R1.13 COCc1cccc(c1Cl)F 34a_100138415774_100000696688 [0,1,0,0,0,0|2,0,1]=4 882 B11R1.13 COCc1cccc(c1Cl)F 7a_100000696319_200000210301 [0,1,0,0,0,0|2,0,1]=4 883 B11R1.13 COCc1cccc(c1F)Br 34a_100011935076_200000210301 [0,1,0,0,0,0|2,0,1]=4 884 B11R1.13 COCc1cccc(c1F)Br 34a_100138415774_100012356506 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.13 COCc1cccc(c1F)Br 7a_100011935076_200000210301 [0,1,0,0,0,0|2,0,1]=4 886 B11R1.13 COCc1cccc(c1F)C 34a_100138415774_100011216058 [0,1,0,0,0,0|2,0,1]=4 887 B11R1.13 COCc1cccc(c1F)C 34a_200011219517_200000210301 [0,1,0,0,0,0|2,0,1]=4 888 B11R1.13 COCc1cccc(c1F)C 7a_200011219517_200000210301 [0,1,0,0,0,0|2,0,1]=4 889 B11R1.13 COCc1cccc(c1F)Cl 34a_100011216988_200000210301 [0,1,0,0,0,0|2,0,1]=4 890 B11R1.13 COCc1cccc(c1F)Cl 34a_100138415774_100000716733 [0,1,0,0,0,0|2,0,1]=4 891 B11R1.13 COCc1cccc(c1F)Cl 7a_100011216988_200000210301 [0,1,0,0,0,0|2,0,1]=4 892 B11R1.13 COCc1cccc(c1F)F 34a_100011218644_200000210301 [0,1,0,0,0,0|2,0,1]=4 893 B11R1.13 COCc1cccc(c1F)F 34a_100138415774_100000217499 [0,1,0,0,0,0|2,0,1]=4 894 B11R1.13 COCc1cccc(c1F)F 7a_100011218644_200000210301 [0,1,0,0,0,0|2,0,1]=4 895 B11R1.13 COCc1cccc(c1F)I 34a_200010235739_200000210301 [0,1,0,0,0,0|2,0,1]=4 896 B11R1.13 COCc1cccc(c1F)I 7a_200010235739_200000210301 [0,1,0,0,0,0|2,0,1]=4 897 B11R1.13 COCc1cccc(c1F)N 34a_100012023829_200000210301 [0,1,0,0,0,0|2,0,1]=4 898 B11R1.13 COCc1cccc(c1I)Br 34a_100010146604_200000210301 [0,1,0,0,0,0|2,0,1]=4 899 B11R1.13 COCc1cccc(c1I)Br 7a_100010146604_200000210301 [0,1,0,0,0,0|2,0,1]=4 900 B11R1.13 COCc1cccc(c1I)C 34a_100012349780_200000210301 [0,1,0,0,0,0|2,0,1]=4 901 B11R1.13 COCc1cccc(c1I)C 7a_100012349780_200000210301 [0,1,0,0,0,0|2,0,1]=4 902 B11R1.13 COCc1cccc(c1I)F 34a_100000692438_200000210301 [0,1,0,0,0,0|2,0,1]=4 903 B11R1.13 COCc1cccc(c1I)F 34a_100138415774_100010149603 [0,1,0,0,0,0|2,0,1]=4 904 B11R1.13 COCc1cccc(c1I)F 7a_100000692438_200000210301 [0,1,0,0,0,0|2,0,1]=4 905 B11R1.13 COCc1cccc(c1N)Br 34a_100012349457_200000210301 [0,1,0,0,0,0|2,0,1]=4 906 B11R1.13 COCc1cccc(c1N)C 34a_100011215590_200000210301 [0,1,0,0,0,0|2,0,1]=4 907 B11R1.13 COCc1cccc(c1N)Cl 34a_100012182729_200000210301 [0,1,0,0,0,0|2,0,1]=4 908 B11R1.13 COCc1cccc(c1N)F 34a_100000692437_200000210301 [0,1,0,0,0,0|2,0,1]=4 909 B11R1.13 CSCc1cccc(c1Br)C 62a_200000210301_200012349612 [0,1,0,0,0,0|2,0,1]=4 910 B11R1.13 CSCc1cccc(c1Br)C 62a_200012349612_200000210301 [0,1,0,0,0,0|2,0,1]=4 911 B11R1.13 CSCc1cccc(c1Br)Cl 62a_100010145525_200000210301 [0,1,0,0,0,0|2,0,1]=4 912 B11R1.13 CSCc1cccc(c1Br)Cl 62a_200000210301_100010145525 [0,1,0,0,0,0|2,0,1]=4 913 B11R1.13 CSCc1cccc(c1Br)F 62a_100012351116_200000210301 [0,1,0,0,0,0|2,0,1]=4 914 B11R1.13 CSCc1cccc(c1Br)F 62a_200000210301_100012351116 [0,1,0,0,0,0|2,0,1]=4 915 B11R1.13 CSCc1cccc(c1Br)I 62a_100010254545_200000210301 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.13 CSCc1cccc(c1Br)I 62a_200000210301_100010254545 [0,1,0,0,0,0|2,0,1]=4 917 B11R1.13 CSCc1cccc(c1C)Br 62a_100000694682_200000210301 [0,1,0,0,0,0|2,0,1]=4 918 B11R1.13 CSCc1cccc(c1C)Br 62a_200000210301_100000694682 [0,1,0,0,0,0|2,0,1]=4 919 B11R1.13 CSCc1cccc(c1C)C 62a_100011515928_200000210301 [0,1,0,0,0,0|2,0,1]=4 920 B11R1.13 CSCc1cccc(c1C)C 62a_200000210301_100011515928 [0,1,0,0,0,0|2,0,1]=4 921 B11R1.13 CSCc1cccc(c1C)Cl 62a_100012186920_200000210301 [0,1,0,0,0,0|2,0,1]=4 922 B11R1.13 CSCc1cccc(c1C)Cl 62a_200000210301_100012186920 [0,1,0,0,0,0|2,0,1]=4 923 B11R1.13 CSCc1cccc(c1C)F 62a_100009813626_200000210301 [0,1,0,0,0,0|2,0,1]=4 924 B11R1.13 CSCc1cccc(c1C)F 62a_200000210301_100009813626 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.13 CSCc1cccc(c1C)I 62a_100010150147_200000210301 [0,1,0,0,0,0|2,0,1]=4 926 B11R1.13 CSCc1cccc(c1C)I 62a_200000210301_100010150147 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.13 CSCc1cccc(c1Cl)Br 62a_100012349491_200000210301 [0,1,0,0,0,0|2,0,1]=4 928 B11R1.13 CSCc1cccc(c1Cl)Br 62a_200000210301_100012349491 [0,1,0,0,0,0|2,0,1]=4 929 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_100000720918_200000210301 [0,1,0,0,0,0|2,0,1]=4 930 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_200000210301_100000723366 [0,1,0,0,0,0|2,0,1]=4 931 B11R1.13 CSCc1cccc(c1Cl)F 62a_100000696688_200000210301 [0,1,0,0,0,0|2,0,1]=4 932 B11R1.13 CSCc1cccc(c1Cl)F 62a_200000210301_100000696688 [0,1,0,0,0,0|2,0,1]=4 933 B11R1.13 CSCc1cccc(c1F)Br 62a_100012356506_200000210301 [0,1,0,0,0,0|2,0,1]=4 934 B11R1.13 CSCc1cccc(c1F)Br 62a_200000210301_100012356506 [0,1,0,0,0,0|2,0,1]=4 935 B11R1.13 CSCc1cccc(c1F)C 62a_100011216058_200000210301 [0,1,0,0,0,0|2,0,1]=4 936 B11R1.13 CSCc1cccc(c1F)C 62a_200000210301_100011216058 [0,1,0,0,0,0|2,0,1]=4 937 B11R1.13 CSCc1cccc(c1F)Cl 62a_100000716733_200000210301 [0,1,0,0,0,0|2,0,1]=4 938 B11R1.13 CSCc1cccc(c1F)Cl 62a_200000210301_100000716733 [0,1,0,0,0,0|2,0,1]=4 939 B11R1.13 CSCc1cccc(c1F)F 62a_100000217499_200000210301 [0,1,0,0,0,0|2,0,1]=4 940 B11R1.13 CSCc1cccc(c1F)F 62a_200000210301_100000217499 [0,1,0,0,0,0|2,0,1]=4 941 B11R1.13 CSCc1cccc(c1I)F 62a_100010149603_200000210301 [0,1,0,0,0,0|2,0,1]=4 942 B11R1.13 CSCc1cccc(c1I)F 62a_200000210301_100010149603 [0,1,0,0,0,0|2,0,1]=4 943 B11R1.13 Cc1c(cccc1CC#N)O 271570a_203496583355_100010147028 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.13 Cc1c(cccc1CCN)O 271570a_203496583355_100161000114 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.13 Cc1c(cccc1CN[13CH3])Br 34a_100000724210_200025704644 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 2230a_100020639605_200025704644 [0,1,0,0,0,0|2,0,1]=4 947 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 34a_100020639605_200025704644 [0,1,0,0,0,0|2,0,1]=4 948 B11R1.13 Cc1c(cccc1CN[13CH3])F 2230a_100132306986_200025704644 [0,1,0,0,0,0|2,0,1]=4 949 B11R1.13 Cc1c(cccc1CN[13CH3])F 34a_100132306986_200025704644 [0,1,0,0,0,0|2,0,1]=4 950 B11R1.13 Cc1c(cccc1CO[13CH3])Br 34a_100000694458_200025704644 [0,1,0,0,0,0|2,0,1]=4 951 B11R1.13 Cc1c(cccc1CO[13CH3])Br 7a_100000694458_200025704644 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 34a_100012000165_200025704644 [0,1,0,0,0,0|2,0,1]=4 953 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 7a_100012000165_200025704644 [0,1,0,0,0,0|2,0,1]=4 954 B11R1.13 Cc1c(cccc1CO[13CH3])F 34a_100000042775_200025704644 [0,1,0,0,0,0|2,0,1]=4 955 B11R1.13 Cc1c(cccc1CO[13CH3])F 7a_100000042775_200025704644 [0,1,0,0,0,0|2,0,1]=4 956 B11R1.13 Cc1c(cccc1CO[13CH3])I 34a_100010150139_200025704644 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.13 Cc1c(cccc1CO[13CH3])I 7a_100010150139_200025704644 [0,1,0,0,0,0|2,0,1]=4 958 B11R1.13 Cc1c(cccc1CO[13CH3])N 34a_102495339961_200025704644 [0,1,0,0,0,0|2,0,1]=4 959 B11R1.13 Cc1c(cccc1CO[13CH3])N 7a_102495339961_200025704644 [0,1,0,0,0,0|2,0,1]=4 960 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_100000694682_200025704644 [0,1,0,0,0,0|2,0,1]=4 961 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_200025704644_100000694682 [0,1,0,0,0,0|2,0,1]=4 962 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_100012186920_200025704644 [0,1,0,0,0,0|2,0,1]=4 963 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_200025704644_100012186920 [0,1,0,0,0,0|2,0,1]=4 964 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_100009813626_200025704644 [0,1,0,0,0,0|2,0,1]=4 965 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_200025704644_100009813626 [0,1,0,0,0,0|2,0,1]=4 966 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_100010150147_200025704644 [0,1,0,0,0,0|2,0,1]=4 967 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_200025704644_100010150147 [0,1,0,0,0,0|2,0,1]=4 968 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 34a_100011659289_200025704644 [0,1,0,0,0,0|2,0,1]=4 969 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 7a_100011659289_200025704644 [0,1,0,0,0,0|2,0,1]=4 970 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200012349612_200025704644 [0,1,0,0,0,0|2,0,1]=4 971 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200025704644_200012349612 [0,1,0,0,0,0|2,0,1]=4 972 B11R1.13 Cc1cccc(c1C)CN[13CH3] 2230a_100011211637_200025704644 [0,1,0,0,0,0|2,0,1]=4 973 B11R1.13 Cc1cccc(c1C)CN[13CH3] 34a_100011211637_200025704644 [0,1,0,0,0,0|2,0,1]=4 974 B11R1.13 Cc1cccc(c1C)CO[13CH3] 34a_100011219135_200025704644 [0,1,0,0,0,0|2,0,1]=4 975 B11R1.13 Cc1cccc(c1C)CO[13CH3] 7a_100011219135_200025704644 [0,1,0,0,0,0|2,0,1]=4 976 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_100011515928_200025704644 [0,1,0,0,0,0|2,0,1]=4 977 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_200025704644_100011515928 [0,1,0,0,0,0|2,0,1]=4 978 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 2230a_100025705714_200025704644 [0,1,0,0,0,0|2,0,1]=4 979 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 34a_100025705714_200025704644 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 34a_100000710031_200025704644 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 7a_100000710031_200025704644 [0,1,0,0,0,0|2,0,1]=4 982 B11R1.13 Cc1cccc(c1F)CN[13CH3] 2230a_100012002060_200025704644 [0,1,0,0,0,0|2,0,1]=4 983 B11R1.13 Cc1cccc(c1F)CN[13CH3] 34a_100012002060_200025704644 [0,1,0,0,0,0|2,0,1]=4 984 B11R1.13 Cc1cccc(c1F)CO[13CH3] 34a_200011219517_200025704644 [0,1,0,0,0,0|2,0,1]=4 985 B11R1.13 Cc1cccc(c1F)CO[13CH3] 7a_200011219517_200025704644 [0,1,0,0,0,0|2,0,1]=4 986 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_100011216058_200025704644 [0,1,0,0,0,0|2,0,1]=4 987 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_200025704644_100011216058 [0,1,0,0,0,0|2,0,1]=4 988 B11R1.13 Cc1cccc(c1I)CO[13CH3] 34a_100012349780_200025704644 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.13 Cc1cccc(c1I)CO[13CH3] 7a_100012349780_200025704644 [0,1,0,0,0,0|2,0,1]=4 990 B11R1.13 Cc1cccc(c1N)CO[13CH3] 34a_100011215590_200025704644 [0,1,0,0,0,0|2,0,1]=4 991 B11R1.13 Cc1cccc(c1O)CC#N 271570a_203496583355_100010147024 [0,1,0,0,0,0|1,0,1]=3 992 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [0,1,0,0,0,0|1,0,1]=3 993 B11R1.13 Cc1cccc(c1O)NCF 34a_100000756359_100015361967 [0,1,0,0,0,0|2,0,1]=4 994 B11R1.13 Cc1cccc(c1O)SCF 62a_100009817157_100015361967 [0,1,0,0,0,0|2,0,1]=4 995 B11R1.13 Cc1cccc(c1O)SCF 62a_100015361967_100009817157 [0,1,0,0,0,0|2,0,1]=4 996 B11R1.13 N#CCc1cccc(c1F)O 271570a_203496583355_100009817020 [0,1,0,0,0,0|2,0,1]=4 997 B11R1.13 Nc1cccc(c1O)SCF 62a_100011934915_100015361967 [0,1,0,0,0,0|2,0,1]=4 998 B11R1.13 Nc1cccc(c1O)SCF 62a_100015361967_100010084371 [0,1,0,0,0,0|2,0,1]=4 999 B11R1.13 Oc1c(cccc1NCF)Br 34a_100011934915_100015361967 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.13 Oc1c(cccc1NCF)Cl 34a_100000754742_100015361967 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.13 Oc1c(cccc1NCF)F 34a_100011934987_100015361967 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.13 Oc1c(cccc1SCF)Br 62a_100010084509_100015361967 [0,1,0,0,0,0|2,0,1]=4 1003 B11R1.13 Oc1c(cccc1SCF)Br 62a_100015361967_100010084509 [0,1,0,0,0,0|2,0,1]=4 1004 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100010202889_100015361967 [0,1,0,0,0,0|2,0,1]=4 1005 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100015361967_100010202889 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.13 Oc1c(cccc1SCF)F 62a_100009813666_100015361967 [0,1,0,0,0,0|2,0,1]=4 1007 B11R1.13 Oc1c(cccc1SCF)F 62a_100015361967_100009813666 [0,1,0,0,0,0|2,0,1]=4 1008 B11R1.13 Oc1cccc(c1O)SCF 62a_100015361967_100009815950 [0,1,0,0,0,0|2,0,1]=4 1009 B11R1.13 [13CH3]NCc1cccc(c1Br)F 2230a_100020638964_200025704644 [0,1,0,0,0,0|2,0,1]=4 1010 B11R1.13 [13CH3]NCc1cccc(c1Br)F 34a_100020638964_200025704644 [0,1,0,0,0,0|2,0,1]=4 1011 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 2230a_100011211633_200025704644 [0,1,0,0,0,0|2,0,1]=4 1012 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 34a_100011211633_200025704644 [0,1,0,0,0,0|2,0,1]=4 1013 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 2230a_100012001614_200025704644 [0,1,0,0,0,0|2,0,1]=4 1014 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 34a_100012001614_200025704644 [0,1,0,0,0,0|2,0,1]=4 1015 B11R1.13 [13CH3]NCc1cccc(c1F)Br 2230a_100015189953_200025704644 [0,1,0,0,0,0|2,0,1]=4 1016 B11R1.13 [13CH3]NCc1cccc(c1F)Br 34a_100015189953_200025704644 [0,1,0,0,0,0|2,0,1]=4 1017 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 2230a_100000764326_200025704644 [0,1,0,0,0,0|2,0,1]=4 1018 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 34a_100000764326_200025704644 [0,1,0,0,0,0|2,0,1]=4 1019 B11R1.13 [13CH3]NCc1cccc(c1F)F 2230a_100011199105_200025704644 [0,1,0,0,0,0|2,0,1]=4 1020 B11R1.13 [13CH3]NCc1cccc(c1F)F 34a_100011199105_200025704644 [0,1,0,0,0,0|2,0,1]=4 1021 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [0,1,0,0,0,0|2,0,1]=4 1022 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 34a_100010168166_200025704644 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 7a_100010168166_200025704644 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.13 [13CH3]OCc1cccc(c1Br)F 34a_100012351117_200025704644 [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.13 [13CH3]OCc1cccc(c1Br)F 7a_100012351117_200025704644 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.13 [13CH3]OCc1cccc(c1Br)I 34a_100010240205_200025704644 [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.13 [13CH3]OCc1cccc(c1Br)I 7a_100010240205_200025704644 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 34a_100012351182_200025704644 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 7a_100012351182_200025704644 [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 34a_100000720469_200025704644 [0,1,0,0,0,0|2,0,1]=4 1031 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 7a_100000720469_200025704644 [0,1,0,0,0,0|2,0,1]=4 1032 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 34a_100000696319_200025704644 [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 7a_100000696319_200025704644 [0,1,0,0,0,0|2,0,1]=4 1034 B11R1.13 [13CH3]OCc1cccc(c1F)Br 34a_100011935076_200025704644 [0,1,0,0,0,0|2,0,1]=4 1035 B11R1.13 [13CH3]OCc1cccc(c1F)Br 7a_100011935076_200025704644 [0,1,0,0,0,0|2,0,1]=4 1036 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 34a_100011216988_200025704644 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 7a_100011216988_200025704644 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.13 [13CH3]OCc1cccc(c1F)F 34a_100011218644_200025704644 [0,1,0,0,0,0|2,0,1]=4 1039 B11R1.13 [13CH3]OCc1cccc(c1F)F 7a_100011218644_200025704644 [0,1,0,0,0,0|2,0,1]=4 1040 B11R1.13 [13CH3]OCc1cccc(c1F)I 34a_200010235739_200025704644 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.13 [13CH3]OCc1cccc(c1F)I 7a_200010235739_200025704644 [0,1,0,0,0,0|2,0,1]=4 1042 B11R1.13 [13CH3]OCc1cccc(c1F)N 34a_100012023829_200025704644 [0,1,0,0,0,0|2,0,1]=4 1043 B11R1.13 [13CH3]OCc1cccc(c1I)Br 34a_100010146604_200025704644 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.13 [13CH3]OCc1cccc(c1I)Br 7a_100010146604_200025704644 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.13 [13CH3]OCc1cccc(c1I)F 34a_100000692438_200025704644 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.13 [13CH3]OCc1cccc(c1I)F 7a_100000692438_200025704644 [0,1,0,0,0,0|2,0,1]=4 1047 B11R1.13 [13CH3]OCc1cccc(c1N)Br 34a_100012349457_200025704644 [0,1,0,0,0,0|2,0,1]=4 1048 B11R1.13 [13CH3]OCc1cccc(c1N)Cl 34a_100012182729_200025704644 [0,1,0,0,0,0|2,0,1]=4 1049 B11R1.13 [13CH3]OCc1cccc(c1N)F 34a_100000692437_200025704644 [0,1,0,0,0,0|2,0,1]=4 1050 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_100010145525_200025704644 [0,1,0,0,0,0|2,0,1]=4 1051 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_200025704644_100010145525 [0,1,0,0,0,0|2,0,1]=4 1052 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_100012351116_200025704644 [0,1,0,0,0,0|2,0,1]=4 1053 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_200025704644_100012351116 [0,1,0,0,0,0|2,0,1]=4 1054 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_100010254545_200025704644 [0,1,0,0,0,0|2,0,1]=4 1055 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_200025704644_100010254545 [0,1,0,0,0,0|2,0,1]=4 1056 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_100012349491_200025704644 [0,1,0,0,0,0|2,0,1]=4 1057 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_200025704644_100012349491 [0,1,0,0,0,0|2,0,1]=4 1058 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_100000720918_200025704644 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_200025704644_100000723366 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_100000696688_200025704644 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_200025704644_100000696688 [0,1,0,0,0,0|2,0,1]=4 1062 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_100012356506_200025704644 [0,1,0,0,0,0|2,0,1]=4 1063 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_200025704644_100012356506 [0,1,0,0,0,0|2,0,1]=4 1064 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_100000716733_200025704644 [0,1,0,0,0,0|2,0,1]=4 1065 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_200025704644_100000716733 [0,1,0,0,0,0|2,0,1]=4 1066 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_100000217499_200025704644 [0,1,0,0,0,0|2,0,1]=4 1067 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_200025704644_100000217499 [0,1,0,0,0,0|2,0,1]=4 1068 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_100010149603_200025704644 [0,1,0,0,0,0|2,0,1]=4 1069 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_200025704644_100010149603 [0,1,0,0,0,0|2,0,1]=4 1070 B11R1.17 C#CCNc1ccccc1Br 34a_100000210017_100000184674 [0,1,0,0,0,0|1,0,2]=4 1071 B11R1.17 C#CCNc1ccccc1C 34a_100015192222_100000184674 [0,1,0,0,0,0|1,0,2]=4 1072 B11R1.17 C#CCNc1ccccc1Cl 34a_100000185783_100000184674 [0,1,0,0,0,0|1,0,2]=4 1073 B11R1.17 C#CCNc1ccccc1F 34a_100000210422_100000184674 [0,1,0,0,0,0|1,0,2]=4 1074 B11R1.17 C#CCNc1ccccc1I 34a_100000210053_100000184674 [0,1,0,0,0,0|1,0,2]=4 1075 B11R1.17 C#CCNc1ccccc1O 34a_100000185747_100000184674 [0,1,0,0,0,0|0,0,2]=3 1076 B11R1.17 C#CCOc1ccccc1Br 34a_100000181306_100000184674 [0,1,0,0,0,0|1,0,2]=4 1077 B11R1.17 C#CCOc1ccccc1Br 7a_100000181306_100000038162 [0,1,0,0,0,0|1,0,2]=4 1078 B11R1.17 C#CCOc1ccccc1C 34a_100000210338_100000184674 [0,1,0,0,0,0|1,0,2]=4 1079 B11R1.17 C#CCOc1ccccc1C 7a_100000210338_100000038162 [0,1,0,0,0,0|1,0,2]=4 1080 B11R1.17 C#CCOc1ccccc1Cl 34a_100000210172_100000184674 [0,1,0,0,0,0|1,0,2]=4 1081 B11R1.17 C#CCOc1ccccc1Cl 7a_100000210172_100000038162 [0,1,0,0,0,0|1,0,2]=4 1082 B11R1.17 C#CCOc1ccccc1F 34a_100000210171_100000184674 [0,1,0,0,0,0|1,0,2]=4 1083 B11R1.17 C#CCOc1ccccc1F 7a_100000210171_100000038162 [0,1,0,0,0,0|1,0,2]=4 1084 B11R1.17 C#CCOc1ccccc1I 34a_100000739446_100000184674 [0,1,0,0,0,0|1,0,2]=4 1085 B11R1.17 C#CCOc1ccccc1I 7a_100000739446_100000038162 [0,1,0,0,0,0|1,0,2]=4 1086 B11R1.17 C#CCOc1ccccc1N 34a_100000185747_100000184674 [0,1,0,0,0,0|1,0,2]=4 1087 B11R1.17 C#CCOc1ccccc1N 7a_100000185747_100000038162 [0,1,0,0,0,0|1,0,2]=4 1088 B11R1.17 C#CCSc1ccccc1Br 62a_100000038162_100000695589 [0,1,0,0,0,0|1,0,2]=4 1089 B11R1.17 C#CCSc1ccccc1C 62a_100000038162_100000210755 [0,1,0,0,0,0|1,0,2]=4 1090 B11R1.17 C#CCSc1ccccc1Cl 62a_100000038162_100000764095 [0,1,0,0,0,0|1,0,2]=4 1091 B11R1.17 C#CCSc1ccccc1F 62a_100000038162_100011215700 [0,1,0,0,0,0|1,0,2]=4 1092 B11R1.17 C#CCSc1ccccc1N 62a_100000038162_100000210017 [0,1,0,0,0,0|1,0,2]=4 1093 B11R1.17 C#CCSc1ccccc1O 62a_100000038162_100000739446 [0,1,0,0,0,0|0,0,2]=3 1094 B11R1.17 C#CCSc1cccnc1O 62a_100000038162_100000760158 [0,1,0,0,0,0|1,0,2]=4 1095 B11R1.17 C#CCSc1ccncc1O 62a_100000038162_100009817591 [0,1,0,0,0,0|1,0,2]=4 1096 B11R1.17 C#CCSc1ncccc1O 62a_100000038162_100000034122 [0,1,0,0,0,0|1,0,2]=4 1097 B11R1.17 C=CCNc1ccccc1Br 34a_100000210017_100015514636 [0,1,0,0,0,0|1,0,0]=2 1098 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [0,1,0,0,0,0|1,0,0]=2 1099 B11R1.17 C=CCNc1ccccc1Cl 34a_100000185783_100015514636 [0,1,0,0,0,0|1,0,0]=2 1100 B11R1.17 C=CCNc1ccccc1F 34a_100000210422_100015514636 [0,1,0,0,0,0|1,0,0]=2 1101 B11R1.17 C=CCNc1ccccc1I 34a_100000210053_100015514636 [0,1,0,0,0,0|1,0,0]=2 1102 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [0,1,0,0,0,0|0,0,0]=1 1103 B11R1.17 C=CCNc1ccn[nH]c1=O 27a_100020586998_100000087129 [0,1,0,0,0,0|2,0,1]=4 1104 B11R1.17 C=CCNc1ccncc1Br 27a_100020586998_100000726257 [0,1,0,0,0,0|2,0,0]=3 1105 B11R1.17 C=CCNc1ccncc1C 27a_100020586998_100000765111 [0,1,0,0,0,0|2,0,0]=3 1106 B11R1.17 C=CCNc1ccncc1F 27a_100020586998_100000035921 [0,1,0,0,0,0|2,0,0]=3 1107 B11R1.17 C=CCNc1ncccc1Br 27a_100020586998_100000696092 [0,1,0,0,0,0|2,0,0]=3 1108 B11R1.17 C=CCNc1nccnc1C 27a_100020586998_100011999405 [0,1,0,0,0,0|3,0,0]=4 1109 B11R1.17 C=CCNc1nccnc1F 27a_100020586998_200010125657 [0,1,0,0,0,0|3,0,0]=4 1110 B11R1.17 C=CCNc1ncncc1C 27a_100020586998_100011998708 [0,1,0,0,0,0|3,0,0]=4 1111 B11R1.17 C=CCNc1ncncc1F 27a_100020586998_100000069762 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.17 C=CCNc1ncncc1N 27a_100020586998_100000709731 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.17 C=CCNc1nnccc1C 27a_100020586998_100000089043 [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.17 C=CCOc1cccc[n+]1[O-] 7a_100000211761_100015514636 [0,1,0,0,0,0|1,0,1]=3 1115 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [0,1,0,0,0,0|1,0,0]=2 1116 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [0,1,0,0,0,0|1,0,0]=2 1117 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [0,1,0,0,0,0|1,0,0]=2 1118 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [0,1,0,0,0,0|1,0,0]=2 1119 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [0,1,0,0,0,0|1,0,0]=2 1120 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [0,1,0,0,0,0|1,0,0]=2 1121 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [0,1,0,0,0,0|1,0,0]=2 1122 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [0,1,0,0,0,0|1,0,0]=2 1123 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [0,1,0,0,0,0|1,0,0]=2 1124 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [0,1,0,0,0,0|1,0,0]=2 1125 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,1,0,0,0,0|1,0,0]=2 1126 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,1,0,0,0,0|1,0,0]=2 1127 B11R1.17 C=CCOc1cccnc1Br 34a_100000744436_100015514636 [0,1,0,0,0,0|2,0,0]=3 1128 B11R1.17 C=CCOc1cccnc1Br 7a_100000744436_100015514636 [0,1,0,0,0,0|2,0,0]=3 1129 B11R1.17 C=CCOc1cccnc1C 34a_100000745507_100015514636 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.17 C=CCOc1cccnc1C 7a_100000745507_100015514636 [0,1,0,0,0,0|2,0,0]=3 1131 B11R1.17 C=CCOc1cccnc1Cl 34a_100000757616_100015514636 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.17 C=CCOc1cccnc1Cl 7a_100000757616_100015514636 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.17 C=CCOc1cccnc1F 34a_100000061740_100015514636 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.17 C=CCOc1cccnc1F 7a_100000061740_100015514636 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.17 C=CCOc1cccnc1I 34a_100000034122_100015514636 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.17 C=CCOc1cccnc1I 7a_100000034122_100015514636 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.17 C=CCOc1cccnc1N 34a_100000211975_100015514636 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.17 C=CCOc1cccnc1N 7a_100000211975_100015514636 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.17 C=CCOc1cccoc1=O 34a_100000077404_100015514636 [0,1,0,0,0,0|1,0,1]=3 1140 B11R1.17 C=CCOc1cccoc1=O 7a_100000077404_100015514636 [0,1,0,0,0,0|1,0,1]=3 1141 B11R1.17 C=CCOc1ccncc1Br 34a_100011996408_100015514636 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.17 C=CCOc1ccncc1C 34a_100000694293_100015514636 [0,1,0,0,0,0|2,0,0]=3 1143 B11R1.17 C=CCOc1ccncc1Cl 34a_100011997054_100015514636 [0,1,0,0,0,0|2,0,0]=3 1144 B11R1.17 C=CCOc1ccncc1F 34a_200000081243_100015514636 [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.17 C=CCOc1cnccc1C 34a_100011997053_100015514636 [0,1,0,0,0,0|2,0,0]=3 1146 B11R1.17 C=CCOc1cnccc1C 7a_100011997053_100015514636 [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.17 C=CCOc1cnccc1Cl 34a_100011996695_100015514636 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.17 C=CCOc1cnccc1I 34a_100000050107_100015514636 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.17 C=CCOc1cnccc1N 34a_100000753702_100015514636 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.17 C=CCOc1cncnc1N 7a_100000112926_100015514636 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.17 C=CCOc1coccc1=O 34a_100000060831_100015514636 [0,1,0,0,0,0|1,0,1]=3 1152 B11R1.17 C=CCOc1ncccc1Cl 34a_100011290957_100015514636 [0,1,0,0,0,0|2,0,0]=3 1153 B11R1.17 C=CCOc1ncccc1F 34a_100011219419_100015514636 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.17 C=CCOc1ncccc1N 34a_100000746358_100015514636 [0,1,0,0,0,0|2,0,0]=3 1155 B11R1.17 C=CCOc1nccnc1C 34a_100000766352_100015514636 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.17 C=CCSc1c[nH]ccc1=O 62a_100000210623_100009998708 [0,1,0,0,0,0|1,0,1]=3 1157 B11R1.17 C=CCSc1c[nH]ccc1=O 62a_100009998708_100000210623 [0,1,0,0,0,0|1,0,1]=3 1158 B11R1.17 C=CCSc1c[nH]ccc1=S 62a_100000210623_200012280681 [0,1,0,0,0,0|1,1,0]=3 1159 B11R1.17 C=CCSc1c[nH]ccc1=S 62a_200012280681_100000210623 [0,1,0,0,0,0|1,1,0]=3 1160 B11R1.17 C=CCSc1cccc[n+]1C 62a_100000210623_100000212160 [0,1,0,0,0,0|2,0,0]=3 1161 B11R1.17 C=CCSc1cccc[n+]1[O-] 62a_100000210623_200000042595 [0,1,0,0,0,0|1,0,1]=3 1162 B11R1.17 C=CCSc1ccccc1Br 62a_100000210623_100000695589 [0,1,0,0,0,0|1,0,0]=2 1163 B11R1.17 C=CCSc1ccccc1Br 62a_100000695589_100000210623 [0,1,0,0,0,0|1,0,0]=2 1164 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [0,1,0,0,0,0|1,0,0]=2 1165 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [0,1,0,0,0,0|1,0,0]=2 1166 B11R1.17 C=CCSc1ccccc1Cl 62a_100000210623_100000764095 [0,1,0,0,0,0|1,0,0]=2 1167 B11R1.17 C=CCSc1ccccc1Cl 62a_100000764095_100000210623 [0,1,0,0,0,0|1,0,0]=2 1168 B11R1.17 C=CCSc1ccccc1F 62a_100000210623_100011215700 [0,1,0,0,0,0|1,0,0]=2 1169 B11R1.17 C=CCSc1ccccc1F 62a_100011215700_100000210623 [0,1,0,0,0,0|1,0,0]=2 1170 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [0,1,0,0,0,0|1,0,0]=2 1171 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [0,1,0,0,0,0|1,0,0]=2 1172 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [0,1,0,0,0,0|0,0,0]=1 1173 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [0,1,0,0,0,0|0,0,0]=1 1174 B11R1.17 C=CCSc1cccnc1Br 62a_100000210623_100010202626 [0,1,0,0,0,0|2,0,0]=3 1175 B11R1.17 C=CCSc1cccnc1Br 62a_100010202626_100000210623 [0,1,0,0,0,0|2,0,0]=3 1176 B11R1.17 C=CCSc1cccnc1C 62a_100000210623_100000751574 [0,1,0,0,0,0|2,0,0]=3 1177 B11R1.17 C=CCSc1cccnc1C 62a_100000751574_100000210623 [0,1,0,0,0,0|2,0,0]=3 1178 B11R1.17 C=CCSc1cccnc1Cl 62a_100000036424_100000210623 [0,1,0,0,0,0|2,0,0]=3 1179 B11R1.17 C=CCSc1cccnc1Cl 62a_100000210623_100000036424 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.17 C=CCSc1cccnc1F 62a_100000210623_100009816115 [0,1,0,0,0,0|2,0,0]=3 1181 B11R1.17 C=CCSc1cccnc1F 62a_100009816115_100000210623 [0,1,0,0,0,0|2,0,0]=3 1182 B11R1.17 C=CCSc1cccnc1N 62a_100000045569_100000210623 [0,1,0,0,0,0|2,0,0]=3 1183 B11R1.17 C=CCSc1cccnc1N 62a_100000210623_100000045569 [0,1,0,0,0,0|2,0,0]=3 1184 B11R1.17 C=CCSc1cccnc1O 62a_100000210623_100000760158 [0,1,0,0,0,0|1,0,0]=2 1185 B11R1.17 C=CCSc1cccnc1O 62a_100000760158_100000210623 [0,1,0,0,0,0|1,0,0]=2 1186 B11R1.17 C=CCSc1ccn[nH]c1=O 62a_100000210623_100000087129 [0,1,0,0,0,0|2,0,1]=4 1187 B11R1.17 C=CCSc1ccncc1Br 62a_100000210623_100000726257 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.17 C=CCSc1ccncc1Br 62a_100000726257_100000210623 [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.17 C=CCSc1ccncc1C 62a_100000210623_100000765111 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.17 C=CCSc1ccncc1C 62a_100000765111_100000210623 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.17 C=CCSc1ccncc1Cl 62a_100000210623_100000708259 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.17 C=CCSc1ccncc1Cl 62a_100000708259_100000210623 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.17 C=CCSc1ccncc1F 62a_100000047030_100000210623 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.17 C=CCSc1ccncc1F 62a_100000210623_100000047030 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.17 C=CCSc1ccncc1N 62a_100000210623_100000756074 [0,1,0,0,0,0|2,0,0]=3 1196 B11R1.17 C=CCSc1ccncc1N 62a_100000756074_100000210623 [0,1,0,0,0,0|2,0,0]=3 1197 B11R1.17 C=CCSc1ccncc1O 62a_100000210623_100009817591 [0,1,0,0,0,0|1,0,0]=2 1198 B11R1.17 C=CCSc1ccncc1O 62a_100009817591_100000210623 [0,1,0,0,0,0|1,0,0]=2 1199 B11R1.17 C=CCSc1cnccc1Br 62a_100000210623_100010138639 [0,1,0,0,0,0|2,0,0]=3 1200 B11R1.17 C=CCSc1cnccc1Br 62a_100010138639_100000210623 [0,1,0,0,0,0|2,0,0]=3 1201 B11R1.17 C=CCSc1cnccc1C 62a_100000210623_100000761580 [0,1,0,0,0,0|2,0,0]=3 1202 B11R1.17 C=CCSc1cnccc1C 62a_100000761580_100000210623 [0,1,0,0,0,0|2,0,0]=3 1203 B11R1.17 C=CCSc1cnccc1Cl 62a_100000210623_100009995489 [0,1,0,0,0,0|2,0,0]=3 1204 B11R1.17 C=CCSc1cnccc1Cl 62a_100009995489_100000210623 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.17 C=CCSc1cnccc1F 62a_100000210623_100009820683 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.17 C=CCSc1cnccc1F 62a_100009820683_100000210623 [0,1,0,0,0,0|2,0,0]=3 1207 B11R1.17 C=CCSc1cnccc1N 62a_100000047001_100000210623 [0,1,0,0,0,0|2,0,0]=3 1208 B11R1.17 C=CCSc1cnccc1N 62a_100000210623_100000047001 [0,1,0,0,0,0|2,0,0]=3 1209 B11R1.17 C=CCSc1cncnc1Br 62a_100000210623_200012461658 [0,1,0,0,0,0|3,0,0]=4 1210 B11R1.17 C=CCSc1cncnc1Br 62a_200012461658_100000210623 [0,1,0,0,0,0|3,0,0]=4 1211 B11R1.17 C=CCSc1cncnc1C 62a_100000210623_100009819671 [0,1,0,0,0,0|3,0,0]=4 1212 B11R1.17 C=CCSc1cncnc1C 62a_100009819671_100000210623 [0,1,0,0,0,0|3,0,0]=4 1213 B11R1.17 C=CCSc1cncnc1Cl 62a_100000210623_100000758962 [0,1,0,0,0,0|3,0,0]=4 1214 B11R1.17 C=CCSc1cncnc1Cl 62a_100000758962_100000210623 [0,1,0,0,0,0|3,0,0]=4 1215 B11R1.17 C=CCSc1cncnc1N 62a_100000210623_100011996079 [0,1,0,0,0,0|3,0,0]=4 1216 B11R1.17 C=CCSc1cncnc1N 62a_100011996079_100000210623 [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.17 C=CCSc1cncnc1O 62a_100000210623_100000751107 [0,1,0,0,0,0|2,0,0]=3 1218 B11R1.17 C=CCSc1cncnc1O 62a_100000751107_100000210623 [0,1,0,0,0,0|2,0,0]=3 1219 B11R1.17 C=CCSc1cnncc1N 62a_100000210623_100009829405 [0,1,0,0,0,0|3,0,0]=4 1220 B11R1.17 C=CCSc1cnncc1N 62a_100009829405_100000210623 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.17 C=CCSc1ncc[nH]c1=O 62a_100000210623_100000763361 [0,1,0,0,0,0|2,0,1]=4 1222 B11R1.17 C=CCSc1ncccc1Br 62a_100000210623_100000696092 [0,1,0,0,0,0|2,0,0]=3 1223 B11R1.17 C=CCSc1ncccc1Br 62a_100000696092_100000210623 [0,1,0,0,0,0|2,0,0]=3 1224 B11R1.17 C=CCSc1ncccc1C 62a_100000210623_100000751373 [0,1,0,0,0,0|2,0,0]=3 1225 B11R1.17 C=CCSc1ncccc1C 62a_100000751373_100000210623 [0,1,0,0,0,0|2,0,0]=3 1226 B11R1.17 C=CCSc1ncccc1Cl 62a_100000210623_100011356963 [0,1,0,0,0,0|2,0,0]=3 1227 B11R1.17 C=CCSc1ncccc1Cl 62a_100011356963_100000210623 [0,1,0,0,0,0|2,0,0]=3 1228 B11R1.17 C=CCSc1ncccc1F 62a_100000210623_100000685392 [0,1,0,0,0,0|2,0,0]=3 1229 B11R1.17 C=CCSc1ncccc1F 62a_100000685392_100000210623 [0,1,0,0,0,0|2,0,0]=3 1230 B11R1.17 C=CCSc1ncccc1N 62a_100000210623_100000688686 [0,1,0,0,0,0|2,0,0]=3 1231 B11R1.17 C=CCSc1ncccc1N 62a_100000688686_100000210623 [0,1,0,0,0,0|2,0,0]=3 1232 B11R1.17 C=CCSc1ncccc1O 62a_100000034122_100000210623 [0,1,0,0,0,0|1,0,0]=2 1233 B11R1.17 C=CCSc1ncccc1O 62a_100000210623_100000034122 [0,1,0,0,0,0|1,0,0]=2 1234 B11R1.17 C=CCSc1nccnc1C 62a_100000210623_100011999405 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.17 C=CCSc1nccnc1C 62a_100011999405_100000210623 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.17 C=CCSc1nccnc1Cl 62a_100000210623_100010886584 [0,1,0,0,0,0|3,0,0]=4 1237 B11R1.17 C=CCSc1nccnc1Cl 62a_100010886584_100000210623 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.17 C=CCSc1nccnc1F 62a_100000210623_200010125657 [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.17 C=CCSc1nccnc1F 62a_200010125657_100000210623 [0,1,0,0,0,0|3,0,0]=4 1240 B11R1.17 C=CCSc1nccnc1N 62a_100000210623_100000747729 [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.17 C=CCSc1nccnc1N 62a_100000747729_100000210623 [0,1,0,0,0,0|3,0,0]=4 1242 B11R1.17 C=CCSc1ncncc1C 62a_100000210623_100011998708 [0,1,0,0,0,0|3,0,0]=4 1243 B11R1.17 C=CCSc1ncncc1C 62a_100011998708_100000210623 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.17 C=CCSc1ncncc1F 62a_100000069762_100000210623 [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.17 C=CCSc1ncncc1F 62a_100000210623_100000069762 [0,1,0,0,0,0|3,0,0]=4 1246 B11R1.17 C=CCSc1ncncc1N 62a_100000210623_100000709731 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.17 C=CCSc1ncncc1N 62a_100000709731_100000210623 [0,1,0,0,0,0|3,0,0]=4 1248 B11R1.17 C=CCSc1nnccc1C 62a_100000210623_100000089043 [0,1,0,0,0,0|3,0,0]=4 1249 B11R1.17 CC=NNc1ccccc1Br 4a_100000241748_200000210099 [0,1,0,0,0,0|2,0,1]=4 1250 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [0,1,0,0,0,0|2,0,1]=4 1251 B11R1.17 CC=NNc1ccccc1Cl 4a_100000683529_200000210099 [0,1,0,0,0,0|2,0,1]=4 1252 B11R1.17 CC=NNc1ccccc1F 4a_100000239246_200000210099 [0,1,0,0,0,0|2,0,1]=4 1253 B11R1.17 CC=NNc1ccccc1I 4a_100011218156_200000210099 [0,1,0,0,0,0|2,0,1]=4 1254 B11R1.17 CCCCc1ccccc1Br 271570a_100020621405_100000695589 [0,1,0,0,0,0|1,0,2]=4 1255 B11R1.17 CCCCc1ccccc1C 271570a_100020621405_100000210755 [0,1,0,0,0,0|1,0,2]=4 1256 B11R1.17 CCCCc1ccccc1Cl 271570a_100020621405_100000764095 [0,1,0,0,0,0|1,0,2]=4 1257 B11R1.17 CCCCc1ccccc1F 271570a_100020621405_100011215700 [0,1,0,0,0,0|1,0,2]=4 1258 B11R1.17 CCCCc1ccccc1N 271570a_100020621405_100000210017 [0,1,0,0,0,0|1,0,2]=4 1259 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [0,1,0,0,0,0|0,0,2]=3 1260 B11R1.17 CCCCc1ccncc1O 271570a_100020621405_100009817591 [0,1,0,0,0,0|1,0,2]=4 1261 B11R1.17 CCCCc1ncccc1O 271570a_100020621405_100000034122 [0,1,0,0,0,0|1,0,2]=4 1262 B11R1.17 CCCNc1ccccc1Br 34a_100000210017_100000210303 [0,1,0,0,0,0|1,0,2]=4 1263 B11R1.17 CCCNc1ccccc1C 34a_100015192222_100000210303 [0,1,0,0,0,0|1,0,2]=4 1264 B11R1.17 CCCNc1ccccc1Cl 34a_100000185783_100000210303 [0,1,0,0,0,0|1,0,2]=4 1265 B11R1.17 CCCNc1ccccc1F 34a_100000210422_100000210303 [0,1,0,0,0,0|1,0,2]=4 1266 B11R1.17 CCCNc1ccccc1I 34a_100000210053_100000210303 [0,1,0,0,0,0|1,0,2]=4 1267 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [0,1,0,0,0,0|0,0,2]=3 1268 B11R1.17 CCCOc1ccccc1Br 34a_100000181306_100000210303 [0,1,0,0,0,0|1,0,2]=4 1269 B11R1.17 CCCOc1ccccc1Br 7a_100000181306_100000210303 [0,1,0,0,0,0|1,0,2]=4 1270 B11R1.17 CCCOc1ccccc1C 34a_100000210338_100000210303 [0,1,0,0,0,0|1,0,2]=4 1271 B11R1.17 CCCOc1ccccc1C 7a_100000210338_100000210303 [0,1,0,0,0,0|1,0,2]=4 1272 B11R1.17 CCCOc1ccccc1Cl 34a_100000210172_100000210303 [0,1,0,0,0,0|1,0,2]=4 1273 B11R1.17 CCCOc1ccccc1Cl 7a_100000210172_100000210303 [0,1,0,0,0,0|1,0,2]=4 1274 B11R1.17 CCCOc1ccccc1F 34a_100000210171_100000210303 [0,1,0,0,0,0|1,0,2]=4 1275 B11R1.17 CCCOc1ccccc1F 7a_100000210171_100000210303 [0,1,0,0,0,0|1,0,2]=4 1276 B11R1.17 CCCOc1ccccc1I 34a_100000739446_100000210303 [0,1,0,0,0,0|1,0,2]=4 1277 B11R1.17 CCCOc1ccccc1I 7a_100000739446_100000210303 [0,1,0,0,0,0|1,0,2]=4 1278 B11R1.17 CCCOc1ccccc1N 34a_100000185747_100000210303 [0,1,0,0,0,0|1,0,2]=4 1279 B11R1.17 CCCOc1ccccc1N 7a_100000185747_100000210303 [0,1,0,0,0,0|1,0,2]=4 1280 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [0,1,0,0,0,0|0,0,2]=3 1281 B11R1.17 CCCOc1ncccc1O 271570a_203496583355_200011465209 [0,1,0,0,0,0|1,0,2]=4 1282 B11R1.17 CCCSc1ccccc1Br 62a_100000210303_100000695589 [0,1,0,0,0,0|1,0,2]=4 1283 B11R1.17 CCCSc1ccccc1Br 62a_100000695589_100000210303 [0,1,0,0,0,0|1,0,2]=4 1284 B11R1.17 CCCSc1ccccc1C 62a_100000210303_100000210755 [0,1,0,0,0,0|1,0,2]=4 1285 B11R1.17 CCCSc1ccccc1C 62a_100000210755_100000210303 [0,1,0,0,0,0|1,0,2]=4 1286 B11R1.17 CCCSc1ccccc1Cl 62a_100000210303_100000764095 [0,1,0,0,0,0|1,0,2]=4 1287 B11R1.17 CCCSc1ccccc1Cl 62a_100000764095_100000210303 [0,1,0,0,0,0|1,0,2]=4 1288 B11R1.17 CCCSc1ccccc1F 62a_100000210303_100011215700 [0,1,0,0,0,0|1,0,2]=4 1289 B11R1.17 CCCSc1ccccc1F 62a_100011215700_100000210303 [0,1,0,0,0,0|1,0,2]=4 1290 B11R1.17 CCCSc1ccccc1N 62a_100000210017_100000210303 [0,1,0,0,0,0|1,0,2]=4 1291 B11R1.17 CCCSc1ccccc1N 62a_100000210303_100000210017 [0,1,0,0,0,0|1,0,2]=4 1292 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [0,1,0,0,0,0|0,0,2]=3 1293 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [0,1,0,0,0,0|0,0,2]=3 1294 B11R1.17 CCCSc1cccnc1O 62a_100000210303_100000760158 [0,1,0,0,0,0|1,0,2]=4 1295 B11R1.17 CCCSc1cccnc1O 62a_100000760158_100000210303 [0,1,0,0,0,0|1,0,2]=4 1296 B11R1.17 CCCSc1ccncc1O 62a_100000210303_100009817591 [0,1,0,0,0,0|1,0,2]=4 1297 B11R1.17 CCCSc1ccncc1O 62a_100009817591_100000210303 [0,1,0,0,0,0|1,0,2]=4 1298 B11R1.17 CCCSc1ncccc1O 62a_100000034122_100000210303 [0,1,0,0,0,0|1,0,2]=4 1299 B11R1.17 CCCSc1ncccc1O 62a_100000210303_100000034122 [0,1,0,0,0,0|1,0,2]=4 1300 B11R1.17 CCNCc1ccccc1Br 207a_100015525214_100000211189 [0,1,0,0,0,0|1,0,2]=4 1301 B11R1.17 CCNCc1ccccc1Br 2230a_100000689332_100000210202 [0,1,0,0,0,0|1,0,2]=4 1302 B11R1.17 CCNCc1ccccc1Br 2230a_100015525214_100000184730 [0,1,0,0,0,0|1,0,2]=4 1303 B11R1.17 CCNCc1ccccc1Br 270004a_100015525214_100000211189 [0,1,0,0,0,0|1,0,2]=4 1304 B11R1.17 CCNCc1ccccc1Br 34a_100000689332_100000210202 [0,1,0,0,0,0|1,0,2]=4 1305 B11R1.17 CCNCc1ccccc1C 207a_100015525214_100000211143 [0,1,0,0,0,0|1,0,2]=4 1306 B11R1.17 CCNCc1ccccc1C 2230a_100015525214_100000211839 [0,1,0,0,0,0|1,0,2]=4 1307 B11R1.17 CCNCc1ccccc1C 270004a_100015525214_100000211143 [0,1,0,0,0,0|1,0,2]=4 1308 B11R1.17 CCNCc1ccccc1C 34a_100000174972_100000210202 [0,1,0,0,0,0|1,0,2]=4 1309 B11R1.17 CCNCc1ccccc1Cl 207a_100015525214_100000210073 [0,1,0,0,0,0|1,0,2]=4 1310 B11R1.17 CCNCc1ccccc1Cl 2230a_100000174879_100000210202 [0,1,0,0,0,0|1,0,2]=4 1311 B11R1.17 CCNCc1ccccc1Cl 2230a_100015525214_100000187162 [0,1,0,0,0,0|1,0,2]=4 1312 B11R1.17 CCNCc1ccccc1Cl 270004a_100015525214_100000210073 [0,1,0,0,0,0|1,0,2]=4 1313 B11R1.17 CCNCc1ccccc1Cl 34a_100000174879_100000210202 [0,1,0,0,0,0|1,0,2]=4 1314 B11R1.17 CCNCc1ccccc1F 207a_100015525214_100000210811 [0,1,0,0,0,0|1,0,2]=4 1315 B11R1.17 CCNCc1ccccc1F 2230a_100015525214_100000211605 [0,1,0,0,0,0|1,0,2]=4 1316 B11R1.17 CCNCc1ccccc1F 270004a_100015525214_100000210811 [0,1,0,0,0,0|1,0,2]=4 1317 B11R1.17 CCNCc1ccccc1F 34a_100000174869_100000210202 [0,1,0,0,0,0|1,0,2]=4 1318 B11R1.17 CCNCc1ccccc1I 207a_100015525214_100000010305 [0,1,0,0,0,0|1,0,2]=4 1319 B11R1.17 CCNCc1ccccc1I 2230a_100015525214_100011215278 [0,1,0,0,0,0|1,0,2]=4 1320 B11R1.17 CCNCc1ccccc1I 270004a_100015525214_100000010305 [0,1,0,0,0,0|1,0,2]=4 1321 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [0,1,0,0,0,0|0,0,2]=3 1322 B11R1.17 CCNCc1cccnc1O 207a_100015525214_100011998315 [0,1,0,0,0,0|1,0,2]=4 1323 B11R1.17 CCNCc1cccnc1O 270004a_100015525214_100011998315 [0,1,0,0,0,0|1,0,2]=4 1324 B11R1.17 CCOCc1ccccc1Br 34a_100000756307_100000210202 [0,1,0,0,0,0|1,0,2]=4 1325 B11R1.17 CCOCc1ccccc1Br 34a_100121572206_100000184730 [0,1,0,0,0,0|1,0,2]=4 1326 B11R1.17 CCOCc1ccccc1Br 7a_100000756307_100000210202 [0,1,0,0,0,0|1,0,2]=4 1327 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [0,1,0,0,0,0|1,0,2]=4 1328 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [0,1,0,0,0,0|1,0,2]=4 1329 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [0,1,0,0,0,0|1,0,2]=4 1330 B11R1.17 CCOCc1ccccc1Cl 34a_100000210847_100000210202 [0,1,0,0,0,0|1,0,2]=4 1331 B11R1.17 CCOCc1ccccc1Cl 34a_100121572206_100000187162 [0,1,0,0,0,0|1,0,2]=4 1332 B11R1.17 CCOCc1ccccc1Cl 7a_100000210847_100000210202 [0,1,0,0,0,0|1,0,2]=4 1333 B11R1.17 CCOCc1ccccc1F 34a_100000211962_100000210202 [0,1,0,0,0,0|1,0,2]=4 1334 B11R1.17 CCOCc1ccccc1F 34a_100121572206_100000211605 [0,1,0,0,0,0|1,0,2]=4 1335 B11R1.17 CCOCc1ccccc1F 7a_100000211962_100000210202 [0,1,0,0,0,0|1,0,2]=4 1336 B11R1.17 CCOCc1ccccc1I 34a_100000187465_100000210202 [0,1,0,0,0,0|1,0,2]=4 1337 B11R1.17 CCOCc1ccccc1I 34a_100121572206_100011215278 [0,1,0,0,0,0|1,0,2]=4 1338 B11R1.17 CCOCc1ccccc1I 7a_100000187465_100000210202 [0,1,0,0,0,0|1,0,2]=4 1339 B11R1.17 CCOCc1ccccc1N 34a_100000212039_100000210202 [0,1,0,0,0,0|1,0,2]=4 1340 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [0,1,0,0,0,0|0,0,2]=3 1341 B11R1.17 CCOCc1ncccc1O 34a_100121572206_200020655725 [0,1,0,0,0,0|1,0,2]=4 1342 B11R1.17 CCSCc1ccccc1Br 62a_100000184730_100000210202 [0,1,0,0,0,0|1,0,2]=4 1343 B11R1.17 CCSCc1ccccc1Br 62a_100000210202_100000184730 [0,1,0,0,0,0|1,0,2]=4 1344 B11R1.17 CCSCc1ccccc1C 62a_100000210202_100000211839 [0,1,0,0,0,0|1,0,2]=4 1345 B11R1.17 CCSCc1ccccc1C 62a_100000211839_100000210202 [0,1,0,0,0,0|1,0,2]=4 1346 B11R1.17 CCSCc1ccccc1Cl 62a_100000187162_100000210202 [0,1,0,0,0,0|1,0,2]=4 1347 B11R1.17 CCSCc1ccccc1Cl 62a_100000210202_100000187162 [0,1,0,0,0,0|1,0,2]=4 1348 B11R1.17 CCSCc1ccccc1F 62a_100000210202_100000211605 [0,1,0,0,0,0|1,0,2]=4 1349 B11R1.17 CCSCc1ccccc1F 62a_100000211605_100000210202 [0,1,0,0,0,0|1,0,2]=4 1350 B11R1.17 CCSCc1ccccc1I 62a_100000210202_100011216222 [0,1,0,0,0,0|1,0,2]=4 1351 B11R1.17 CCSCc1ccccc1I 62a_100011216222_100000210202 [0,1,0,0,0,0|1,0,2]=4 1352 B11R1.17 CCSCc1ccccc1O 271570a_203496583355_200000173030 [0,1,0,0,0,0|0,0,2]=3 1353 B11R1.17 CCSCc1ncccc1O 62a_100000210202_200020655725 [0,1,0,0,0,0|1,0,2]=4 1354 B11R1.17 CCSCc1ncccc1O 62a_200020655725_100000210202 [0,1,0,0,0,0|1,0,2]=4 1355 B11R1.17 CNCCc1ccccc1Br 2230a_100000747383_200000210301 [0,1,0,0,0,0|1,0,2]=4 1356 B11R1.17 CNCCc1ccccc1Br 2230a_106832991635_100012161201 [0,1,0,0,0,0|1,0,2]=4 1357 B11R1.17 CNCCc1ccccc1Br 34a_100000747383_200000210301 [0,1,0,0,0,0|1,0,2]=4 1358 B11R1.17 CNCCc1ccccc1Br 34a_100102657272_100012161201 [0,1,0,0,0,0|1,0,2]=4 1359 B11R1.17 CNCCc1ccccc1Br 7a_106832991635_100012161201 [0,1,0,0,0,0|1,0,2]=4 1360 B11R1.17 CNCCc1ccccc1C 2230a_100000685071_200000210301 [0,1,0,0,0,0|1,0,2]=4 1361 B11R1.17 CNCCc1ccccc1C 2230a_106832991635_100011713688 [0,1,0,0,0,0|1,0,2]=4 1362 B11R1.17 CNCCc1ccccc1C 34a_100000685071_200000210301 [0,1,0,0,0,0|1,0,2]=4 1363 B11R1.17 CNCCc1ccccc1C 34a_100102657272_100011713688 [0,1,0,0,0,0|1,0,2]=4 1364 B11R1.17 CNCCc1ccccc1C 7a_106832991635_100011713688 [0,1,0,0,0,0|1,0,2]=4 1365 B11R1.17 CNCCc1ccccc1Cl 2230a_100011207228_200000210301 [0,1,0,0,0,0|1,0,2]=4 1366 B11R1.17 CNCCc1ccccc1Cl 2230a_106832991635_100011713703 [0,1,0,0,0,0|1,0,2]=4 1367 B11R1.17 CNCCc1ccccc1Cl 270004a_106832991635_200011713468 [0,1,0,0,0,0|1,0,2]=4 1368 B11R1.17 CNCCc1ccccc1Cl 34a_100011207228_200000210301 [0,1,0,0,0,0|1,0,2]=4 1369 B11R1.17 CNCCc1ccccc1Cl 34a_100102657272_100011713703 [0,1,0,0,0,0|1,0,2]=4 1370 B11R1.17 CNCCc1ccccc1Cl 7a_106832991635_100011713703 [0,1,0,0,0,0|1,0,2]=4 1371 B11R1.17 CNCCc1ccccc1F 2230a_100000185272_200000210301 [0,1,0,0,0,0|1,0,2]=4 1372 B11R1.17 CNCCc1ccccc1F 2230a_106832991635_100011713696 [0,1,0,0,0,0|1,0,2]=4 1373 B11R1.17 CNCCc1ccccc1F 34a_100000185272_200000210301 [0,1,0,0,0,0|1,0,2]=4 1374 B11R1.17 CNCCc1ccccc1F 34a_100102657272_100000720011 [0,1,0,0,0,0|1,0,2]=4 1375 B11R1.17 CNCCc1ccccc1F 7a_106832991635_100000720011 [0,1,0,0,0,0|1,0,2]=4 1376 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [0,1,0,0,0,0|0,0,2]=3 1377 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [0,1,0,0,0,0|0,0,2]=3 1378 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [0,1,0,0,0,0|0,0,2]=3 1379 B11R1.17 COCCc1ccccc1Br 34a_100000731337_200000210301 [0,1,0,0,0,0|1,0,2]=4 1380 B11R1.17 COCCc1ccccc1Br 34a_100138415774_100012161201 [0,1,0,0,0,0|1,0,2]=4 1381 B11R1.17 COCCc1ccccc1Br 7a_100000731337_200000210301 [0,1,0,0,0,0|1,0,2]=4 1382 B11R1.17 COCCc1ccccc1C 34a_100011220023_200000210301 [0,1,0,0,0,0|1,0,2]=4 1383 B11R1.17 COCCc1ccccc1C 34a_100138415774_100011713688 [0,1,0,0,0,0|1,0,2]=4 1384 B11R1.17 COCCc1ccccc1C 7a_100011220023_200000210301 [0,1,0,0,0,0|1,0,2]=4 1385 B11R1.17 COCCc1ccccc1Cl 34a_100011215284_200000210301 [0,1,0,0,0,0|1,0,2]=4 1386 B11R1.17 COCCc1ccccc1Cl 34a_100138415774_100011713703 [0,1,0,0,0,0|1,0,2]=4 1387 B11R1.17 COCCc1ccccc1Cl 7a_100011215284_200000210301 [0,1,0,0,0,0|1,0,2]=4 1388 B11R1.17 COCCc1ccccc1F 34a_100000753711_200000210301 [0,1,0,0,0,0|1,0,2]=4 1389 B11R1.17 COCCc1ccccc1F 34a_100138415774_100000720011 [0,1,0,0,0,0|1,0,2]=4 1390 B11R1.17 COCCc1ccccc1F 7a_100000753711_200000210301 [0,1,0,0,0,0|1,0,2]=4 1391 B11R1.17 COCCc1ccccc1I 34a_100010255290_200000210301 [0,1,0,0,0,0|1,0,2]=4 1392 B11R1.17 COCCc1ccccc1I 7a_100010255290_200000210301 [0,1,0,0,0,0|1,0,2]=4 1393 B11R1.17 COCCc1ccccc1N 34a_100011215289_200000210301 [0,1,0,0,0,0|1,0,2]=4 1394 B11R1.17 COCCc1ccccc1O 34a_100138415774_100000722297 [0,1,0,0,0,0|0,0,2]=3 1395 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [0,1,0,0,0,0|1,0,1]=3 1396 B11R1.17 COCOc1cccnc1O 271570a_203496583355_100011935308 [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.17 COCSc1ccccc1Br 62a_100000695589_100000766300 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.17 COCSc1ccccc1Br 62a_100000766300_100000695589 [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.17 COCSc1ccccc1C 62a_100000210755_100000766300 [0,1,0,0,0,0|2,0,1]=4 1400 B11R1.17 COCSc1ccccc1C 62a_100000766300_100000210755 [0,1,0,0,0,0|2,0,1]=4 1401 B11R1.17 COCSc1ccccc1Cl 62a_100000764095_100000766300 [0,1,0,0,0,0|2,0,1]=4 1402 B11R1.17 COCSc1ccccc1Cl 62a_100000766300_100000764095 [0,1,0,0,0,0|2,0,1]=4 1403 B11R1.17 COCSc1ccccc1F 62a_100000766300_100011215700 [0,1,0,0,0,0|2,0,1]=4 1404 B11R1.17 COCSc1ccccc1F 62a_100011215700_100000766300 [0,1,0,0,0,0|2,0,1]=4 1405 B11R1.17 COCSc1ccccc1N 62a_100000210017_100000766300 [0,1,0,0,0,0|2,0,1]=4 1406 B11R1.17 COCSc1ccccc1N 62a_100000766300_100000210017 [0,1,0,0,0,0|2,0,1]=4 1407 B11R1.17 COCSc1ccccc1O 62a_100000739446_100000766300 [0,1,0,0,0,0|1,0,1]=3 1408 B11R1.17 COCSc1ccccc1O 62a_100000766300_100000739446 [0,1,0,0,0,0|1,0,1]=3 1409 B11R1.17 COCSc1cccnc1O 62a_100000760158_100000766300 [0,1,0,0,0,0|2,0,1]=4 1410 B11R1.17 COCSc1cccnc1O 62a_100000766300_100000760158 [0,1,0,0,0,0|2,0,1]=4 1411 B11R1.17 COCSc1ccncc1O 62a_100000766300_100009817591 [0,1,0,0,0,0|2,0,1]=4 1412 B11R1.17 COCSc1ccncc1O 62a_100009817591_100000766300 [0,1,0,0,0,0|2,0,1]=4 1413 B11R1.17 COCSc1ncccc1O 62a_100000034122_100000766300 [0,1,0,0,0,0|2,0,1]=4 1414 B11R1.17 COCSc1ncccc1O 62a_100000766300_100000034122 [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.17 CSCCc1ccccc1Br 62a_100012161201_200000210301 [0,1,0,0,0,0|1,0,2]=4 1416 B11R1.17 CSCCc1ccccc1Br 62a_200000210301_100012161201 [0,1,0,0,0,0|1,0,2]=4 1417 B11R1.17 CSCCc1ccccc1C 62a_100011713688_200000210301 [0,1,0,0,0,0|1,0,2]=4 1418 B11R1.17 CSCCc1ccccc1C 62a_200000210301_100011713688 [0,1,0,0,0,0|1,0,2]=4 1419 B11R1.17 CSCCc1ccccc1Cl 62a_100011713703_200000210301 [0,1,0,0,0,0|1,0,2]=4 1420 B11R1.17 CSCCc1ccccc1Cl 62a_200000210301_100011713703 [0,1,0,0,0,0|1,0,2]=4 1421 B11R1.17 CSCCc1ccccc1F 62a_100011713696_200000210301 [0,1,0,0,0,0|1,0,2]=4 1422 B11R1.17 CSCCc1ccccc1F 62a_200000210301_100011713696 [0,1,0,0,0,0|1,0,2]=4 1423 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [0,1,0,0,0,0|0,0,2]=3 1424 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [0,1,0,0,0,0|0,0,2]=3 1425 B11R1.17 CSCNc1ccccc1Br 34a_100000210017_100011218213 [0,1,0,0,0,0|2,0,1]=4 1426 B11R1.17 CSCNc1ccccc1C 34a_100015192222_100011218213 [0,1,0,0,0,0|2,0,1]=4 1427 B11R1.17 CSCNc1ccccc1Cl 34a_100000185783_100011218213 [0,1,0,0,0,0|2,0,1]=4 1428 B11R1.17 CSCNc1ccccc1F 34a_100000210422_100011218213 [0,1,0,0,0,0|2,0,1]=4 1429 B11R1.17 CSCNc1ccccc1I 34a_100000210053_100011218213 [0,1,0,0,0,0|2,0,1]=4 1430 B11R1.17 CSCNc1ccccc1O 34a_100000185747_100011218213 [0,1,0,0,0,0|1,0,1]=3 1431 B11R1.17 CSCOc1ccccc1Br 34a_100000181306_100011218213 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.17 CSCOc1ccccc1C 34a_100000210338_100011218213 [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.17 CSCOc1ccccc1Cl 34a_100000210172_100011218213 [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.17 CSCOc1ccccc1F 34a_100000210171_100011218213 [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.17 CSCOc1ccccc1I 34a_100000739446_100011218213 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.17 CSCOc1ccccc1N 34a_100000185747_100011218213 [0,1,0,0,0,0|2,0,1]=4 1437 B11R1.17 CSCSc1ccccc1Br 62a_100000695589_100011218213 [0,1,0,0,0,0|2,0,1]=4 1438 B11R1.17 CSCSc1ccccc1Br 62a_100011218213_100000695589 [0,1,0,0,0,0|2,0,1]=4 1439 B11R1.17 CSCSc1ccccc1C 62a_100000210755_100011218213 [0,1,0,0,0,0|2,0,1]=4 1440 B11R1.17 CSCSc1ccccc1C 62a_100011218213_100000210755 [0,1,0,0,0,0|2,0,1]=4 1441 B11R1.17 CSCSc1ccccc1Cl 62a_100000764095_100011218213 [0,1,0,0,0,0|2,0,1]=4 1442 B11R1.17 CSCSc1ccccc1Cl 62a_100011218213_100000764095 [0,1,0,0,0,0|2,0,1]=4 1443 B11R1.17 CSCSc1ccccc1F 62a_100011215700_100011218213 [0,1,0,0,0,0|2,0,1]=4 1444 B11R1.17 CSCSc1ccccc1F 62a_100011218213_100011215700 [0,1,0,0,0,0|2,0,1]=4 1445 B11R1.17 CSCSc1ccccc1N 62a_100000210017_100011218213 [0,1,0,0,0,0|2,0,1]=4 1446 B11R1.17 CSCSc1ccccc1N 62a_100011218213_100000210017 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.17 CSCSc1ccccc1O 62a_100000739446_100011218213 [0,1,0,0,0,0|1,0,1]=3 1448 B11R1.17 CSCSc1ccccc1O 62a_100011218213_100000739446 [0,1,0,0,0,0|1,0,1]=3 1449 B11R1.17 CSCSc1cccnc1O 62a_100000760158_100011218213 [0,1,0,0,0,0|2,0,1]=4 1450 B11R1.17 CSCSc1cccnc1O 62a_100011218213_100000760158 [0,1,0,0,0,0|2,0,1]=4 1451 B11R1.17 CSCSc1ccncc1O 62a_100009817591_100011218213 [0,1,0,0,0,0|2,0,1]=4 1452 B11R1.17 CSCSc1ccncc1O 62a_100011218213_100009817591 [0,1,0,0,0,0|2,0,1]=4 1453 B11R1.17 CSCSc1ncccc1O 62a_100000034122_100011218213 [0,1,0,0,0,0|2,0,1]=4 1454 B11R1.17 CSCSc1ncccc1O 62a_100011218213_100000034122 [0,1,0,0,0,0|2,0,1]=4 1455 B11R1.17 C[n+]1ccccc1SCC=O 62a_200015260668_100000212160 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.17 Cc1ccccc1CCN[13CH3] 2230a_100000685071_200025704644 [0,1,0,0,0,0|1,0,2]=4 1457 B11R1.17 Cc1ccccc1CCN[13CH3] 34a_100000685071_200025704644 [0,1,0,0,0,0|1,0,2]=4 1458 B11R1.17 Cc1ccccc1CCO[13CH3] 34a_100011220023_200025704644 [0,1,0,0,0,0|1,0,2]=4 1459 B11R1.17 Cc1ccccc1CCO[13CH3] 7a_100011220023_200025704644 [0,1,0,0,0,0|1,0,2]=4 1460 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_100011713688_200025704644 [0,1,0,0,0,0|1,0,2]=4 1461 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_200025704644_100011713688 [0,1,0,0,0,0|1,0,2]=4 1462 B11R1.17 Cc1ccccc1CNCF 34a_100000174972_100015361967 [0,1,0,0,0,0|2,0,1]=4 1463 B11R1.17 Cc1ccccc1COCF 34a_100000698903_100015361967 [0,1,0,0,0,0|2,0,1]=4 1464 B11R1.17 Cc1ccccc1COCF 7a_100000698903_100015361967 [0,1,0,0,0,0|2,0,1]=4 1465 B11R1.17 Cc1ccccc1CSCF 62a_100000211839_100015361967 [0,1,0,0,0,0|2,0,1]=4 1466 B11R1.17 Cc1ccccc1CSCF 62a_100015361967_100000211839 [0,1,0,0,0,0|2,0,1]=4 1467 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [0,1,0,0,0,0|2,0,0]=3 1468 B11R1.17 Cc1ccccc1NCCF 34a_100015192222_100011217306 [0,1,0,0,0,0|2,0,1]=4 1469 B11R1.17 Cc1ccccc1NCCO 34a_100015192222_100000211926 [0,1,0,0,0,0|2,0,1]=4 1470 B11R1.17 Cc1ccccc1OCC#N 7a_100000210338_100011215382 [0,1,0,0,0,0|2,0,1]=4 1471 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,1,0,0,0,0|2,0,0]=3 1472 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,1,0,0,0,0|2,0,0]=3 1473 B11R1.17 Cc1ccccc1OCCF 34a_100000210338_100011217306 [0,1,0,0,0,0|2,0,1]=4 1474 B11R1.17 Cc1ccccc1OCCF 7a_100000210338_100011217306 [0,1,0,0,0,0|2,0,1]=4 1475 B11R1.17 Cc1ccccc1OCCO 34a_100000210338_100000211926 [0,1,0,0,0,0|2,0,1]=4 1476 B11R1.17 Cc1ccccc1OCCO 7a_100000210338_100000211926 [0,1,0,0,0,0|2,0,1]=4 1477 B11R1.17 Cc1ccccc1SCC#N 62a_100000210755_100011215382 [0,1,0,0,0,0|2,0,1]=4 1478 B11R1.17 Cc1ccccc1SCC#N 62a_100011215382_100000210755 [0,1,0,0,0,0|2,0,1]=4 1479 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [0,1,0,0,0,0|2,0,0]=3 1480 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [0,1,0,0,0,0|2,0,0]=3 1481 B11R1.17 Cc1ccccc1SCCF 62a_100000210755_100011217306 [0,1,0,0,0,0|2,0,1]=4 1482 B11R1.17 Cc1ccccc1SCCF 62a_100011217306_100000210755 [0,1,0,0,0,0|2,0,1]=4 1483 B11R1.17 Cc1ccccc1SCCO 62a_100000210755_100000211926 [0,1,0,0,0,0|2,0,1]=4 1484 B11R1.17 Cc1ccccc1SCCO 62a_100000211926_100000210755 [0,1,0,0,0,0|2,0,1]=4 1485 B11R1.17 Cc1cccnc1SCC=O 62a_100000751373_200015260668 [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.17 Cc1cccnc1SCC=O 62a_200015260668_100000751373 [0,1,0,0,0,0|3,0,0]=4 1487 B11R1.17 Cc1ccncc1OCC=O 34a_100011997053_200009817547 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.17 Cc1ccncc1OCC=O 7a_100011997053_200015260668 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.17 Cc1ccncc1SCC=O 62a_100000761580_200015260668 [0,1,0,0,0,0|3,0,0]=4 1490 B11R1.17 Cc1ccncc1SCC=O 62a_200015260668_100000761580 [0,1,0,0,0,0|3,0,0]=4 1491 B11R1.17 Cc1cnccc1OCC=O 34a_100000694293_200009817547 [0,1,0,0,0,0|3,0,0]=4 1492 B11R1.17 Cc1cnccc1SCC=O 62a_100000765111_200015260668 [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.17 Cc1cnccc1SCC=O 62a_200015260668_100000765111 [0,1,0,0,0,0|3,0,0]=4 1494 B11R1.17 Cc1ncccc1OCC=O 34a_100000745507_200009817547 [0,1,0,0,0,0|3,0,0]=4 1495 B11R1.17 Cc1ncccc1OCC=O 7a_100000745507_200015260668 [0,1,0,0,0,0|3,0,0]=4 1496 B11R1.17 Cc1ncccc1SCC=O 62a_100000751574_200015260668 [0,1,0,0,0,0|3,0,0]=4 1497 B11R1.17 Cc1ncccc1SCC=O 62a_200015260668_100000751574 [0,1,0,0,0,0|3,0,0]=4 1498 B11R1.17 FCCNc1ccccc1Br 34a_100000210017_100011217306 [0,1,0,0,0,0|2,0,1]=4 1499 B11R1.17 FCCNc1ccccc1Cl 34a_100000185783_100011217306 [0,1,0,0,0,0|2,0,1]=4 1500 B11R1.17 FCCNc1ccccc1F 34a_100000210422_100011217306 [0,1,0,0,0,0|2,0,1]=4 1501 B11R1.17 FCCNc1ccccc1I 34a_100000210053_100011217306 [0,1,0,0,0,0|2,0,1]=4 1502 B11R1.17 FCCOc1ccccc1Br 34a_100000181306_100011217306 [0,1,0,0,0,0|2,0,1]=4 1503 B11R1.17 FCCOc1ccccc1Br 7a_100000181306_100011217306 [0,1,0,0,0,0|2,0,1]=4 1504 B11R1.17 FCCOc1ccccc1Cl 34a_100000210172_100011217306 [0,1,0,0,0,0|2,0,1]=4 1505 B11R1.17 FCCOc1ccccc1Cl 7a_100000210172_100011217306 [0,1,0,0,0,0|2,0,1]=4 1506 B11R1.17 FCCOc1ccccc1F 34a_100000210171_100011217306 [0,1,0,0,0,0|2,0,1]=4 1507 B11R1.17 FCCOc1ccccc1F 7a_100000210171_100011217306 [0,1,0,0,0,0|2,0,1]=4 1508 B11R1.17 FCCOc1ccccc1I 34a_100000739446_100011217306 [0,1,0,0,0,0|2,0,1]=4 1509 B11R1.17 FCCOc1ccccc1I 7a_100000739446_100011217306 [0,1,0,0,0,0|2,0,1]=4 1510 B11R1.17 FCCSc1ccccc1Br 62a_100000695589_100011217306 [0,1,0,0,0,0|2,0,1]=4 1511 B11R1.17 FCCSc1ccccc1Br 62a_100011217306_100000695589 [0,1,0,0,0,0|2,0,1]=4 1512 B11R1.17 FCCSc1ccccc1Cl 62a_100000764095_100011217306 [0,1,0,0,0,0|2,0,1]=4 1513 B11R1.17 FCCSc1ccccc1Cl 62a_100011217306_100000764095 [0,1,0,0,0,0|2,0,1]=4 1514 B11R1.17 FCCSc1ccccc1F 62a_100011215700_100011217306 [0,1,0,0,0,0|2,0,1]=4 1515 B11R1.17 FCCSc1ccccc1F 62a_100011217306_100011215700 [0,1,0,0,0,0|2,0,1]=4 1516 B11R1.17 FCNCc1ccccc1Br 34a_100000689332_100015361967 [0,1,0,0,0,0|2,0,1]=4 1517 B11R1.17 FCNCc1ccccc1Cl 34a_100000174879_100015361967 [0,1,0,0,0,0|2,0,1]=4 1518 B11R1.17 FCNCc1ccccc1F 34a_100000174869_100015361967 [0,1,0,0,0,0|2,0,1]=4 1519 B11R1.17 FCOCc1ccccc1Br 34a_100000756307_100015361967 [0,1,0,0,0,0|2,0,1]=4 1520 B11R1.17 FCOCc1ccccc1Br 7a_100000756307_100015361967 [0,1,0,0,0,0|2,0,1]=4 1521 B11R1.17 FCOCc1ccccc1Cl 34a_100000210847_100015361967 [0,1,0,0,0,0|2,0,1]=4 1522 B11R1.17 FCOCc1ccccc1Cl 7a_100000210847_100015361967 [0,1,0,0,0,0|2,0,1]=4 1523 B11R1.17 FCOCc1ccccc1F 34a_100000211962_100015361967 [0,1,0,0,0,0|2,0,1]=4 1524 B11R1.17 FCOCc1ccccc1F 7a_100000211962_100015361967 [0,1,0,0,0,0|2,0,1]=4 1525 B11R1.17 FCOCc1ccccc1I 34a_100000187465_100015361967 [0,1,0,0,0,0|2,0,1]=4 1526 B11R1.17 FCOCc1ccccc1I 7a_100000187465_100015361967 [0,1,0,0,0,0|2,0,1]=4 1527 B11R1.17 FCSCc1ccccc1Br 62a_100000184730_100015361967 [0,1,0,0,0,0|2,0,1]=4 1528 B11R1.17 FCSCc1ccccc1Br 62a_100015361967_100000184730 [0,1,0,0,0,0|2,0,1]=4 1529 B11R1.17 FCSCc1ccccc1Cl 62a_100000187162_100015361967 [0,1,0,0,0,0|2,0,1]=4 1530 B11R1.17 FCSCc1ccccc1Cl 62a_100015361967_100000187162 [0,1,0,0,0,0|2,0,1]=4 1531 B11R1.17 FCSCc1ccccc1F 62a_100000211605_100015361967 [0,1,0,0,0,0|2,0,1]=4 1532 B11R1.17 FCSCc1ccccc1F 62a_100015361967_100000211605 [0,1,0,0,0,0|2,0,1]=4 1533 B11R1.17 FCSCc1ccccc1I 62a_100011216222_100015361967 [0,1,0,0,0,0|2,0,1]=4 1534 B11R1.17 FCSCc1ccccc1I 62a_100015361967_100011216222 [0,1,0,0,0,0|2,0,1]=4 1535 B11R1.17 N#CCOc1ccccc1Br 7a_100000181306_100011215382 [0,1,0,0,0,0|2,0,1]=4 1536 B11R1.17 N#CCOc1ccccc1Cl 7a_100000210172_100011215382 [0,1,0,0,0,0|2,0,1]=4 1537 B11R1.17 N#CCOc1ccccc1F 7a_100000210171_100011215382 [0,1,0,0,0,0|2,0,1]=4 1538 B11R1.17 N#CCOc1ccccc1I 7a_100000739446_100011215382 [0,1,0,0,0,0|2,0,1]=4 1539 B11R1.17 N#CCOc1ccccc1N 7a_100000185747_100011215382 [0,1,0,0,0,0|2,0,1]=4 1540 B11R1.17 N#CCOc1ccccc1O 271570a_203496583355_200000173881 [0,1,0,0,0,0|1,0,1]=3 1541 B11R1.17 N#CCSc1ccccc1Br 62a_100000695589_100011215382 [0,1,0,0,0,0|2,0,1]=4 1542 B11R1.17 N#CCSc1ccccc1Br 62a_100011215382_100000695589 [0,1,0,0,0,0|2,0,1]=4 1543 B11R1.17 N#CCSc1ccccc1Cl 62a_100000764095_100011215382 [0,1,0,0,0,0|2,0,1]=4 1544 B11R1.17 N#CCSc1ccccc1Cl 62a_100011215382_100000764095 [0,1,0,0,0,0|2,0,1]=4 1545 B11R1.17 N#CCSc1ccccc1F 62a_100011215382_100011215700 [0,1,0,0,0,0|2,0,1]=4 1546 B11R1.17 N#CCSc1ccccc1F 62a_100011215700_100011215382 [0,1,0,0,0,0|2,0,1]=4 1547 B11R1.17 N#CCSc1ccccc1N 62a_100000210017_100011215382 [0,1,0,0,0,0|2,0,1]=4 1548 B11R1.17 N#CCSc1ccccc1N 62a_100011215382_100000210017 [0,1,0,0,0,0|2,0,1]=4 1549 B11R1.17 N#CCSc1ccccc1O 62a_100000739446_100011215382 [0,1,0,0,0,0|1,0,1]=3 1550 B11R1.17 N#CCSc1ccccc1O 62a_100011215382_100000739446 [0,1,0,0,0,0|1,0,1]=3 1551 B11R1.17 N#CCSc1cccnc1O 62a_100000760158_100011215382 [0,1,0,0,0,0|2,0,1]=4 1552 B11R1.17 N#CCSc1cccnc1O 62a_100011215382_100000760158 [0,1,0,0,0,0|2,0,1]=4 1553 B11R1.17 N#CCSc1ccncc1O 62a_100009817591_100011215382 [0,1,0,0,0,0|2,0,1]=4 1554 B11R1.17 N#CCSc1ccncc1O 62a_100011215382_100009817591 [0,1,0,0,0,0|2,0,1]=4 1555 B11R1.17 N#CCSc1ncccc1O 62a_100000034122_100011215382 [0,1,0,0,0,0|2,0,1]=4 1556 B11R1.17 N#CCSc1ncccc1O 62a_100011215382_100000034122 [0,1,0,0,0,0|2,0,1]=4 1557 B11R1.17 N#CSCc1ccccc1O 271570a_203496583355_200010199460 [0,1,0,0,0,0|1,0,1]=3 1558 B11R1.17 NCCOc1ccccc1O 271570a_203496583355_100000744007 [0,1,0,0,0,0|1,0,1]=3 1559 B11R1.17 Nc1ccccc1COCF 34a_100000212039_100015361967 [0,1,0,0,0,0|2,0,1]=4 1560 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,1,0,0,0,0|2,0,0]=3 1561 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,1,0,0,0,0|2,0,0]=3 1562 B11R1.17 Nc1ccccc1OCCF 34a_100000185747_100011217306 [0,1,0,0,0,0|2,0,1]=4 1563 B11R1.17 Nc1ccccc1OCCF 7a_100000185747_100011217306 [0,1,0,0,0,0|2,0,1]=4 1564 B11R1.17 Nc1ccccc1OCCO 34a_100000185747_100000211926 [0,1,0,0,0,0|2,0,1]=4 1565 B11R1.17 Nc1ccccc1OCCO 7a_100000185747_100000211926 [0,1,0,0,0,0|2,0,1]=4 1566 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [0,1,0,0,0,0|2,0,0]=3 1567 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [0,1,0,0,0,0|2,0,0]=3 1568 B11R1.17 Nc1ccccc1SCCF 62a_100000210017_100011217306 [0,1,0,0,0,0|2,0,1]=4 1569 B11R1.17 Nc1ccccc1SCCF 62a_100011217306_100000210017 [0,1,0,0,0,0|2,0,1]=4 1570 B11R1.17 Nc1ccccc1SCCO 62a_100000210017_100000211926 [0,1,0,0,0,0|2,0,1]=4 1571 B11R1.17 Nc1ccccc1SCCO 62a_100000211926_100000210017 [0,1,0,0,0,0|2,0,1]=4 1572 B11R1.17 Nc1cccnc1OCC=O 34a_100000746358_200009817547 [0,1,0,0,0,0|3,0,0]=4 1573 B11R1.17 Nc1cccnc1SCC=O 62a_100000688686_200015260668 [0,1,0,0,0,0|3,0,0]=4 1574 B11R1.17 Nc1cccnc1SCC=O 62a_200015260668_100000688686 [0,1,0,0,0,0|3,0,0]=4 1575 B11R1.17 Nc1ccncc1OCC=O 34a_100000753702_200009817547 [0,1,0,0,0,0|3,0,0]=4 1576 B11R1.17 Nc1ccncc1SCC=O 62a_100000047001_200015260668 [0,1,0,0,0,0|3,0,0]=4 1577 B11R1.17 Nc1ccncc1SCC=O 62a_200015260668_100000047001 [0,1,0,0,0,0|3,0,0]=4 1578 B11R1.17 Nc1cnccc1SCC=O 62a_100000756074_200015260668 [0,1,0,0,0,0|3,0,0]=4 1579 B11R1.17 Nc1cnccc1SCC=O 62a_200015260668_100000756074 [0,1,0,0,0,0|3,0,0]=4 1580 B11R1.17 Nc1ncccc1OCC=O 34a_100000211975_200009817547 [0,1,0,0,0,0|3,0,0]=4 1581 B11R1.17 Nc1ncccc1OCC=O 7a_100000211975_200015260668 [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.17 Nc1ncccc1SCC=O 62a_100000045569_200015260668 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.17 Nc1ncccc1SCC=O 62a_200015260668_100000045569 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [0,1,0,0,0,0|0,0,1]=2 1585 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [0,1,0,0,0,0|2,0,0]=3 1586 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [0,1,0,0,0,0|2,0,0]=3 1587 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [0,1,0,0,0,0|2,0,0]=3 1588 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [0,1,0,0,0,0|2,0,0]=3 1589 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,1,0,0,0,0|1,0,0]=2 1590 B11R1.17 O=CCOc1cccc[n+]1[O-] 7a_100000211761_200015260668 [0,1,0,0,0,0|2,0,1]=4 1591 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [0,1,0,0,0,0|2,0,0]=3 1592 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [0,1,0,0,0,0|2,0,0]=3 1593 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [0,1,0,0,0,0|2,0,0]=3 1594 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [0,1,0,0,0,0|2,0,0]=3 1595 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [0,1,0,0,0,0|2,0,0]=3 1596 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [0,1,0,0,0,0|2,0,0]=3 1597 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [0,1,0,0,0,0|2,0,0]=3 1598 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [0,1,0,0,0,0|2,0,0]=3 1599 B11R1.17 O=CCOc1cccnc1Br 34a_100000744436_200009817547 [0,1,0,0,0,0|3,0,0]=4 1600 B11R1.17 O=CCOc1cccnc1Br 7a_100000744436_200015260668 [0,1,0,0,0,0|3,0,0]=4 1601 B11R1.17 O=CCOc1cccnc1Cl 34a_100000757616_200009817547 [0,1,0,0,0,0|3,0,0]=4 1602 B11R1.17 O=CCOc1cccnc1Cl 7a_100000757616_200015260668 [0,1,0,0,0,0|3,0,0]=4 1603 B11R1.17 O=CCOc1cccnc1F 34a_100000061740_200009817547 [0,1,0,0,0,0|3,0,0]=4 1604 B11R1.17 O=CCOc1cccnc1F 7a_100000061740_200015260668 [0,1,0,0,0,0|3,0,0]=4 1605 B11R1.17 O=CCOc1cccnc1I 34a_100000034122_200009817547 [0,1,0,0,0,0|3,0,0]=4 1606 B11R1.17 O=CCOc1cccnc1I 7a_100000034122_200015260668 [0,1,0,0,0,0|3,0,0]=4 1607 B11R1.17 O=CCOc1cccoc1=O 34a_100000077404_200009817547 [0,1,0,0,0,0|2,0,1]=4 1608 B11R1.17 O=CCOc1cccoc1=O 7a_100000077404_200015260668 [0,1,0,0,0,0|2,0,1]=4 1609 B11R1.17 O=CCOc1ccncc1Br 34a_100011996408_200009817547 [0,1,0,0,0,0|3,0,0]=4 1610 B11R1.17 O=CCOc1ccncc1Cl 34a_100011997054_200009817547 [0,1,0,0,0,0|3,0,0]=4 1611 B11R1.17 O=CCOc1ccncc1F 34a_200000081243_200009817547 [0,1,0,0,0,0|3,0,0]=4 1612 B11R1.17 O=CCOc1cnccc1Cl 34a_100011996695_200009817547 [0,1,0,0,0,0|3,0,0]=4 1613 B11R1.17 O=CCOc1cnccc1I 34a_100000050107_200009817547 [0,1,0,0,0,0|3,0,0]=4 1614 B11R1.17 O=CCOc1coccc1=O 34a_100000060831_200009817547 [0,1,0,0,0,0|2,0,1]=4 1615 B11R1.17 O=CCOc1ncccc1Cl 34a_100011290957_200009817547 [0,1,0,0,0,0|3,0,0]=4 1616 B11R1.17 O=CCOc1ncccc1F 34a_100011219419_200009817547 [0,1,0,0,0,0|3,0,0]=4 1617 B11R1.17 O=CCSc1c[nH]ccc1=O 62a_100009998708_200015260668 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.17 O=CCSc1c[nH]ccc1=O 62a_200015260668_100009998708 [0,1,0,0,0,0|2,0,1]=4 1619 B11R1.17 O=CCSc1c[nH]ccc1=S 62a_200012280681_200015260668 [0,1,0,0,0,0|2,1,0]=4 1620 B11R1.17 O=CCSc1c[nH]ccc1=S 62a_200015260668_200012280681 [0,1,0,0,0,0|2,1,0]=4 1621 B11R1.17 O=CCSc1cccc[n+]1[O-] 62a_200015260668_200000042595 [0,1,0,0,0,0|2,0,1]=4 1622 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [0,1,0,0,0,0|2,0,0]=3 1623 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [0,1,0,0,0,0|2,0,0]=3 1624 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [0,1,0,0,0,0|2,0,0]=3 1625 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [0,1,0,0,0,0|2,0,0]=3 1626 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [0,1,0,0,0,0|2,0,0]=3 1627 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [0,1,0,0,0,0|2,0,0]=3 1628 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,1,0,0,0,0|1,0,0]=2 1629 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,1,0,0,0,0|1,0,0]=2 1630 B11R1.17 O=CCSc1cccnc1Br 62a_100010202626_200015260668 [0,1,0,0,0,0|3,0,0]=4 1631 B11R1.17 O=CCSc1cccnc1Br 62a_200015260668_100010202626 [0,1,0,0,0,0|3,0,0]=4 1632 B11R1.17 O=CCSc1cccnc1Cl 62a_100000036424_200015260668 [0,1,0,0,0,0|3,0,0]=4 1633 B11R1.17 O=CCSc1cccnc1Cl 62a_200015260668_100000036424 [0,1,0,0,0,0|3,0,0]=4 1634 B11R1.17 O=CCSc1cccnc1F 62a_100009816115_200015260668 [0,1,0,0,0,0|3,0,0]=4 1635 B11R1.17 O=CCSc1cccnc1F 62a_200015260668_100009816115 [0,1,0,0,0,0|3,0,0]=4 1636 B11R1.17 O=CCSc1cccnc1O 62a_100000760158_200015260668 [0,1,0,0,0,0|2,0,0]=3 1637 B11R1.17 O=CCSc1cccnc1O 62a_200015260668_100000760158 [0,1,0,0,0,0|2,0,0]=3 1638 B11R1.17 O=CCSc1ccncc1Br 62a_100000726257_200015260668 [0,1,0,0,0,0|3,0,0]=4 1639 B11R1.17 O=CCSc1ccncc1Br 62a_200015260668_100000726257 [0,1,0,0,0,0|3,0,0]=4 1640 B11R1.17 O=CCSc1ccncc1Cl 62a_100000708259_200015260668 [0,1,0,0,0,0|3,0,0]=4 1641 B11R1.17 O=CCSc1ccncc1Cl 62a_200015260668_100000708259 [0,1,0,0,0,0|3,0,0]=4 1642 B11R1.17 O=CCSc1ccncc1F 62a_100000047030_200015260668 [0,1,0,0,0,0|3,0,0]=4 1643 B11R1.17 O=CCSc1ccncc1F 62a_200015260668_100000047030 [0,1,0,0,0,0|3,0,0]=4 1644 B11R1.17 O=CCSc1ccncc1O 62a_100009817591_200015260668 [0,1,0,0,0,0|2,0,0]=3 1645 B11R1.17 O=CCSc1ccncc1O 62a_200015260668_100009817591 [0,1,0,0,0,0|2,0,0]=3 1646 B11R1.17 O=CCSc1cnccc1Br 62a_100010138639_200015260668 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.17 O=CCSc1cnccc1Br 62a_200015260668_100010138639 [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.17 O=CCSc1cnccc1Cl 62a_100009995489_200015260668 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.17 O=CCSc1cnccc1Cl 62a_200015260668_100009995489 [0,1,0,0,0,0|3,0,0]=4 1650 B11R1.17 O=CCSc1cnccc1F 62a_100009820683_200015260668 [0,1,0,0,0,0|3,0,0]=4 1651 B11R1.17 O=CCSc1cnccc1F 62a_200015260668_100009820683 [0,1,0,0,0,0|3,0,0]=4 1652 B11R1.17 O=CCSc1cncnc1O 62a_100000751107_200015260668 [0,1,0,0,0,0|3,0,0]=4 1653 B11R1.17 O=CCSc1cncnc1O 62a_200015260668_100000751107 [0,1,0,0,0,0|3,0,0]=4 1654 B11R1.17 O=CCSc1ncccc1Br 62a_100000696092_200015260668 [0,1,0,0,0,0|3,0,0]=4 1655 B11R1.17 O=CCSc1ncccc1Br 62a_200015260668_100000696092 [0,1,0,0,0,0|3,0,0]=4 1656 B11R1.17 O=CCSc1ncccc1Cl 62a_100011356963_200015260668 [0,1,0,0,0,0|3,0,0]=4 1657 B11R1.17 O=CCSc1ncccc1Cl 62a_200015260668_100011356963 [0,1,0,0,0,0|3,0,0]=4 1658 B11R1.17 O=CCSc1ncccc1F 62a_100000685392_200015260668 [0,1,0,0,0,0|3,0,0]=4 1659 B11R1.17 O=CCSc1ncccc1F 62a_200015260668_100000685392 [0,1,0,0,0,0|3,0,0]=4 1660 B11R1.17 O=CCSc1ncccc1O 62a_100000034122_200015260668 [0,1,0,0,0,0|2,0,0]=3 1661 B11R1.17 O=CCSc1ncccc1O 62a_200015260668_100000034122 [0,1,0,0,0,0|2,0,0]=3 1662 B11R1.17 OCC#Cc1ccccc1O 271570a_203496583355_100009814404 [0,1,0,0,0,0|0,0,3]=4 1663 B11R1.17 OCCCc1ccccc1O 271570a_203496583355_100000699526 [0,1,0,0,0,0|0,0,2]=3 1664 B11R1.17 OCCNc1ccccc1Br 34a_100000210017_100000211926 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.17 OCCNc1ccccc1Cl 34a_100000185783_100000211926 [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.17 OCCNc1ccccc1F 34a_100000210422_100000211926 [0,1,0,0,0,0|2,0,1]=4 1667 B11R1.17 OCCNc1ccccc1I 34a_100000210053_100000211926 [0,1,0,0,0,0|2,0,1]=4 1668 B11R1.17 OCCNc1ccccc1O 34a_100000185747_100000211926 [0,1,0,0,0,0|1,0,1]=3 1669 B11R1.17 OCCNc1ncccc1O 271570a_203496583355_200011464885 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.17 OCCOc1ccccc1Br 34a_100000181306_100000211926 [0,1,0,0,0,0|2,0,1]=4 1671 B11R1.17 OCCOc1ccccc1Br 7a_100000181306_100000211926 [0,1,0,0,0,0|2,0,1]=4 1672 B11R1.17 OCCOc1ccccc1Cl 34a_100000210172_100000211926 [0,1,0,0,0,0|2,0,1]=4 1673 B11R1.17 OCCOc1ccccc1Cl 7a_100000210172_100000211926 [0,1,0,0,0,0|2,0,1]=4 1674 B11R1.17 OCCOc1ccccc1F 34a_100000210171_100000211926 [0,1,0,0,0,0|2,0,1]=4 1675 B11R1.17 OCCOc1ccccc1F 7a_100000210171_100000211926 [0,1,0,0,0,0|2,0,1]=4 1676 B11R1.17 OCCOc1ccccc1I 34a_100000739446_100000211926 [0,1,0,0,0,0|2,0,1]=4 1677 B11R1.17 OCCOc1ccccc1I 7a_100000739446_100000211926 [0,1,0,0,0,0|2,0,1]=4 1678 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [0,1,0,0,0,0|1,0,1]=3 1679 B11R1.17 OCCSc1ccccc1Br 62a_100000211926_100000695589 [0,1,0,0,0,0|2,0,1]=4 1680 B11R1.17 OCCSc1ccccc1Br 62a_100000695589_100000211926 [0,1,0,0,0,0|2,0,1]=4 1681 B11R1.17 OCCSc1ccccc1Cl 62a_100000211926_100000764095 [0,1,0,0,0,0|2,0,1]=4 1682 B11R1.17 OCCSc1ccccc1Cl 62a_100000764095_100000211926 [0,1,0,0,0,0|2,0,1]=4 1683 B11R1.17 OCCSc1ccccc1F 62a_100000211926_100011215700 [0,1,0,0,0,0|2,0,1]=4 1684 B11R1.17 OCCSc1ccccc1F 62a_100011215700_100000211926 [0,1,0,0,0,0|2,0,1]=4 1685 B11R1.17 OCCSc1ccccc1O 271570a_203496583355_200000230852 [0,1,0,0,0,0|1,0,1]=3 1686 B11R1.17 OCCSc1ccccc1O 62a_100000211926_100000739446 [0,1,0,0,0,0|1,0,1]=3 1687 B11R1.17 OCCSc1ccccc1O 62a_100000739446_100000211926 [0,1,0,0,0,0|1,0,1]=3 1688 B11R1.17 OCCSc1cccnc1O 62a_100000211926_100000760158 [0,1,0,0,0,0|2,0,1]=4 1689 B11R1.17 OCCSc1cccnc1O 62a_100000760158_100000211926 [0,1,0,0,0,0|2,0,1]=4 1690 B11R1.17 OCCSc1ccncc1O 62a_100000211926_100009817591 [0,1,0,0,0,0|2,0,1]=4 1691 B11R1.17 OCCSc1ccncc1O 62a_100009817591_100000211926 [0,1,0,0,0,0|2,0,1]=4 1692 B11R1.17 OCCSc1ncccc1O 62a_100000034122_100000211926 [0,1,0,0,0,0|2,0,1]=4 1693 B11R1.17 OCCSc1ncccc1O 62a_100000211926_100000034122 [0,1,0,0,0,0|2,0,1]=4 1694 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [0,1,0,0,0,0|1,0,1]=3 1695 B11R1.17 Oc1ccccc1NCCF 34a_100000185747_100011217306 [0,1,0,0,0,0|1,0,1]=3 1696 B11R1.17 Oc1ccccc1SCCF 62a_100000739446_100011217306 [0,1,0,0,0,0|1,0,1]=3 1697 B11R1.17 Oc1ccccc1SCCF 62a_100011217306_100000739446 [0,1,0,0,0,0|1,0,1]=3 1698 B11R1.17 Oc1cccnc1CSCF 62a_100015361967_200020655725 [0,1,0,0,0,0|2,0,1]=4 1699 B11R1.17 Oc1cccnc1CSCF 62a_200020655725_100015361967 [0,1,0,0,0,0|2,0,1]=4 1700 B11R1.17 Oc1cccnc1SCCF 62a_100000034122_100011217306 [0,1,0,0,0,0|2,0,1]=4 1701 B11R1.17 Oc1cccnc1SCCF 62a_100011217306_100000034122 [0,1,0,0,0,0|2,0,1]=4 1702 B11R1.17 Oc1cnccc1SCCF 62a_100009817591_100011217306 [0,1,0,0,0,0|2,0,1]=4 1703 B11R1.17 Oc1cnccc1SCCF 62a_100011217306_100009817591 [0,1,0,0,0,0|2,0,1]=4 1704 B11R1.17 Oc1ncccc1OCCF 271570a_203496583355_100012814765 [0,1,0,0,0,0|2,0,1]=4 1705 B11R1.17 Oc1ncccc1SCCF 62a_100000760158_100011217306 [0,1,0,0,0,0|2,0,1]=4 1706 B11R1.17 Oc1ncccc1SCCF 62a_100011217306_100000760158 [0,1,0,0,0,0|2,0,1]=4 1707 B11R1.17 [13CH3]NCCc1ccccc1Br 2230a_100000747383_200025704644 [0,1,0,0,0,0|1,0,2]=4 1708 B11R1.17 [13CH3]NCCc1ccccc1Br 34a_100000747383_200025704644 [0,1,0,0,0,0|1,0,2]=4 1709 B11R1.17 [13CH3]NCCc1ccccc1Cl 2230a_100011207228_200025704644 [0,1,0,0,0,0|1,0,2]=4 1710 B11R1.17 [13CH3]NCCc1ccccc1Cl 34a_100011207228_200025704644 [0,1,0,0,0,0|1,0,2]=4 1711 B11R1.17 [13CH3]NCCc1ccccc1F 2230a_100000185272_200025704644 [0,1,0,0,0,0|1,0,2]=4 1712 B11R1.17 [13CH3]NCCc1ccccc1F 34a_100000185272_200025704644 [0,1,0,0,0,0|1,0,2]=4 1713 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [0,1,0,0,0,0|0,0,2]=3 1714 B11R1.17 [13CH3]OCCc1ccccc1Br 34a_100000731337_200025704644 [0,1,0,0,0,0|1,0,2]=4 1715 B11R1.17 [13CH3]OCCc1ccccc1Br 7a_100000731337_200025704644 [0,1,0,0,0,0|1,0,2]=4 1716 B11R1.17 [13CH3]OCCc1ccccc1Cl 34a_100011215284_200025704644 [0,1,0,0,0,0|1,0,2]=4 1717 B11R1.17 [13CH3]OCCc1ccccc1Cl 7a_100011215284_200025704644 [0,1,0,0,0,0|1,0,2]=4 1718 B11R1.17 [13CH3]OCCc1ccccc1F 34a_100000753711_200025704644 [0,1,0,0,0,0|1,0,2]=4 1719 B11R1.17 [13CH3]OCCc1ccccc1F 7a_100000753711_200025704644 [0,1,0,0,0,0|1,0,2]=4 1720 B11R1.17 [13CH3]OCCc1ccccc1I 34a_100010255290_200025704644 [0,1,0,0,0,0|1,0,2]=4 1721 B11R1.17 [13CH3]OCCc1ccccc1I 7a_100010255290_200025704644 [0,1,0,0,0,0|1,0,2]=4 1722 B11R1.17 [13CH3]OCCc1ccccc1N 34a_100011215289_200025704644 [0,1,0,0,0,0|1,0,2]=4 1723 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_100012161201_200025704644 [0,1,0,0,0,0|1,0,2]=4 1724 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_200025704644_100012161201 [0,1,0,0,0,0|1,0,2]=4 1725 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_100011713703_200025704644 [0,1,0,0,0,0|1,0,2]=4 1726 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_200025704644_100011713703 [0,1,0,0,0,0|1,0,2]=4 1727 B11R1.17 [13CH3]SCCc1ccccc1F 62a_100011713696_200025704644 [0,1,0,0,0,0|1,0,2]=4 1728 B11R1.17 [13CH3]SCCc1ccccc1F 62a_200025704644_100011713696 [0,1,0,0,0,0|1,0,2]=4 1729 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [0,1,0,0,0,0|0,0,2]=3 1730 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [0,1,0,0,0,0|0,0,2]=3 1731 B11R1.41 C#Cc1ccccc1CNC 34a_100020634229_200000210301 [0,1,0,0,0,0|2,0,1]=4 1732 B11R1.41 C#Cc1ccccc1CN[13CH3] 34a_100020634229_200025704644 [0,1,0,0,0,0|2,0,1]=4 1733 B11R1.41 C#Cc1ccccc1COC 34a_100000054652_200000210301 [0,1,0,0,0,0|2,0,1]=4 1734 B11R1.41 C#Cc1ccccc1COC 7a_100000054652_200000210301 [0,1,0,0,0,0|2,0,1]=4 1735 B11R1.41 C#Cc1ccccc1CO[13CH3] 34a_100000054652_200025704644 [0,1,0,0,0,0|2,0,1]=4 1736 B11R1.41 C#Cc1ccccc1CO[13CH3] 7a_100000054652_200025704644 [0,1,0,0,0,0|2,0,1]=4 1737 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [0,1,0,0,0,0|0,0,2]=3 1738 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [0,1,0,0,0,0|0,0,2]=3 1739 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [0,1,0,0,0,0|0,0,2]=3 1740 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [0,1,0,0,0,0|0,0,2]=3 1741 B11R1.41 C=C=Cc1ccccc1C#N 271570a_100015277604_100000188569 [0,1,0,0,0,0|1,0,2]=4 1742 B11R1.41 C=C=Cc1ccccc1C=O 271570a_100015277604_100000211189 [0,1,0,0,0,0|0,0,3]=4 1743 B11R1.41 C=C=Cc1ccccc1CC 271570a_100015277604_100011215823 [0,1,0,0,0,0|1,0,2]=4 1744 B11R1.41 C=C=Cc1ccccc1CN 271570a_100015277604_100000689332 [0,1,0,0,0,0|1,0,2]=4 1745 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [0,1,0,0,0,0|0,0,2]=3 1746 B11R1.41 C=C=Cc1ccccc1NC 271570a_100015277604_100020606079 [0,1,0,0,0,0|1,0,2]=4 1747 B11R1.41 C=C=Cc1ccccc1NN 271570a_100015277604_100000241748 [0,1,0,0,0,0|1,0,2]=4 1748 B11R1.41 C=C=Cc1ccccc1OC 271570a_100015277604_100000174000 [0,1,0,0,0,0|0,0,2]=3 1749 B11R1.41 C=C=Cc1ccccc1SC 271570a_100015277604_100011217816 [0,1,0,0,0,0|0,1,2]=4 1750 B11R1.41 C=C=Cc1cccnc1CO 271570a_100015277604_100011996772 [0,1,0,0,0,0|1,0,2]=4 1751 B11R1.41 C=C=Cc1cccnc1OC 271570a_100015277604_100000047025 [0,1,0,0,0,0|1,0,2]=4 1752 B11R1.41 C=C=Cc1ccncc1CO 271570a_100015277604_100000117392 [0,1,0,0,0,0|1,0,2]=4 1753 B11R1.41 C=C=Cc1ccncc1OC 271570a_100015277604_100016988167 [0,1,0,0,0,0|1,0,2]=4 1754 B11R1.41 C=C=Cc1cnccc1CO 271570a_100015277604_100009873359 [0,1,0,0,0,0|1,0,2]=4 1755 B11R1.41 C=C=Cc1cnccc1OC 271570a_100015277604_100011997281 [0,1,0,0,0,0|1,0,2]=4 1756 B11R1.41 C=C=Cc1ncccc1CO 271570a_100015277604_100000748726 [0,1,0,0,0,0|1,0,2]=4 1757 B11R1.41 C=C=Cc1ncccc1OC 271570a_100015277604_100000690851 [0,1,0,0,0,0|1,0,2]=4 1758 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,1,0,0,0,0|1,0,0]=2 1759 B11R1.41 C=CCc1ccccc1NC 2230a_200138433279_200000210301 [0,1,0,0,0,0|1,0,0]=2 1760 B11R1.41 C=CCc1ccccc1NC 34a_200138433279_200000210301 [0,1,0,0,0,0|1,0,0]=2 1761 B11R1.41 C=CCc1ccccc1N[13CH3] 2230a_200138433279_200025704644 [0,1,0,0,0,0|1,0,0]=2 1762 B11R1.41 C=CCc1ccccc1N[13CH3] 34a_200138433279_200025704644 [0,1,0,0,0,0|1,0,0]=2 1763 B11R1.41 C=CCc1ccccc1OC 34a_100000211836_200000210301 [0,1,0,0,0,0|0,0,0]=1 1764 B11R1.41 C=CCc1ccccc1OC 7a_100000211836_200000210301 [0,1,0,0,0,0|0,0,0]=1 1765 B11R1.41 C=CCc1ccccc1O[13CH3] 34a_100000211836_200025704644 [0,1,0,0,0,0|0,0,0]=1 1766 B11R1.41 C=CCc1ccccc1O[13CH3] 7a_100000211836_200025704644 [0,1,0,0,0,0|0,0,0]=1 1767 B11R1.41 C=CCc1ccccc1SC 62a_100009828059_200000210301 [0,1,0,0,0,0|0,1,0]=2 1768 B11R1.41 C=CCc1ccccc1SC 62a_200000210301_100009828059 [0,1,0,0,0,0|0,1,0]=2 1769 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_100009828059_200025704644 [0,1,0,0,0,0|0,1,0]=2 1770 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_200025704644_100009828059 [0,1,0,0,0,0|0,1,0]=2 1771 B11R1.41 C=Cc1ccccc1CC#N 271570a_100011290941_100000033512 [0,1,0,0,0,0|2,0,1]=4 1772 B11R1.41 C=Cc1ccccc1CCN 271570a_100011290941_100000747383 [0,1,0,0,0,0|2,0,1]=4 1773 B11R1.41 C=Cc1ccccc1CCO 271570a_100011290941_100000731337 [0,1,0,0,0,0|2,0,1]=4 1774 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [0,1,0,0,0,0|2,0,1]=4 1775 B11R1.41 C=Cc1ccccc1CNN 271570a_100011290941_200016993956 [0,1,0,0,0,0|3,0,0]=4 1776 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,1,0,0,0,0|2,0,1]=4 1777 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,1,0,0,0,0|2,0,1]=4 1778 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,1,0,0,0,0|2,0,1]=4 1779 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,1,0,0,0,0|2,0,1]=4 1780 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,1,0,0,0,0|2,0,1]=4 1781 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [0,1,0,0,0,0|2,0,1]=4 1782 B11R1.41 CC=Cc1ccccc1C#N 271570a_100016259895_100000188569 [0,1,0,0,0,0|1,0,2]=4 1783 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,1,0,0,0,0|0,0,3]=4 1784 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [0,1,0,0,0,0|1,0,2]=4 1785 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [0,1,0,0,0,0|1,0,2]=4 1786 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [0,1,0,0,0,0|0,0,2]=3 1787 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [0,1,0,0,0,0|1,0,2]=4 1788 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [0,1,0,0,0,0|1,0,2]=4 1789 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [0,1,0,0,0,0|0,0,2]=3 1790 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [0,1,0,0,0,0|0,1,2]=4 1791 B11R1.41 CC=Cc1cccnc1CO 271570a_100016259895_100011996772 [0,1,0,0,0,0|1,0,2]=4 1792 B11R1.41 CC=Cc1cccnc1OC 271570a_100016259895_100000047025 [0,1,0,0,0,0|1,0,2]=4 1793 B11R1.41 CC=Cc1ccncc1CO 271570a_100016259895_100000117392 [0,1,0,0,0,0|1,0,2]=4 1794 B11R1.41 CC=Cc1ccncc1OC 271570a_100016259895_100016988167 [0,1,0,0,0,0|1,0,2]=4 1795 B11R1.41 CC=Cc1cnccc1CO 271570a_100016259895_100009873359 [0,1,0,0,0,0|1,0,2]=4 1796 B11R1.41 CC=Cc1cnccc1OC 271570a_100016259895_100011997281 [0,1,0,0,0,0|1,0,2]=4 1797 B11R1.41 CC=Cc1ncccc1CO 271570a_100016259895_100000748726 [0,1,0,0,0,0|1,0,2]=4 1798 B11R1.41 CC=Cc1ncccc1OC 271570a_100016259895_100000690851 [0,1,0,0,0,0|1,0,2]=4 1799 B11R1.41 CCCc1ccccc1NC 2230a_100000737634_200000210301 [0,1,0,0,0,0|1,0,2]=4 1800 B11R1.41 CCCc1ccccc1NC 34a_100000737634_200000210301 [0,1,0,0,0,0|1,0,2]=4 1801 B11R1.41 CCCc1ccccc1NC 7a_100000737634_200000210301 [0,1,0,0,0,0|1,0,2]=4 1802 B11R1.41 CCCc1ccccc1N[13CH3] 2230a_100000737634_200025704644 [0,1,0,0,0,0|1,0,2]=4 1803 B11R1.41 CCCc1ccccc1N[13CH3] 34a_100000737634_200025704644 [0,1,0,0,0,0|1,0,2]=4 1804 B11R1.41 CCCc1ccccc1N[13CH3] 7a_100000737634_200025704644 [0,1,0,0,0,0|1,0,2]=4 1805 B11R1.41 CCCc1ccccc1OC 34a_100011217252_200000210301 [0,1,0,0,0,0|0,0,2]=3 1806 B11R1.41 CCCc1ccccc1OC 7a_100011217252_200000210301 [0,1,0,0,0,0|0,0,2]=3 1807 B11R1.41 CCCc1ccccc1O[13CH3] 34a_100011217252_200025704644 [0,1,0,0,0,0|0,0,2]=3 1808 B11R1.41 CCCc1ccccc1O[13CH3] 7a_100011217252_200025704644 [0,1,0,0,0,0|0,0,2]=3 1809 B11R1.41 CCNc1ccccc1CO 34a_100000212039_100000210202 [0,1,0,0,0,0|1,0,2]=4 1810 B11R1.41 CCNc1ccccc1OC 34a_100000210025_100000210202 [0,1,0,0,0,0|1,0,2]=4 1811 B11R1.41 CCNc1ccccc1OC 34a_103624766699_200000210301 [0,1,0,0,0,0|1,0,2]=4 1812 B11R1.41 CCNc1ccccc1OC 7a_103624766699_200000210301 [0,1,0,0,0,0|1,0,2]=4 1813 B11R1.41 CCNc1ccccc1O[13CH3] 34a_103624766699_200025704644 [0,1,0,0,0,0|1,0,2]=4 1814 B11R1.41 CCNc1ccccc1O[13CH3] 7a_103624766699_200025704644 [0,1,0,0,0,0|1,0,2]=4 1815 B11R1.41 CCOc1ccccc1CO 34a_100011216872_100000210202 [0,1,0,0,0,0|1,0,2]=4 1816 B11R1.41 CCOc1ccccc1OC 34a_100000210385_100000210202 [0,1,0,0,0,0|1,0,2]=4 1817 B11R1.41 CCOc1ccccc1OC 34a_100000211404_200000210301 [0,1,0,0,0,0|1,0,2]=4 1818 B11R1.41 CCOc1ccccc1OC 7a_100000211404_200000210301 [0,1,0,0,0,0|1,0,2]=4 1819 B11R1.41 CCOc1ccccc1O[13CH3] 34a_100000211404_200025704644 [0,1,0,0,0,0|1,0,2]=4 1820 B11R1.41 CCOc1ccccc1O[13CH3] 7a_100000211404_200025704644 [0,1,0,0,0,0|1,0,2]=4 1821 B11R1.41 CCSc1ccccc1CO 62a_100000187465_100000210202 [0,1,0,0,0,0|1,0,2]=4 1822 B11R1.41 CCSc1ccccc1CO 62a_100000210202_100000187465 [0,1,0,0,0,0|1,0,2]=4 1823 B11R1.41 CCSc1ccccc1OC 62a_100000210202_100000210334 [0,1,0,0,0,0|1,0,2]=4 1824 B11R1.41 CCSc1ccccc1OC 62a_100000210334_100000210202 [0,1,0,0,0,0|1,0,2]=4 1825 B11R1.41 CCc1ccccc1CNC 207a_100102657272_100011219594 [0,1,0,0,0,0|2,0,1]=4 1826 B11R1.41 CCc1ccccc1CNC 270004a_106832991635_100011219594 [0,1,0,0,0,0|2,0,1]=4 1827 B11R1.41 CCc1ccccc1COC 34a_100011663872_200000210301 [0,1,0,0,0,0|2,0,1]=4 1828 B11R1.41 CCc1ccccc1COC 7a_100011663872_200000210301 [0,1,0,0,0,0|2,0,1]=4 1829 B11R1.41 CCc1ccccc1CO[13CH3] 34a_100011663872_200025704644 [0,1,0,0,0,0|2,0,1]=4 1830 B11R1.41 CCc1ccccc1CO[13CH3] 7a_100011663872_200025704644 [0,1,0,0,0,0|2,0,1]=4 1831 B11R1.41 CNCc1ccccc1C#N 2230a_106832991635_100000181865 [0,1,0,0,0,0|2,0,1]=4 1832 B11R1.41 CNCc1ccccc1C#N 34a_100016989011_200000210301 [0,1,0,0,0,0|2,0,1]=4 1833 B11R1.41 CNCc1ccccc1C#N 34a_100102657272_100000181865 [0,1,0,0,0,0|2,0,1]=4 1834 B11R1.41 CNCc1ccccc1C#N 7a_106832991635_100000181865 [0,1,0,0,0,0|2,0,1]=4 1835 B11R1.41 CNCc1ccccc1C=O 2230a_106832991635_200009853537 [0,1,0,0,0,0|1,0,2]=4 1836 B11R1.41 CNCc1ccccc1C=O 34a_100102657272_200009853537 [0,1,0,0,0,0|1,0,2]=4 1837 B11R1.41 CNCc1ccccc1C=O 7a_106832991635_200009853537 [0,1,0,0,0,0|1,0,2]=4 1838 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [0,1,0,0,0,0|1,0,1]=3 1839 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [0,1,0,0,0,0|1,0,1]=3 1840 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [0,1,0,0,0,0|1,0,1]=3 1841 B11R1.41 CNCc1ccccc1OC 207a_100102657272_100000169842 [0,1,0,0,0,0|1,0,1]=3 1842 B11R1.41 CNCc1ccccc1OC 2230a_106832991635_100000210004 [0,1,0,0,0,0|1,0,1]=3 1843 B11R1.41 CNCc1ccccc1OC 270004a_106832991635_100000169842 [0,1,0,0,0,0|1,0,1]=3 1844 B11R1.41 CNCc1ccccc1OC 34a_100000188900_200000210301 [0,1,0,0,0,0|1,0,1]=3 1845 B11R1.41 CNCc1ccccc1OC 34a_100015189988_200000210301 [0,1,0,0,0,0|1,0,1]=3 1846 B11R1.41 CNCc1ccccc1OC 34a_100102657272_100000210004 [0,1,0,0,0,0|1,0,1]=3 1847 B11R1.41 CNCc1ccccc1OC 7a_106832991635_100000210004 [0,1,0,0,0,0|1,0,1]=3 1848 B11R1.41 CNCc1ccccc1O[13CH3] 34a_100015189988_200025704644 [0,1,0,0,0,0|1,0,1]=3 1849 B11R1.41 CNCc1ccccc1SC 207a_100102657272_100011217347 [0,1,0,0,0,0|1,1,1]=4 1850 B11R1.41 CNCc1ccccc1SC 2230a_106832991635_100000699184 [0,1,0,0,0,0|1,1,1]=4 1851 B11R1.41 CNCc1ccccc1SC 270004a_106832991635_100011217347 [0,1,0,0,0,0|1,1,1]=4 1852 B11R1.41 CNCc1ccccc1SC 34a_100102657272_100000699184 [0,1,0,0,0,0|1,1,1]=4 1853 B11R1.41 CNCc1ccccc1SC 34a_102495365025_200000210301 [0,1,0,0,0,0|1,1,1]=4 1854 B11R1.41 CNCc1ccccc1SC 62a_100000184654_200000210301 [0,1,0,0,0,0|1,1,1]=4 1855 B11R1.41 CNCc1ccccc1SC 62a_200000210301_100000184654 [0,1,0,0,0,0|1,1,1]=4 1856 B11R1.41 CNCc1ccccc1SC 7a_106832991635_100000699184 [0,1,0,0,0,0|1,1,1]=4 1857 B11R1.41 CNCc1ccccc1S[13CH3] 62a_100000184654_200025704644 [0,1,0,0,0,0|1,1,1]=4 1858 B11R1.41 CNCc1ccccc1S[13CH3] 62a_200025704644_100000184654 [0,1,0,0,0,0|1,1,1]=4 1859 B11R1.41 CNCc1cccnc1OC 207a_100102657272_100011290804 [0,1,0,0,0,0|2,0,1]=4 1860 B11R1.41 CNCc1cccnc1OC 2230a_106832991635_100020631285 [0,1,0,0,0,0|2,0,1]=4 1861 B11R1.41 CNCc1cccnc1OC 270004a_106832991635_100011290804 [0,1,0,0,0,0|2,0,1]=4 1862 B11R1.41 CNCc1cccnc1OC 34a_100102657272_100020631285 [0,1,0,0,0,0|2,0,1]=4 1863 B11R1.41 CNCc1cccnc1OC 7a_106832991635_100020631285 [0,1,0,0,0,0|2,0,1]=4 1864 B11R1.41 CNCc1ccncc1OC 207a_100102657272_100011361505 [0,1,0,0,0,0|2,0,1]=4 1865 B11R1.41 CNCc1ccncc1OC 2230a_106832991635_100020635607 [0,1,0,0,0,0|2,0,1]=4 1866 B11R1.41 CNCc1ccncc1OC 270004a_106832991635_100011361505 [0,1,0,0,0,0|2,0,1]=4 1867 B11R1.41 CNCc1ccncc1OC 7a_106832991635_100020635607 [0,1,0,0,0,0|2,0,1]=4 1868 B11R1.41 CNCc1cnccc1OC 207a_100102657272_200011997045 [0,1,0,0,0,0|2,0,1]=4 1869 B11R1.41 CNCc1cnccc1OC 270004a_106832991635_200011997045 [0,1,0,0,0,0|2,0,1]=4 1870 B11R1.41 CNCc1ncccc1OC 207a_100102657272_100011912573 [0,1,0,0,0,0|2,0,1]=4 1871 B11R1.41 CNCc1ncccc1OC 270004a_106832991635_100011912573 [0,1,0,0,0,0|2,0,1]=4 1872 B11R1.41 CNc1ccccc1CCO 2230a_100011215289_200000210301 [0,1,0,0,0,0|2,0,1]=4 1873 B11R1.41 CNc1ccccc1CCO 34a_100011215289_200000210301 [0,1,0,0,0,0|2,0,1]=4 1874 B11R1.41 COCc1ccccc1C#N 34a_100138415774_100000181865 [0,1,0,0,0,0|2,0,1]=4 1875 B11R1.41 COCc1ccccc1C#N 34a_200011269968_200000210301 [0,1,0,0,0,0|2,0,1]=4 1876 B11R1.41 COCc1ccccc1C#N 7a_200011269968_200000210301 [0,1,0,0,0,0|2,0,1]=4 1877 B11R1.41 COCc1ccccc1C=O 34a_100138415774_200009853537 [0,1,0,0,0,0|1,0,2]=4 1878 B11R1.41 COCc1ccccc1CBr 34a_100009816955_200000210301 [0,1,0,0,0,0|2,0,1]=4 1879 B11R1.41 COCc1ccccc1CBr 7a_100009816955_200000210301 [0,1,0,0,0,0|2,0,1]=4 1880 B11R1.41 COCc1ccccc1CN 34a_100000743596_200000210301 [0,1,0,0,0,0|2,0,1]=4 1881 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [0,1,0,0,0,0|1,0,1]=3 1882 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [0,1,0,0,0,0|1,0,1]=3 1883 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [0,1,0,0,0,0|1,0,1]=3 1884 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [0,1,0,0,0,0|1,0,1]=3 1885 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [0,1,0,0,0,0|1,0,1]=3 1886 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [0,1,0,0,0,0|1,0,1]=3 1887 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [0,1,0,0,0,0|1,0,1]=3 1888 B11R1.41 COCc1ccccc1SC 34a_100000699167_200000210301 [0,1,0,0,0,0|1,1,1]=4 1889 B11R1.41 COCc1ccccc1SC 34a_100138415774_100000699184 [0,1,0,0,0,0|1,1,1]=4 1890 B11R1.41 COCc1ccccc1SC 62a_100011493684_200000210301 [0,1,0,0,0,0|1,1,1]=4 1891 B11R1.41 COCc1ccccc1SC 62a_200000210301_100011493684 [0,1,0,0,0,0|1,1,1]=4 1892 B11R1.41 COCc1ccccc1S[13CH3] 62a_100011493684_200025704644 [0,1,0,0,0,0|1,1,1]=4 1893 B11R1.41 COCc1ccccc1S[13CH3] 62a_200025704644_100011493684 [0,1,0,0,0,0|1,1,1]=4 1894 B11R1.41 COCc1cccnc1OC 34a_100000717863_200000210301 [0,1,0,0,0,0|2,0,1]=4 1895 B11R1.41 COCc1cccnc1OC 34a_100138415774_100020631285 [0,1,0,0,0,0|2,0,1]=4 1896 B11R1.41 COCc1ncccc1OC 34a_100011998681_200000210301 [0,1,0,0,0,0|2,0,1]=4 1897 B11R1.41 COc1ccccc1CC#N 34a_100000043107_200000210301 [0,1,0,0,0,0|1,0,1]=3 1898 B11R1.41 COc1ccccc1CC#N 7a_100000043107_200000210301 [0,1,0,0,0,0|1,0,1]=3 1899 B11R1.41 COc1ccccc1CCBr 34a_100000722297_200000210301 [0,1,0,0,0,0|1,0,1]=3 1900 B11R1.41 COc1ccccc1CCBr 7a_100000722297_200000210301 [0,1,0,0,0,0|1,0,1]=3 1901 B11R1.41 COc1ccccc1CCN 34a_100011207237_200000210301 [0,1,0,0,0,0|1,0,1]=3 1902 B11R1.41 COc1ccccc1CCO 34a_100000719421_200000210301 [0,1,0,0,0,0|1,0,1]=3 1903 B11R1.41 COc1ccccc1CCO 7a_100000719421_200000210301 [0,1,0,0,0,0|1,0,1]=3 1904 B11R1.41 COc1ccccc1CN[13CH3] 34a_100000188900_200025704644 [0,1,0,0,0,0|1,0,1]=3 1905 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [0,1,0,0,0,0|1,0,1]=3 1906 B11R1.41 COc1ccccc1CSC 62a_100000210004_200000210301 [0,1,0,0,0,0|1,0,1]=3 1907 B11R1.41 COc1ccccc1CSC 62a_200000210301_100000210004 [0,1,0,0,0,0|1,0,1]=3 1908 B11R1.41 COc1ccccc1CS[13CH3] 62a_100000210004_200025704644 [0,1,0,0,0,0|1,0,1]=3 1909 B11R1.41 COc1ccccc1CS[13CH3] 62a_200025704644_100000210004 [0,1,0,0,0,0|1,0,1]=3 1910 B11R1.41 COc1ccccc1NCF 34a_100000210025_100015361967 [0,1,0,0,0,0|2,0,1]=4 1911 B11R1.41 COc1ccccc1OCF 34a_100000210385_100015361967 [0,1,0,0,0,0|2,0,1]=4 1912 B11R1.41 COc1ccccc1SCF 62a_100000210334_100015361967 [0,1,0,0,0,0|2,0,1]=4 1913 B11R1.41 COc1ccccc1SCF 62a_100015361967_100000210334 [0,1,0,0,0,0|2,0,1]=4 1914 B11R1.41 COc1cccnc1CO[13CH3] 34a_100011998681_200025704644 [0,1,0,0,0,0|2,0,1]=4 1915 B11R1.41 COc1cnccc1CSC 62a_100020635607_200000210301 [0,1,0,0,0,0|2,0,1]=4 1916 B11R1.41 COc1cnccc1CSC 62a_200000210301_100020635607 [0,1,0,0,0,0|2,0,1]=4 1917 B11R1.41 COc1cnccc1CS[13CH3] 62a_100020635607_200025704644 [0,1,0,0,0,0|2,0,1]=4 1918 B11R1.41 COc1cnccc1CS[13CH3] 62a_200025704644_100020635607 [0,1,0,0,0,0|2,0,1]=4 1919 B11R1.41 COc1ncccc1CO[13CH3] 34a_100000717863_200025704644 [0,1,0,0,0,0|2,0,1]=4 1920 B11R1.41 COc1ncccc1CSC 62a_100020631285_200000210301 [0,1,0,0,0,0|2,0,1]=4 1921 B11R1.41 COc1ncccc1CSC 62a_200000210301_100020631285 [0,1,0,0,0,0|2,0,1]=4 1922 B11R1.41 COc1ncccc1CS[13CH3] 62a_100020631285_200025704644 [0,1,0,0,0,0|2,0,1]=4 1923 B11R1.41 COc1ncccc1CS[13CH3] 62a_200025704644_100020631285 [0,1,0,0,0,0|2,0,1]=4 1924 B11R1.41 CSCc1ccccc1C#N 62a_100000186380_200000210301 [0,1,0,0,0,0|2,0,1]=4 1925 B11R1.41 CSCc1ccccc1C#N 62a_200000210301_100000181865 [0,1,0,0,0,0|2,0,1]=4 1926 B11R1.41 CSCc1ccccc1C=O 62a_200000210301_200009853537 [0,1,0,0,0,0|1,0,2]=4 1927 B11R1.41 CSCc1ccccc1C=O 62a_200009853537_200000210301 [0,1,0,0,0,0|1,0,2]=4 1928 B11R1.41 CSCc1ccccc1CO 62a_100009816955_200000210301 [0,1,0,0,0,0|1,0,1]=3 1929 B11R1.41 CSCc1ccccc1CO 62a_200000210301_100009816955 [0,1,0,0,0,0|1,0,1]=3 1930 B11R1.41 CSCc1ccccc1SC 62a_100000148299_200000210301 [0,1,0,0,0,0|1,1,1]=4 1931 B11R1.41 CSCc1ccccc1SC 62a_100000699184_200000210301 [0,1,0,0,0,0|1,1,1]=4 1932 B11R1.41 CSCc1ccccc1SC 62a_200000210301_100000148299 [0,1,0,0,0,0|1,1,1]=4 1933 B11R1.41 CSCc1ccccc1SC 62a_200000210301_100000699184 [0,1,0,0,0,0|1,1,1]=4 1934 B11R1.41 CSCc1ccccc1S[13CH3] 62a_100000148299_200025704644 [0,1,0,0,0,0|1,1,1]=4 1935 B11R1.41 CSCc1ccccc1S[13CH3] 62a_200025704644_100000148299 [0,1,0,0,0,0|1,1,1]=4 1936 B11R1.41 CSc1ccccc1CC#N 62a_100000033512_200000210301 [0,1,0,0,0,0|1,1,1]=4 1937 B11R1.41 CSc1ccccc1CC#N 62a_200000210301_100000033512 [0,1,0,0,0,0|1,1,1]=4 1938 B11R1.41 CSc1ccccc1CCN 62a_100000747383_200000210301 [0,1,0,0,0,0|1,1,1]=4 1939 B11R1.41 CSc1ccccc1CCN 62a_200000210301_100000747383 [0,1,0,0,0,0|1,1,1]=4 1940 B11R1.41 CSc1ccccc1CCO 62a_100000731337_200000210301 [0,1,0,0,0,0|1,1,1]=4 1941 B11R1.41 CSc1ccccc1CCO 62a_200000210301_100000731337 [0,1,0,0,0,0|1,1,1]=4 1942 B11R1.41 CSc1ccccc1CNN 62a_200000210301_200016993956 [0,1,0,0,0,0|2,1,0]=4 1943 B11R1.41 CSc1ccccc1CNN 62a_200016993956_200000210301 [0,1,0,0,0,0|2,1,0]=4 1944 B11R1.41 CSc1ccccc1CN[13CH3] 34a_102495365025_200025704644 [0,1,0,0,0,0|1,1,1]=4 1945 B11R1.41 CSc1ccccc1CO[13CH3] 34a_100000699167_200025704644 [0,1,0,0,0,0|1,1,1]=4 1946 B11R1.41 CSc1ccccc1CS[13CH3] 62a_100000699184_200025704644 [0,1,0,0,0,0|1,1,1]=4 1947 B11R1.41 CSc1ccccc1CS[13CH3] 62a_200025704644_100000699184 [0,1,0,0,0,0|1,1,1]=4 1948 B11R1.41 CSc1ccccc1NC=O 62a_200000210301_200020615051 [0,1,0,0,0,0|2,1,0]=4 1949 B11R1.41 CSc1ccccc1NC=O 62a_200020615051_200000210301 [0,1,0,0,0,0|2,1,0]=4 1950 B11R1.41 OCc1ccccc1NCF 34a_100000212039_100015361967 [0,1,0,0,0,0|2,0,1]=4 1951 B11R1.41 OCc1ccccc1OCF 34a_100011216872_100015361967 [0,1,0,0,0,0|2,0,1]=4 1952 B11R1.41 OCc1ccccc1SCF 62a_100000187465_100015361967 [0,1,0,0,0,0|2,0,1]=4 1953 B11R1.41 OCc1ccccc1SCF 62a_100015361967_100000187465 [0,1,0,0,0,0|2,0,1]=4 1954 B11R1.41 [13CH3]NCc1ccccc1C#N 34a_100016989011_200025704644 [0,1,0,0,0,0|2,0,1]=4 1955 B11R1.41 [13CH3]Nc1ccccc1CCO 2230a_100011215289_200025704644 [0,1,0,0,0,0|2,0,1]=4 1956 B11R1.41 [13CH3]Nc1ccccc1CCO 34a_100011215289_200025704644 [0,1,0,0,0,0|2,0,1]=4 1957 B11R1.41 [13CH3]OCc1ccccc1C#N 34a_200011269968_200025704644 [0,1,0,0,0,0|2,0,1]=4 1958 B11R1.41 [13CH3]OCc1ccccc1C#N 7a_200011269968_200025704644 [0,1,0,0,0,0|2,0,1]=4 1959 B11R1.41 [13CH3]OCc1ccccc1CBr 34a_100009816955_200025704644 [0,1,0,0,0,0|2,0,1]=4 1960 B11R1.41 [13CH3]OCc1ccccc1CBr 7a_100009816955_200025704644 [0,1,0,0,0,0|2,0,1]=4 1961 B11R1.41 [13CH3]OCc1ccccc1CN 34a_100000743596_200025704644 [0,1,0,0,0,0|2,0,1]=4 1962 B11R1.41 [13CH3]Oc1ccccc1CC#N 34a_100000043107_200025704644 [0,1,0,0,0,0|1,0,1]=3 1963 B11R1.41 [13CH3]Oc1ccccc1CC#N 7a_100000043107_200025704644 [0,1,0,0,0,0|1,0,1]=3 1964 B11R1.41 [13CH3]Oc1ccccc1CCBr 34a_100000722297_200025704644 [0,1,0,0,0,0|1,0,1]=3 1965 B11R1.41 [13CH3]Oc1ccccc1CCBr 7a_100000722297_200025704644 [0,1,0,0,0,0|1,0,1]=3 1966 B11R1.41 [13CH3]Oc1ccccc1CCN 34a_100011207237_200025704644 [0,1,0,0,0,0|1,0,1]=3 1967 B11R1.41 [13CH3]Oc1ccccc1CCO 34a_100000719421_200025704644 [0,1,0,0,0,0|1,0,1]=3 1968 B11R1.41 [13CH3]Oc1ccccc1CCO 7a_100000719421_200025704644 [0,1,0,0,0,0|1,0,1]=3 1969 B11R1.41 [13CH3]SCc1ccccc1C#N 62a_100000186380_200025704644 [0,1,0,0,0,0|2,0,1]=4 1970 B11R1.41 [13CH3]SCc1ccccc1C#N 62a_200025704644_100000181865 [0,1,0,0,0,0|2,0,1]=4 1971 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200009853537_200025704644 [0,1,0,0,0,0|1,0,2]=4 1972 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200025704644_200009853537 [0,1,0,0,0,0|1,0,2]=4 1973 B11R1.41 [13CH3]SCc1ccccc1CO 62a_100009816955_200025704644 [0,1,0,0,0,0|1,0,1]=3 1974 B11R1.41 [13CH3]SCc1ccccc1CO 62a_200025704644_100009816955 [0,1,0,0,0,0|1,0,1]=3 1975 B11R1.41 [13CH3]Sc1ccccc1CC#N 62a_100000033512_200025704644 [0,1,0,0,0,0|1,1,1]=4 1976 B11R1.41 [13CH3]Sc1ccccc1CC#N 62a_200025704644_100000033512 [0,1,0,0,0,0|1,1,1]=4 1977 B11R1.41 [13CH3]Sc1ccccc1CCN 62a_100000747383_200025704644 [0,1,0,0,0,0|1,1,1]=4 1978 B11R1.41 [13CH3]Sc1ccccc1CCN 62a_200025704644_100000747383 [0,1,0,0,0,0|1,1,1]=4 1979 B11R1.41 [13CH3]Sc1ccccc1CCO 62a_100000731337_200025704644 [0,1,0,0,0,0|1,1,1]=4 1980 B11R1.41 [13CH3]Sc1ccccc1CCO 62a_200025704644_100000731337 [0,1,0,0,0,0|1,1,1]=4 1981 B11R1.41 [13CH3]Sc1ccccc1CNN 62a_200016993956_200025704644 [0,1,0,0,0,0|2,1,0]=4 1982 B11R1.41 [13CH3]Sc1ccccc1CNN 62a_200025704644_200016993956 [0,1,0,0,0,0|2,1,0]=4 1983 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200020615051_200025704644 [0,1,0,0,0,0|2,1,0]=4 1984 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200025704644_200020615051 [0,1,0,0,0,0|2,1,0]=4 1985 B11R1.81 C=C=Cc1ccc(cc1Br)Br 271570a_100015277604_100011484698 [0,1,0,0,0,0|1,0,2]=4 1986 B11R1.81 C=C=Cc1ccc(cc1Br)C 271570a_100015277604_100009813563 [0,1,0,0,0,0|1,0,2]=4 1987 B11R1.81 C=C=Cc1ccc(cc1Br)Cl 271570a_100015277604_100011219703 [0,1,0,0,0,0|1,0,2]=4 1988 B11R1.81 C=C=Cc1ccc(cc1Br)F 271570a_100015277604_100011217111 [0,1,0,0,0,0|1,0,2]=4 1989 B11R1.81 C=C=Cc1ccc(cc1Br)N 271570a_100015277604_100000750458 [0,1,0,0,0,0|1,0,2]=4 1990 B11R1.81 C=C=Cc1ccc(cc1Br)O 271570a_100015277604_100000701344 [0,1,0,0,0,0|1,0,2]=4 1991 B11R1.81 C=C=Cc1ccc(cc1C)Br 271570a_100015277604_100000701812 [0,1,0,0,0,0|1,0,2]=4 1992 B11R1.81 C=C=Cc1ccc(cc1C)C 271570a_100015277604_100011217332 [0,1,0,0,0,0|1,0,2]=4 1993 B11R1.81 C=C=Cc1ccc(cc1C)Cl 271570a_100015277604_100011219607 [0,1,0,0,0,0|1,0,2]=4 1994 B11R1.81 C=C=Cc1ccc(cc1C)F 271570a_100015277604_100011205405 [0,1,0,0,0,0|1,0,2]=4 1995 B11R1.81 C=C=Cc1ccc(cc1C)N 271570a_100015277604_100000210723 [0,1,0,0,0,0|1,0,2]=4 1996 B11R1.81 C=C=Cc1ccc(cc1C)O 271570a_100015277604_100000729255 [0,1,0,0,0,0|1,0,2]=4 1997 B11R1.81 C=C=Cc1ccc(cc1Cl)Br 271570a_100015277604_100011216062 [0,1,0,0,0,0|1,0,2]=4 1998 B11R1.81 C=C=Cc1ccc(cc1Cl)C 271570a_100015277604_100011263221 [0,1,0,0,0,0|1,0,2]=4 1999 B11R1.81 C=C=Cc1ccc(cc1Cl)Cl 271570a_100015277604_100000699841 [0,1,0,0,0,0|1,0,2]=4 2000 B11R1.81 C=C=Cc1ccc(cc1Cl)F 271570a_100015277604_100000733362 [0,1,0,0,0,0|1,0,2]=4 2001 B11R1.81 C=C=Cc1ccc(cc1Cl)N 271570a_100015277604_100000761885 [0,1,0,0,0,0|1,0,2]=4 2002 B11R1.81 C=C=Cc1ccc(cc1Cl)O 271570a_100015277604_100000047559 [0,1,0,0,0,0|1,0,2]=4 2003 B11R1.81 C=C=Cc1ccc(cc1F)Br 271570a_100015277604_100009814013 [0,1,0,0,0,0|1,0,2]=4 2004 B11R1.81 C=C=Cc1ccc(cc1F)C 271570a_100015277604_100011216119 [0,1,0,0,0,0|1,0,2]=4 2005 B11R1.81 C=C=Cc1ccc(cc1F)Cl 271570a_100015277604_100011216042 [0,1,0,0,0,0|1,0,2]=4 2006 B11R1.81 C=C=Cc1ccc(cc1F)F 271570a_100015277604_100000750030 [0,1,0,0,0,0|1,0,2]=4 2007 B11R1.81 C=C=Cc1ccc(cc1F)N 271570a_100015277604_100011356925 [0,1,0,0,0,0|1,0,2]=4 2008 B11R1.81 C=C=Cc1ccc(cc1F)O 271570a_100015277604_100000755031 [0,1,0,0,0,0|1,0,2]=4 2009 B11R1.81 C=C=Cc1ccc(cc1N)Br 271570a_100015277604_100000743836 [0,1,0,0,0,0|1,0,2]=4 2010 B11R1.81 C=C=Cc1ccc(cc1N)C 271570a_100015277604_100011216686 [0,1,0,0,0,0|1,0,2]=4 2011 B11R1.81 C=C=Cc1ccc(cc1N)Cl 271570a_100015277604_100000761886 [0,1,0,0,0,0|1,0,2]=4 2012 B11R1.81 C=C=Cc1ccc(cc1N)F 271570a_100015277604_100011218093 [0,1,0,0,0,0|1,0,2]=4 2013 B11R1.81 C=C=Cc1ccc(cc1N)N 271570a_100015277604_200012175722 [0,1,0,0,0,0|1,0,2]=4 2014 B11R1.81 C=C=Cc1ccc(cc1N)O 271570a_100015277604_100011999798 [0,1,0,0,0,0|1,0,2]=4 2015 B11R1.81 C=C=Cc1ccc(cc1O)Br 271570a_100015277604_100012344904 [0,1,0,0,0,0|0,0,2]=3 2016 B11R1.81 C=C=Cc1ccc(cc1O)C 271570a_100015277604_100012002257 [0,1,0,0,0,0|0,0,2]=3 2017 B11R1.81 C=C=Cc1ccc(cc1O)Cl 271570a_100015277604_100000050036 [0,1,0,0,0,0|0,0,2]=3 2018 B11R1.81 C=C=Cc1ccc(cc1O)F 271570a_100015277604_100000690578 [0,1,0,0,0,0|0,0,2]=3 2019 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [0,1,0,0,0,0|0,0,2]=3 2020 B11R1.81 C=C=Cc1ccc(nc1O)C 271570a_100015277604_100009817604 [0,1,0,0,0,0|1,0,2]=4 2021 B11R1.81 C=C=Cc1cnc(cc1O)C 271570a_100015277604_100011016184 [0,1,0,0,0,0|1,0,2]=4 2022 B11R1.81 C=C=Cc1ncc(cc1O)Br 271570a_100015277604_100010210634 [0,1,0,0,0,0|1,0,2]=4 2023 B11R1.81 C=C=Cc1ncc(cc1O)C 271570a_100015277604_100012000487 [0,1,0,0,0,0|1,0,2]=4 2024 B11R1.81 C=C=Cc1ncc(cc1O)Cl 271570a_100015277604_100010233512 [0,1,0,0,0,0|1,0,2]=4 2025 B11R1.81 C=C=Cc1ncc(cc1O)F 271570a_100015277604_100000079967 [0,1,0,0,0,0|1,0,2]=4 2026 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [0,1,0,0,0,0|1,0,2]=4 2027 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [0,1,0,0,0,0|1,0,2]=4 2028 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [0,1,0,0,0,0|1,0,2]=4 2029 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [0,1,0,0,0,0|1,0,2]=4 2030 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [0,1,0,0,0,0|1,0,2]=4 2031 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [0,1,0,0,0,0|1,0,2]=4 2032 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [0,1,0,0,0,0|1,0,2]=4 2033 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,1,0,0,0,0|1,0,2]=4 2034 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [0,1,0,0,0,0|1,0,2]=4 2035 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [0,1,0,0,0,0|1,0,2]=4 2036 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [0,1,0,0,0,0|1,0,2]=4 2037 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [0,1,0,0,0,0|1,0,2]=4 2038 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [0,1,0,0,0,0|1,0,2]=4 2039 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [0,1,0,0,0,0|1,0,2]=4 2040 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [0,1,0,0,0,0|1,0,2]=4 2041 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [0,1,0,0,0,0|1,0,2]=4 2042 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [0,1,0,0,0,0|1,0,2]=4 2043 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [0,1,0,0,0,0|1,0,2]=4 2044 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [0,1,0,0,0,0|1,0,2]=4 2045 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [0,1,0,0,0,0|1,0,2]=4 2046 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [0,1,0,0,0,0|1,0,2]=4 2047 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [0,1,0,0,0,0|1,0,2]=4 2048 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [0,1,0,0,0,0|1,0,2]=4 2049 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [0,1,0,0,0,0|1,0,2]=4 2050 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [0,1,0,0,0,0|1,0,2]=4 2051 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,1,0,0,0,0|1,0,2]=4 2052 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [0,1,0,0,0,0|1,0,2]=4 2053 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [0,1,0,0,0,0|1,0,2]=4 2054 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [0,1,0,0,0,0|1,0,2]=4 2055 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [0,1,0,0,0,0|1,0,2]=4 2056 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [0,1,0,0,0,0|0,0,2]=3 2057 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [0,1,0,0,0,0|0,0,2]=3 2058 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [0,1,0,0,0,0|0,0,2]=3 2059 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [0,1,0,0,0,0|0,0,2]=3 2060 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [0,1,0,0,0,0|0,0,2]=3 2061 B11R1.81 CC=Cc1ccc(nc1O)C 271570a_100016259895_100009817604 [0,1,0,0,0,0|1,0,2]=4 2062 B11R1.81 CC=Cc1cnc(cc1O)C 271570a_100016259895_100011016184 [0,1,0,0,0,0|1,0,2]=4 2063 B11R1.81 CC=Cc1ncc(cc1O)Br 271570a_100016259895_100010210634 [0,1,0,0,0,0|1,0,2]=4 2064 B11R1.81 CC=Cc1ncc(cc1O)C 271570a_100016259895_100012000487 [0,1,0,0,0,0|1,0,2]=4 2065 B11R1.81 CC=Cc1ncc(cc1O)Cl 271570a_100016259895_100010233512 [0,1,0,0,0,0|1,0,2]=4 2066 B11R1.81 CC=Cc1ncc(cc1O)F 271570a_100016259895_100000079967 [0,1,0,0,0,0|1,0,2]=4 2067 B11R1.81 CCNc1ccc(cc1O)Br 34a_100000739049_100000210202 [0,1,0,0,0,0|1,0,2]=4 2068 B11R1.81 CCNc1ccc(cc1O)C 34a_100000211527_100000210202 [0,1,0,0,0,0|1,0,2]=4 2069 B11R1.81 CCNc1ccc(cc1O)Cl 34a_100000185728_100000210202 [0,1,0,0,0,0|1,0,2]=4 2070 B11R1.81 CCNc1ccc(cc1O)F 34a_100000753323_100000210202 [0,1,0,0,0,0|1,0,2]=4 2071 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [0,1,0,0,0,0|1,0,2]=4 2072 B11R1.81 CCOc1ccc(cc1O)C 271570a_203496583355_200000230997 [0,1,0,0,0,0|1,0,2]=4 2073 B11R1.81 CCOc1ccc(cc1O)F 271570a_203496583355_100000171695 [0,1,0,0,0,0|1,0,2]=4 2074 B11R1.81 CCSc1ccc(cc1O)Br 62a_100000210202_100012344904 [0,1,0,0,0,0|1,0,2]=4 2075 B11R1.81 CCSc1ccc(cc1O)Br 62a_100012344904_100000210202 [0,1,0,0,0,0|1,0,2]=4 2076 B11R1.81 CCSc1ccc(cc1O)C 62a_100000210202_100012002257 [0,1,0,0,0,0|1,0,2]=4 2077 B11R1.81 CCSc1ccc(cc1O)C 62a_100012002257_100000210202 [0,1,0,0,0,0|1,0,2]=4 2078 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000050036_100000210202 [0,1,0,0,0,0|1,0,2]=4 2079 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000210202_100000050036 [0,1,0,0,0,0|1,0,2]=4 2080 B11R1.81 CCSc1ccc(cc1O)F 62a_100000210202_100000690578 [0,1,0,0,0,0|1,0,2]=4 2081 B11R1.81 CCSc1ccc(cc1O)F 62a_100000690578_100000210202 [0,1,0,0,0,0|1,0,2]=4 2082 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [0,1,0,0,0,0|1,0,2]=4 2083 B11R1.81 CNCc1ccc(cc1Br)Br 207a_100102657272_100012351556 [0,1,0,0,0,0|2,0,1]=4 2084 B11R1.81 CNCc1ccc(cc1Br)Br 2230a_106832991635_200012351560 [0,1,0,0,0,0|2,0,1]=4 2085 B11R1.81 CNCc1ccc(cc1Br)Br 26a_100102657272_100000188717 [0,1,0,0,0,0|2,0,1]=4 2086 B11R1.81 CNCc1ccc(cc1Br)Br 270004a_106832991635_100012351556 [0,1,0,0,0,0|2,0,1]=4 2087 B11R1.81 CNCc1ccc(cc1Br)Br 34a_100102657272_200012351560 [0,1,0,0,0,0|2,0,1]=4 2088 B11R1.81 CNCc1ccc(cc1Br)Br 7a_106832991635_200012351560 [0,1,0,0,0,0|2,0,1]=4 2089 B11R1.81 CNCc1ccc(cc1Br)C 207a_100102657272_100000692596 [0,1,0,0,0,0|2,0,1]=4 2090 B11R1.81 CNCc1ccc(cc1Br)C 26a_100102657272_100000210800 [0,1,0,0,0,0|2,0,1]=4 2091 B11R1.81 CNCc1ccc(cc1Br)C 270004a_106832991635_100000692596 [0,1,0,0,0,0|2,0,1]=4 2092 B11R1.81 CNCc1ccc(cc1Br)Cl 207a_100102657272_100000687667 [0,1,0,0,0,0|2,0,1]=4 2093 B11R1.81 CNCc1ccc(cc1Br)Cl 2230a_106832991635_100000755608 [0,1,0,0,0,0|2,0,1]=4 2094 B11R1.81 CNCc1ccc(cc1Br)Cl 26a_100102657272_100000211998 [0,1,0,0,0,0|2,0,1]=4 2095 B11R1.81 CNCc1ccc(cc1Br)Cl 270004a_106832991635_100000687667 [0,1,0,0,0,0|2,0,1]=4 2096 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102657272_100000755608 [0,1,0,0,0,0|2,0,1]=4 2097 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102692131_200000210301 [0,1,0,0,0,0|2,0,1]=4 2098 B11R1.81 CNCc1ccc(cc1Br)Cl 7a_106832991635_100000755608 [0,1,0,0,0,0|2,0,1]=4 2099 B11R1.81 CNCc1ccc(cc1Br)F 207a_100102657272_100000685661 [0,1,0,0,0,0|2,0,1]=4 2100 B11R1.81 CNCc1ccc(cc1Br)F 2230a_106832991635_100000243222 [0,1,0,0,0,0|2,0,1]=4 2101 B11R1.81 CNCc1ccc(cc1Br)F 26a_100102657272_100000211999 [0,1,0,0,0,0|2,0,1]=4 2102 B11R1.81 CNCc1ccc(cc1Br)F 270004a_106832991635_100000685661 [0,1,0,0,0,0|2,0,1]=4 2103 B11R1.81 CNCc1ccc(cc1Br)F 34a_100000708791_200000210301 [0,1,0,0,0,0|2,0,1]=4 2104 B11R1.81 CNCc1ccc(cc1Br)F 34a_100102657272_100000243222 [0,1,0,0,0,0|2,0,1]=4 2105 B11R1.81 CNCc1ccc(cc1Br)F 7a_106832991635_100000243222 [0,1,0,0,0,0|2,0,1]=4 2106 B11R1.81 CNCc1ccc(cc1Br)I 207a_100102657272_100010185650 [0,1,0,0,0,0|2,0,1]=4 2107 B11R1.81 CNCc1ccc(cc1Br)I 2230a_106832991635_100010146610 [0,1,0,0,0,0|2,0,1]=4 2108 B11R1.81 CNCc1ccc(cc1Br)I 26a_100102657272_100012361655 [0,1,0,0,0,0|2,0,1]=4 2109 B11R1.81 CNCc1ccc(cc1Br)I 34a_100102657272_100010146610 [0,1,0,0,0,0|2,0,1]=4 2110 B11R1.81 CNCc1ccc(cc1Br)I 7a_106832991635_100010146610 [0,1,0,0,0,0|2,0,1]=4 2111 B11R1.81 CNCc1ccc(cc1C)Br 207a_100102657272_100000687586 [0,1,0,0,0,0|2,0,1]=4 2112 B11R1.81 CNCc1ccc(cc1C)Br 2230a_106832991635_100000708836 [0,1,0,0,0,0|2,0,1]=4 2113 B11R1.81 CNCc1ccc(cc1C)Br 26a_100102657272_100000186361 [0,1,0,0,0,0|2,0,1]=4 2114 B11R1.81 CNCc1ccc(cc1C)Br 270004a_106832991635_100000687586 [0,1,0,0,0,0|2,0,1]=4 2115 B11R1.81 CNCc1ccc(cc1C)Br 34a_100000753881_200000210301 [0,1,0,0,0,0|2,0,1]=4 2116 B11R1.81 CNCc1ccc(cc1C)Br 34a_100102657272_100000708836 [0,1,0,0,0,0|2,0,1]=4 2117 B11R1.81 CNCc1ccc(cc1C)Br 7a_106832991635_100000708836 [0,1,0,0,0,0|2,0,1]=4 2118 B11R1.81 CNCc1ccc(cc1C)C 207a_100102657272_100000211342 [0,1,0,0,0,0|2,0,1]=4 2119 B11R1.81 CNCc1ccc(cc1C)C 2230a_106832991635_100011219618 [0,1,0,0,0,0|2,0,1]=4 2120 B11R1.81 CNCc1ccc(cc1C)C 270004a_106832991635_100000211342 [0,1,0,0,0,0|2,0,1]=4 2121 B11R1.81 CNCc1ccc(cc1C)C 34a_100000737523_200000210301 [0,1,0,0,0,0|2,0,1]=4 2122 B11R1.81 CNCc1ccc(cc1C)C 34a_100102657272_100011219618 [0,1,0,0,0,0|2,0,1]=4 2123 B11R1.81 CNCc1ccc(cc1C)C 7a_106832991635_100011219618 [0,1,0,0,0,0|2,0,1]=4 2124 B11R1.81 CNCc1ccc(cc1C)Cl 207a_100102657272_100000766358 [0,1,0,0,0,0|2,0,1]=4 2125 B11R1.81 CNCc1ccc(cc1C)Cl 2230a_106832991635_100012361307 [0,1,0,0,0,0|2,0,1]=4 2126 B11R1.81 CNCc1ccc(cc1C)Cl 270004a_106832991635_100000766358 [0,1,0,0,0,0|2,0,1]=4 2127 B11R1.81 CNCc1ccc(cc1C)Cl 34a_100102657272_100012361307 [0,1,0,0,0,0|2,0,1]=4 2128 B11R1.81 CNCc1ccc(cc1C)Cl 34a_103436540063_200000210301 [0,1,0,0,0,0|2,0,1]=4 2129 B11R1.81 CNCc1ccc(cc1C)Cl 7a_106832991635_100012361307 [0,1,0,0,0,0|2,0,1]=4 2130 B11R1.81 CNCc1ccc(cc1C)F 207a_100102657272_100000745986 [0,1,0,0,0,0|2,0,1]=4 2131 B11R1.81 CNCc1ccc(cc1C)F 2230a_106832991635_100000700533 [0,1,0,0,0,0|2,0,1]=4 2132 B11R1.81 CNCc1ccc(cc1C)F 270004a_106832991635_100000745986 [0,1,0,0,0,0|2,0,1]=4 2133 B11R1.81 CNCc1ccc(cc1C)F 34a_100102657272_100000700533 [0,1,0,0,0,0|2,0,1]=4 2134 B11R1.81 CNCc1ccc(cc1C)F 34a_100137329023_200000210301 [0,1,0,0,0,0|2,0,1]=4 2135 B11R1.81 CNCc1ccc(cc1C)F 7a_106832991635_100000700533 [0,1,0,0,0,0|2,0,1]=4 2136 B11R1.81 CNCc1ccc(cc1Cl)Br 207a_100102657272_100000764164 [0,1,0,0,0,0|2,0,1]=4 2137 B11R1.81 CNCc1ccc(cc1Cl)Br 2230a_106832991635_100011740631 [0,1,0,0,0,0|2,0,1]=4 2138 B11R1.81 CNCc1ccc(cc1Cl)Br 26a_100102657272_100000186472 [0,1,0,0,0,0|2,0,1]=4 2139 B11R1.81 CNCc1ccc(cc1Cl)Br 270004a_106832991635_100000764164 [0,1,0,0,0,0|2,0,1]=4 2140 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100020628970_200000210301 [0,1,0,0,0,0|2,0,1]=4 2141 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100102657272_100011740631 [0,1,0,0,0,0|2,0,1]=4 2142 B11R1.81 CNCc1ccc(cc1Cl)Br 7a_106832991635_100011740631 [0,1,0,0,0,0|2,0,1]=4 2143 B11R1.81 CNCc1ccc(cc1Cl)C 207a_100102657272_100011935181 [0,1,0,0,0,0|2,0,1]=4 2144 B11R1.81 CNCc1ccc(cc1Cl)C 2230a_106832991635_100012349684 [0,1,0,0,0,0|2,0,1]=4 2145 B11R1.81 CNCc1ccc(cc1Cl)C 26a_100102657272_100000749699 [0,1,0,0,0,0|2,0,1]=4 2146 B11R1.81 CNCc1ccc(cc1Cl)C 270004a_106832991635_100011935181 [0,1,0,0,0,0|2,0,1]=4 2147 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100011997539_200000210301 [0,1,0,0,0,0|2,0,1]=4 2148 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100102657272_100012349684 [0,1,0,0,0,0|2,0,1]=4 2149 B11R1.81 CNCc1ccc(cc1Cl)C 7a_106832991635_100012349684 [0,1,0,0,0,0|2,0,1]=4 2150 B11R1.81 CNCc1ccc(cc1Cl)Cl 207a_100102657272_100000188887 [0,1,0,0,0,0|2,0,1]=4 2151 B11R1.81 CNCc1ccc(cc1Cl)Cl 2230a_106832991635_100000188473 [0,1,0,0,0,0|2,0,1]=4 2152 B11R1.81 CNCc1ccc(cc1Cl)Cl 26a_100102657272_100015191787 [0,1,0,0,0,0|2,0,1]=4 2153 B11R1.81 CNCc1ccc(cc1Cl)Cl 270004a_106832991635_100000188887 [0,1,0,0,0,0|2,0,1]=4 2154 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100000174880_200000210301 [0,1,0,0,0,0|2,0,1]=4 2155 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100102657272_100000188473 [0,1,0,0,0,0|2,0,1]=4 2156 B11R1.81 CNCc1ccc(cc1Cl)Cl 7a_106832991635_100000188473 [0,1,0,0,0,0|2,0,1]=4 2157 B11R1.81 CNCc1ccc(cc1Cl)F 207a_100102657272_100000752949 [0,1,0,0,0,0|2,0,1]=4 2158 B11R1.81 CNCc1ccc(cc1Cl)F 2230a_106832991635_100011216360 [0,1,0,0,0,0|2,0,1]=4 2159 B11R1.81 CNCc1ccc(cc1Cl)F 26a_100102657272_100000212004 [0,1,0,0,0,0|2,0,1]=4 2160 B11R1.81 CNCc1ccc(cc1Cl)F 270004a_106832991635_100000752949 [0,1,0,0,0,0|2,0,1]=4 2161 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100000174946_200000210301 [0,1,0,0,0,0|2,0,1]=4 2162 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100102657272_100011216360 [0,1,0,0,0,0|2,0,1]=4 2163 B11R1.81 CNCc1ccc(cc1Cl)F 7a_106832991635_100011216360 [0,1,0,0,0,0|2,0,1]=4 2164 B11R1.81 CNCc1ccc(cc1Cl)I 207a_100102657272_100000727542 [0,1,0,0,0,0|2,0,1]=4 2165 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [0,1,0,0,0,0|2,0,1]=4 2166 B11R1.81 CNCc1ccc(cc1F)Br 207a_100102657272_100000211676 [0,1,0,0,0,0|2,0,1]=4 2167 B11R1.81 CNCc1ccc(cc1F)Br 2230a_106832991635_100000211606 [0,1,0,0,0,0|2,0,1]=4 2168 B11R1.81 CNCc1ccc(cc1F)Br 26a_100102657272_100000185481 [0,1,0,0,0,0|2,0,1]=4 2169 B11R1.81 CNCc1ccc(cc1F)Br 270004a_106832991635_100000211676 [0,1,0,0,0,0|2,0,1]=4 2170 B11R1.81 CNCc1ccc(cc1F)Br 34a_100000754580_200000210301 [0,1,0,0,0,0|2,0,1]=4 2171 B11R1.81 CNCc1ccc(cc1F)Br 34a_100102657272_100000211606 [0,1,0,0,0,0|2,0,1]=4 2172 B11R1.81 CNCc1ccc(cc1F)Br 7a_106832991635_100000211606 [0,1,0,0,0,0|2,0,1]=4 2173 B11R1.81 CNCc1ccc(cc1F)C 207a_100102657272_100011217368 [0,1,0,0,0,0|2,0,1]=4 2174 B11R1.81 CNCc1ccc(cc1F)C 2230a_106832991635_100011217900 [0,1,0,0,0,0|2,0,1]=4 2175 B11R1.81 CNCc1ccc(cc1F)C 270004a_106832991635_100011217368 [0,1,0,0,0,0|2,0,1]=4 2176 B11R1.81 CNCc1ccc(cc1F)C 34a_100102657272_100012002367 [0,1,0,0,0,0|2,0,1]=4 2177 B11R1.81 CNCc1ccc(cc1F)C 34a_100102887089_200000210301 [0,1,0,0,0,0|2,0,1]=4 2178 B11R1.81 CNCc1ccc(cc1F)C 7a_106832991635_100012002367 [0,1,0,0,0,0|2,0,1]=4 2179 B11R1.81 CNCc1ccc(cc1F)Cl 207a_100102657272_100000697372 [0,1,0,0,0,0|2,0,1]=4 2180 B11R1.81 CNCc1ccc(cc1F)Cl 2230a_106832991635_100000709361 [0,1,0,0,0,0|2,0,1]=4 2181 B11R1.81 CNCc1ccc(cc1F)Cl 270004a_106832991635_100000697372 [0,1,0,0,0,0|2,0,1]=4 2182 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100000708496_200000210301 [0,1,0,0,0,0|2,0,1]=4 2183 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100102657272_100000709361 [0,1,0,0,0,0|2,0,1]=4 2184 B11R1.81 CNCc1ccc(cc1F)Cl 7a_106832991635_100000709361 [0,1,0,0,0,0|2,0,1]=4 2185 B11R1.81 CNCc1ccc(cc1F)F 207a_100102657272_100000211964 [0,1,0,0,0,0|2,0,1]=4 2186 B11R1.81 CNCc1ccc(cc1F)F 2230a_106832991635_100000748237 [0,1,0,0,0,0|2,0,1]=4 2187 B11R1.81 CNCc1ccc(cc1F)F 270004a_106832991635_100000211964 [0,1,0,0,0,0|2,0,1]=4 2188 B11R1.81 CNCc1ccc(cc1F)F 34a_100000737868_200000210301 [0,1,0,0,0,0|2,0,1]=4 2189 B11R1.81 CNCc1ccc(cc1F)F 34a_100102657272_100000748237 [0,1,0,0,0,0|2,0,1]=4 2190 B11R1.81 CNCc1ccc(cc1F)F 7a_106832991635_100000748237 [0,1,0,0,0,0|2,0,1]=4 2191 B11R1.81 CNCc1ccc(cc1F)I 207a_100102657272_100000050965 [0,1,0,0,0,0|2,0,1]=4 2192 B11R1.81 CNCc1ccc(cc1F)I 2230a_106832991635_100010244991 [0,1,0,0,0,0|2,0,1]=4 2193 B11R1.81 CNCc1ccc(cc1F)I 34a_100102657272_100010244991 [0,1,0,0,0,0|2,0,1]=4 2194 B11R1.81 CNCc1ccc(cc1F)I 7a_106832991635_100010244991 [0,1,0,0,0,0|2,0,1]=4 2195 B11R1.81 CNCc1ccc(cc1I)Br 207a_100102657272_100010146562 [0,1,0,0,0,0|2,0,1]=4 2196 B11R1.81 CNCc1ccc(cc1I)Br 2230a_106832991635_100010146615 [0,1,0,0,0,0|2,0,1]=4 2197 B11R1.81 CNCc1ccc(cc1I)Br 26a_100102657272_100012355227 [0,1,0,0,0,0|2,0,1]=4 2198 B11R1.81 CNCc1ccc(cc1I)Br 270004a_106832991635_100010146562 [0,1,0,0,0,0|2,0,1]=4 2199 B11R1.81 CNCc1ccc(cc1I)Br 34a_100102657272_100010146615 [0,1,0,0,0,0|2,0,1]=4 2200 B11R1.81 CNCc1ccc(cc1I)Br 7a_106832991635_100010146615 [0,1,0,0,0,0|2,0,1]=4 2201 B11R1.81 CNCc1ccc(cc1I)C 207a_100102657272_100010150104 [0,1,0,0,0,0|2,0,1]=4 2202 B11R1.81 CNCc1ccc(cc1I)C 270004a_106832991635_100010150104 [0,1,0,0,0,0|2,0,1]=4 2203 B11R1.81 CNCc1ccc(cc1I)Cl 2230a_106832991635_100010254388 [0,1,0,0,0,0|2,0,1]=4 2204 B11R1.81 CNCc1ccc(cc1I)Cl 34a_100102657272_100010254388 [0,1,0,0,0,0|2,0,1]=4 2205 B11R1.81 CNCc1ccc(cc1I)Cl 7a_106832991635_100010254388 [0,1,0,0,0,0|2,0,1]=4 2206 B11R1.81 CNCc1ccc(cc1I)F 207a_100102657272_100010254405 [0,1,0,0,0,0|2,0,1]=4 2207 B11R1.81 CNCc1ccc(cc1I)F 2230a_106832991635_100012354799 [0,1,0,0,0,0|2,0,1]=4 2208 B11R1.81 CNCc1ccc(cc1I)F 34a_100102657272_100012354799 [0,1,0,0,0,0|2,0,1]=4 2209 B11R1.81 CNCc1ccc(cc1I)F 7a_106832991635_100012354799 [0,1,0,0,0,0|2,0,1]=4 2210 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [0,1,0,0,0,0|1,0,1]=3 2211 B11R1.81 COCc1ccc(cc1Br)Br 34a_100012357508_200000210301 [0,1,0,0,0,0|2,0,1]=4 2212 B11R1.81 COCc1ccc(cc1Br)Br 34a_100138415774_200012351560 [0,1,0,0,0,0|2,0,1]=4 2213 B11R1.81 COCc1ccc(cc1Br)Br 7a_100012357508_200000210301 [0,1,0,0,0,0|2,0,1]=4 2214 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100000707881_200000210301 [0,1,0,0,0,0|2,0,1]=4 2215 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100138415774_100000755608 [0,1,0,0,0,0|2,0,1]=4 2216 B11R1.81 COCc1ccc(cc1Br)Cl 7a_100000707881_200000210301 [0,1,0,0,0,0|2,0,1]=4 2217 B11R1.81 COCc1ccc(cc1Br)F 34a_100000744086_200000210301 [0,1,0,0,0,0|2,0,1]=4 2218 B11R1.81 COCc1ccc(cc1Br)F 34a_100138415774_100000243222 [0,1,0,0,0,0|2,0,1]=4 2219 B11R1.81 COCc1ccc(cc1Br)F 7a_100000744086_200000210301 [0,1,0,0,0,0|2,0,1]=4 2220 B11R1.81 COCc1ccc(cc1Br)I 34a_100138415774_100010146610 [0,1,0,0,0,0|2,0,1]=4 2221 B11R1.81 COCc1ccc(cc1Br)I 7a_100010240206_200000210301 [0,1,0,0,0,0|2,0,1]=4 2222 B11R1.81 COCc1ccc(cc1C)Br 34a_100000748258_200000210301 [0,1,0,0,0,0|2,0,1]=4 2223 B11R1.81 COCc1ccc(cc1C)Br 34a_100138415774_100000708836 [0,1,0,0,0,0|2,0,1]=4 2224 B11R1.81 COCc1ccc(cc1C)Br 7a_100000748258_200000210301 [0,1,0,0,0,0|2,0,1]=4 2225 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [0,1,0,0,0,0|2,0,1]=4 2226 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [0,1,0,0,0,0|2,0,1]=4 2227 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [0,1,0,0,0,0|2,0,1]=4 2228 B11R1.81 COCc1ccc(cc1C)Cl 34a_100000702939_200000210301 [0,1,0,0,0,0|2,0,1]=4 2229 B11R1.81 COCc1ccc(cc1C)Cl 34a_100138415774_100012361307 [0,1,0,0,0,0|2,0,1]=4 2230 B11R1.81 COCc1ccc(cc1C)Cl 7a_100000702939_200000210301 [0,1,0,0,0,0|2,0,1]=4 2231 B11R1.81 COCc1ccc(cc1C)F 34a_100000700136_200000210301 [0,1,0,0,0,0|2,0,1]=4 2232 B11R1.81 COCc1ccc(cc1C)F 34a_100138415774_100000700533 [0,1,0,0,0,0|2,0,1]=4 2233 B11R1.81 COCc1ccc(cc1C)F 7a_100000700136_200000210301 [0,1,0,0,0,0|2,0,1]=4 2234 B11R1.81 COCc1ccc(cc1C)N 34a_100000102464_200000210301 [0,1,0,0,0,0|2,0,1]=4 2235 B11R1.81 COCc1ccc(cc1C)N 7a_100000102464_200000210301 [0,1,0,0,0,0|2,0,1]=4 2236 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100000756401_200000210301 [0,1,0,0,0,0|2,0,1]=4 2237 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100138415774_100011740631 [0,1,0,0,0,0|2,0,1]=4 2238 B11R1.81 COCc1ccc(cc1Cl)Br 7a_100000756401_200000210301 [0,1,0,0,0,0|2,0,1]=4 2239 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [0,1,0,0,0,0|2,0,1]=4 2240 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [0,1,0,0,0,0|2,0,1]=4 2241 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [0,1,0,0,0,0|2,0,1]=4 2242 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100000215721_200000210301 [0,1,0,0,0,0|2,0,1]=4 2243 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100138415774_100000188473 [0,1,0,0,0,0|2,0,1]=4 2244 B11R1.81 COCc1ccc(cc1Cl)Cl 7a_100000215721_200000210301 [0,1,0,0,0,0|2,0,1]=4 2245 B11R1.81 COCc1ccc(cc1Cl)F 34a_100011219954_200000210301 [0,1,0,0,0,0|2,0,1]=4 2246 B11R1.81 COCc1ccc(cc1Cl)F 34a_100138415774_100011216360 [0,1,0,0,0,0|2,0,1]=4 2247 B11R1.81 COCc1ccc(cc1Cl)F 7a_100011219954_200000210301 [0,1,0,0,0,0|2,0,1]=4 2248 B11R1.81 COCc1ccc(cc1Cl)N 34a_100000689119_200000210301 [0,1,0,0,0,0|2,0,1]=4 2249 B11R1.81 COCc1ccc(cc1F)Br 34a_100011191541_200000210301 [0,1,0,0,0,0|2,0,1]=4 2250 B11R1.81 COCc1ccc(cc1F)Br 34a_100138415774_100000211606 [0,1,0,0,0,0|2,0,1]=4 2251 B11R1.81 COCc1ccc(cc1F)Br 7a_100011191541_200000210301 [0,1,0,0,0,0|2,0,1]=4 2252 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [0,1,0,0,0,0|2,0,1]=4 2253 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [0,1,0,0,0,0|2,0,1]=4 2254 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [0,1,0,0,0,0|2,0,1]=4 2255 B11R1.81 COCc1ccc(cc1F)Cl 34a_100011217562_200000210301 [0,1,0,0,0,0|2,0,1]=4 2256 B11R1.81 COCc1ccc(cc1F)Cl 34a_100138415774_100000709361 [0,1,0,0,0,0|2,0,1]=4 2257 B11R1.81 COCc1ccc(cc1F)Cl 7a_100011217562_200000210301 [0,1,0,0,0,0|2,0,1]=4 2258 B11R1.81 COCc1ccc(cc1F)F 34a_100011215441_200000210301 [0,1,0,0,0,0|2,0,1]=4 2259 B11R1.81 COCc1ccc(cc1F)F 34a_100138415774_100000748237 [0,1,0,0,0,0|2,0,1]=4 2260 B11R1.81 COCc1ccc(cc1F)F 7a_100011215441_200000210301 [0,1,0,0,0,0|2,0,1]=4 2261 B11R1.81 COCc1ccc(cc1F)I 34a_100138415774_100010244991 [0,1,0,0,0,0|2,0,1]=4 2262 B11R1.81 COCc1ccc(cc1F)I 34a_200010202041_200000210301 [0,1,0,0,0,0|2,0,1]=4 2263 B11R1.81 COCc1ccc(cc1F)I 7a_200010202041_200000210301 [0,1,0,0,0,0|2,0,1]=4 2264 B11R1.81 COCc1ccc(cc1I)Br 34a_100138415774_100010146615 [0,1,0,0,0,0|2,0,1]=4 2265 B11R1.81 COCc1ccc(cc1I)Br 7a_100010146605_200000210301 [0,1,0,0,0,0|2,0,1]=4 2266 B11R1.81 COCc1ccc(cc1I)Cl 34a_100000722340_200000210301 [0,1,0,0,0,0|2,0,1]=4 2267 B11R1.81 COCc1ccc(cc1I)Cl 34a_100138415774_100010254388 [0,1,0,0,0,0|2,0,1]=4 2268 B11R1.81 COCc1ccc(cc1I)Cl 7a_100000722340_200000210301 [0,1,0,0,0,0|2,0,1]=4 2269 B11R1.81 COCc1ccc(cc1I)F 34a_100011356828_200000210301 [0,1,0,0,0,0|2,0,1]=4 2270 B11R1.81 COCc1ccc(cc1I)F 34a_100138415774_100012354799 [0,1,0,0,0,0|2,0,1]=4 2271 B11R1.81 COCc1ccc(cc1I)F 7a_100011356828_200000210301 [0,1,0,0,0,0|2,0,1]=4 2272 B11R1.81 COCc1ccc(cc1N)Br 34a_100000718831_200000210301 [0,1,0,0,0,0|2,0,1]=4 2273 B11R1.81 COCc1ccc(cc1N)Br 7a_100000718831_200000210301 [0,1,0,0,0,0|2,0,1]=4 2274 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [0,1,0,0,0,0|2,0,1]=4 2275 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [0,1,0,0,0,0|2,0,1]=4 2276 B11R1.81 COCc1ccc(cc1N)Cl 34a_100000238622_200000210301 [0,1,0,0,0,0|2,0,1]=4 2277 B11R1.81 COCc1ccc(cc1N)Cl 7a_100000238622_200000210301 [0,1,0,0,0,0|2,0,1]=4 2278 B11R1.81 COCc1ccc(cc1N)F 34a_100011996588_200000210301 [0,1,0,0,0,0|2,0,1]=4 2279 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [0,1,0,0,0,0|2,0,1]=4 2280 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200000210301_200012351560 [0,1,0,0,0,0|2,0,1]=4 2281 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200012351560_200000210301 [0,1,0,0,0,0|2,0,1]=4 2282 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_100000755608_200000210301 [0,1,0,0,0,0|2,0,1]=4 2283 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_200000210301_100000755608 [0,1,0,0,0,0|2,0,1]=4 2284 B11R1.81 CSCc1ccc(cc1Br)F 62a_100000243222_200000210301 [0,1,0,0,0,0|2,0,1]=4 2285 B11R1.81 CSCc1ccc(cc1Br)F 62a_200000210301_100000243222 [0,1,0,0,0,0|2,0,1]=4 2286 B11R1.81 CSCc1ccc(cc1Br)I 62a_100010146610_200000210301 [0,1,0,0,0,0|2,0,1]=4 2287 B11R1.81 CSCc1ccc(cc1Br)I 62a_200000210301_100010146610 [0,1,0,0,0,0|2,0,1]=4 2288 B11R1.81 CSCc1ccc(cc1C)Br 62a_100000708836_200000210301 [0,1,0,0,0,0|2,0,1]=4 2289 B11R1.81 CSCc1ccc(cc1C)Br 62a_200000210301_100000708836 [0,1,0,0,0,0|2,0,1]=4 2290 B11R1.81 CSCc1ccc(cc1C)C 62a_100011219618_200000210301 [0,1,0,0,0,0|2,0,1]=4 2291 B11R1.81 CSCc1ccc(cc1C)C 62a_200000210301_100011219618 [0,1,0,0,0,0|2,0,1]=4 2292 B11R1.81 CSCc1ccc(cc1C)Cl 62a_100012361307_200000210301 [0,1,0,0,0,0|2,0,1]=4 2293 B11R1.81 CSCc1ccc(cc1C)Cl 62a_200000210301_100012361307 [0,1,0,0,0,0|2,0,1]=4 2294 B11R1.81 CSCc1ccc(cc1C)F 62a_100000700533_200000210301 [0,1,0,0,0,0|2,0,1]=4 2295 B11R1.81 CSCc1ccc(cc1C)F 62a_200000210301_100000700533 [0,1,0,0,0,0|2,0,1]=4 2296 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_100011740631_200000210301 [0,1,0,0,0,0|2,0,1]=4 2297 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_200000210301_100011740631 [0,1,0,0,0,0|2,0,1]=4 2298 B11R1.81 CSCc1ccc(cc1Cl)C 62a_100012349684_200000210301 [0,1,0,0,0,0|2,0,1]=4 2299 B11R1.81 CSCc1ccc(cc1Cl)C 62a_200000210301_100012349684 [0,1,0,0,0,0|2,0,1]=4 2300 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_100000188473_200000210301 [0,1,0,0,0,0|2,0,1]=4 2301 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_200000210301_100000188473 [0,1,0,0,0,0|2,0,1]=4 2302 B11R1.81 CSCc1ccc(cc1Cl)F 62a_100000187853_200000210301 [0,1,0,0,0,0|2,0,1]=4 2303 B11R1.81 CSCc1ccc(cc1Cl)F 62a_200000210301_100000187853 [0,1,0,0,0,0|2,0,1]=4 2304 B11R1.81 CSCc1ccc(cc1F)Br 62a_100000211606_200000210301 [0,1,0,0,0,0|2,0,1]=4 2305 B11R1.81 CSCc1ccc(cc1F)Br 62a_200000210301_100000211606 [0,1,0,0,0,0|2,0,1]=4 2306 B11R1.81 CSCc1ccc(cc1F)C 62a_100011217900_200000210301 [0,1,0,0,0,0|2,0,1]=4 2307 B11R1.81 CSCc1ccc(cc1F)C 62a_200000210301_100011217900 [0,1,0,0,0,0|2,0,1]=4 2308 B11R1.81 CSCc1ccc(cc1F)Cl 62a_100000709361_200000210301 [0,1,0,0,0,0|2,0,1]=4 2309 B11R1.81 CSCc1ccc(cc1F)Cl 62a_200000210301_100000709361 [0,1,0,0,0,0|2,0,1]=4 2310 B11R1.81 CSCc1ccc(cc1F)F 62a_100000748237_200000210301 [0,1,0,0,0,0|2,0,1]=4 2311 B11R1.81 CSCc1ccc(cc1F)F 62a_200000210301_100000748237 [0,1,0,0,0,0|2,0,1]=4 2312 B11R1.81 CSCc1ccc(cc1F)I 62a_100010244991_200000210301 [0,1,0,0,0,0|2,0,1]=4 2313 B11R1.81 CSCc1ccc(cc1F)I 62a_200000210301_100010244991 [0,1,0,0,0,0|2,0,1]=4 2314 B11R1.81 CSCc1ccc(cc1I)Br 62a_100010146615_200000210301 [0,1,0,0,0,0|2,0,1]=4 2315 B11R1.81 CSCc1ccc(cc1I)Br 62a_200000210301_100010146615 [0,1,0,0,0,0|2,0,1]=4 2316 B11R1.81 CSCc1ccc(cc1I)Cl 62a_100010254388_200000210301 [0,1,0,0,0,0|2,0,1]=4 2317 B11R1.81 CSCc1ccc(cc1I)Cl 62a_200000210301_100010254388 [0,1,0,0,0,0|2,0,1]=4 2318 B11R1.81 CSCc1ccc(cc1I)F 62a_100012354799_200000210301 [0,1,0,0,0,0|2,0,1]=4 2319 B11R1.81 CSCc1ccc(cc1I)F 62a_200000210301_100012354799 [0,1,0,0,0,0|2,0,1]=4 2320 B11R1.81 Cc1cc(ccc1CC#N)O 271570a_203496583355_100000697864 [0,1,0,0,0,0|2,0,1]=4 2321 B11R1.81 Cc1cc(ccc1CN[13CH3])Br 34a_100000753881_200025704644 [0,1,0,0,0,0|2,0,1]=4 2322 B11R1.81 Cc1cc(ccc1CN[13CH3])Cl 34a_103436540063_200025704644 [0,1,0,0,0,0|2,0,1]=4 2323 B11R1.81 Cc1cc(ccc1CN[13CH3])F 34a_100137329023_200025704644 [0,1,0,0,0,0|2,0,1]=4 2324 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 34a_100000748258_200025704644 [0,1,0,0,0,0|2,0,1]=4 2325 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 7a_100000748258_200025704644 [0,1,0,0,0,0|2,0,1]=4 2326 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 34a_100000702939_200025704644 [0,1,0,0,0,0|2,0,1]=4 2327 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 7a_100000702939_200025704644 [0,1,0,0,0,0|2,0,1]=4 2328 B11R1.81 Cc1cc(ccc1CO[13CH3])F 34a_100000700136_200025704644 [0,1,0,0,0,0|2,0,1]=4 2329 B11R1.81 Cc1cc(ccc1CO[13CH3])F 7a_100000700136_200025704644 [0,1,0,0,0,0|2,0,1]=4 2330 B11R1.81 Cc1cc(ccc1CO[13CH3])N 34a_100000102464_200025704644 [0,1,0,0,0,0|2,0,1]=4 2331 B11R1.81 Cc1cc(ccc1CO[13CH3])N 7a_100000102464_200025704644 [0,1,0,0,0,0|2,0,1]=4 2332 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_100000708836_200025704644 [0,1,0,0,0,0|2,0,1]=4 2333 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_200025704644_100000708836 [0,1,0,0,0,0|2,0,1]=4 2334 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_100012361307_200025704644 [0,1,0,0,0,0|2,0,1]=4 2335 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_200025704644_100012361307 [0,1,0,0,0,0|2,0,1]=4 2336 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_100000700533_200025704644 [0,1,0,0,0,0|2,0,1]=4 2337 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_200025704644_100000700533 [0,1,0,0,0,0|2,0,1]=4 2338 B11R1.81 Cc1ccc(c(c1)C)CN[13CH3] 34a_100000737523_200025704644 [0,1,0,0,0,0|2,0,1]=4 2339 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [0,1,0,0,0,0|2,0,1]=4 2340 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [0,1,0,0,0,0|2,0,1]=4 2341 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_100011219618_200025704644 [0,1,0,0,0,0|2,0,1]=4 2342 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_200025704644_100011219618 [0,1,0,0,0,0|2,0,1]=4 2343 B11R1.81 Cc1ccc(c(c1)Cl)CN[13CH3] 34a_100011997539_200025704644 [0,1,0,0,0,0|2,0,1]=4 2344 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [0,1,0,0,0,0|2,0,1]=4 2345 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [0,1,0,0,0,0|2,0,1]=4 2346 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_100012349684_200025704644 [0,1,0,0,0,0|2,0,1]=4 2347 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_100012349684 [0,1,0,0,0,0|2,0,1]=4 2348 B11R1.81 Cc1ccc(c(c1)F)CN[13CH3] 34a_100102887089_200025704644 [0,1,0,0,0,0|2,0,1]=4 2349 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [0,1,0,0,0,0|2,0,1]=4 2350 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [0,1,0,0,0,0|2,0,1]=4 2351 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_100011217900_200025704644 [0,1,0,0,0,0|2,0,1]=4 2352 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011217900 [0,1,0,0,0,0|2,0,1]=4 2353 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [0,1,0,0,0,0|2,0,1]=4 2354 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [0,1,0,0,0,0|2,0,1]=4 2355 B11R1.81 Cc1ccc(c(c1)O)NCF 34a_100000211527_100015361967 [0,1,0,0,0,0|2,0,1]=4 2356 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100012002257_100015361967 [0,1,0,0,0,0|2,0,1]=4 2357 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100015361967_100012002257 [0,1,0,0,0,0|2,0,1]=4 2358 B11R1.81 N#CCc1ccc(cc1F)O 271570a_203496583355_100011295474 [0,1,0,0,0,0|2,0,1]=4 2359 B11R1.81 N#CCc1ccc(cc1O)F 271570a_203496583355_100011207962 [0,1,0,0,0,0|1,0,1]=3 2360 B11R1.81 N#CSc1ccc(cc1O)F 271570a_203496583355_100025703547 [0,1,0,0,0,0|2,0,1]=4 2361 B11R1.81 N#CSc1ccc(cc1O)N 271570a_203496583355_200012361504 [0,1,0,0,0,0|2,0,1]=4 2362 B11R1.81 OCCc1ccc(cc1F)O 271570a_203496583355_100011962869 [0,1,0,0,0,0|2,0,1]=4 2363 B11R1.81 Oc1cc(ccc1NCF)Br 34a_100000739049_100015361967 [0,1,0,0,0,0|2,0,1]=4 2364 B11R1.81 Oc1cc(ccc1NCF)Cl 34a_100000185728_100015361967 [0,1,0,0,0,0|2,0,1]=4 2365 B11R1.81 Oc1cc(ccc1NCF)F 34a_100000753323_100015361967 [0,1,0,0,0,0|2,0,1]=4 2366 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100012344904_100015361967 [0,1,0,0,0,0|2,0,1]=4 2367 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100015361967_100012344904 [0,1,0,0,0,0|2,0,1]=4 2368 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100000050036_100015361967 [0,1,0,0,0,0|2,0,1]=4 2369 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100015361967_100000050036 [0,1,0,0,0,0|2,0,1]=4 2370 B11R1.81 Oc1cc(ccc1SCF)F 62a_100000690578_100015361967 [0,1,0,0,0,0|2,0,1]=4 2371 B11R1.81 Oc1cc(ccc1SCF)F 62a_100015361967_100000690578 [0,1,0,0,0,0|2,0,1]=4 2372 B11R1.81 Oc1ccc(c(c1)O)NCF 34a_100000106777_100015361967 [0,1,0,0,0,0|2,0,1]=4 2373 B11R1.81 Oc1ccc(c(c1)O)SCF 62a_100015361967_100009813921 [0,1,0,0,0,0|2,0,1]=4 2374 B11R1.81 [13CH3]NCc1ccc(cc1Br)Cl 34a_100102692131_200025704644 [0,1,0,0,0,0|2,0,1]=4 2375 B11R1.81 [13CH3]NCc1ccc(cc1Br)F 34a_100000708791_200025704644 [0,1,0,0,0,0|2,0,1]=4 2376 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Br 34a_100020628970_200025704644 [0,1,0,0,0,0|2,0,1]=4 2377 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Cl 34a_100000174880_200025704644 [0,1,0,0,0,0|2,0,1]=4 2378 B11R1.81 [13CH3]NCc1ccc(cc1Cl)F 34a_100000174946_200025704644 [0,1,0,0,0,0|2,0,1]=4 2379 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [0,1,0,0,0,0|2,0,1]=4 2380 B11R1.81 [13CH3]NCc1ccc(cc1F)Br 34a_100000754580_200025704644 [0,1,0,0,0,0|2,0,1]=4 2381 B11R1.81 [13CH3]NCc1ccc(cc1F)Cl 34a_100000708496_200025704644 [0,1,0,0,0,0|2,0,1]=4 2382 B11R1.81 [13CH3]NCc1ccc(cc1F)F 34a_100000737868_200025704644 [0,1,0,0,0,0|2,0,1]=4 2383 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 34a_100012357508_200025704644 [0,1,0,0,0,0|2,0,1]=4 2384 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 7a_100012357508_200025704644 [0,1,0,0,0,0|2,0,1]=4 2385 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 34a_100000707881_200025704644 [0,1,0,0,0,0|2,0,1]=4 2386 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 7a_100000707881_200025704644 [0,1,0,0,0,0|2,0,1]=4 2387 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 34a_100000744086_200025704644 [0,1,0,0,0,0|2,0,1]=4 2388 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 7a_100000744086_200025704644 [0,1,0,0,0,0|2,0,1]=4 2389 B11R1.81 [13CH3]OCc1ccc(cc1Br)I 7a_100010240206_200025704644 [0,1,0,0,0,0|2,0,1]=4 2390 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 34a_100000756401_200025704644 [0,1,0,0,0,0|2,0,1]=4 2391 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 7a_100000756401_200025704644 [0,1,0,0,0,0|2,0,1]=4 2392 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 34a_100000215721_200025704644 [0,1,0,0,0,0|2,0,1]=4 2393 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 7a_100000215721_200025704644 [0,1,0,0,0,0|2,0,1]=4 2394 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 34a_100011219954_200025704644 [0,1,0,0,0,0|2,0,1]=4 2395 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 7a_100011219954_200025704644 [0,1,0,0,0,0|2,0,1]=4 2396 B11R1.81 [13CH3]OCc1ccc(cc1Cl)N 34a_100000689119_200025704644 [0,1,0,0,0,0|2,0,1]=4 2397 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 34a_100011191541_200025704644 [0,1,0,0,0,0|2,0,1]=4 2398 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 7a_100011191541_200025704644 [0,1,0,0,0,0|2,0,1]=4 2399 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 34a_100011217562_200025704644 [0,1,0,0,0,0|2,0,1]=4 2400 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 7a_100011217562_200025704644 [0,1,0,0,0,0|2,0,1]=4 2401 B11R1.81 [13CH3]OCc1ccc(cc1F)F 34a_100011215441_200025704644 [0,1,0,0,0,0|2,0,1]=4 2402 B11R1.81 [13CH3]OCc1ccc(cc1F)F 7a_100011215441_200025704644 [0,1,0,0,0,0|2,0,1]=4 2403 B11R1.81 [13CH3]OCc1ccc(cc1F)I 34a_200010202041_200025704644 [0,1,0,0,0,0|2,0,1]=4 2404 B11R1.81 [13CH3]OCc1ccc(cc1F)I 7a_200010202041_200025704644 [0,1,0,0,0,0|2,0,1]=4 2405 B11R1.81 [13CH3]OCc1ccc(cc1I)Br 7a_100010146605_200025704644 [0,1,0,0,0,0|2,0,1]=4 2406 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 34a_100000722340_200025704644 [0,1,0,0,0,0|2,0,1]=4 2407 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 7a_100000722340_200025704644 [0,1,0,0,0,0|2,0,1]=4 2408 B11R1.81 [13CH3]OCc1ccc(cc1I)F 34a_100011356828_200025704644 [0,1,0,0,0,0|2,0,1]=4 2409 B11R1.81 [13CH3]OCc1ccc(cc1I)F 7a_100011356828_200025704644 [0,1,0,0,0,0|2,0,1]=4 2410 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 34a_100000718831_200025704644 [0,1,0,0,0,0|2,0,1]=4 2411 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 7a_100000718831_200025704644 [0,1,0,0,0,0|2,0,1]=4 2412 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 34a_100000238622_200025704644 [0,1,0,0,0,0|2,0,1]=4 2413 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 7a_100000238622_200025704644 [0,1,0,0,0,0|2,0,1]=4 2414 B11R1.81 [13CH3]OCc1ccc(cc1N)F 34a_100011996588_200025704644 [0,1,0,0,0,0|2,0,1]=4 2415 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200012351560_200025704644 [0,1,0,0,0,0|2,0,1]=4 2416 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200025704644_200012351560 [0,1,0,0,0,0|2,0,1]=4 2417 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_100000755608_200025704644 [0,1,0,0,0,0|2,0,1]=4 2418 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_200025704644_100000755608 [0,1,0,0,0,0|2,0,1]=4 2419 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_100000243222_200025704644 [0,1,0,0,0,0|2,0,1]=4 2420 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_200025704644_100000243222 [0,1,0,0,0,0|2,0,1]=4 2421 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_100010146610_200025704644 [0,1,0,0,0,0|2,0,1]=4 2422 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_200025704644_100010146610 [0,1,0,0,0,0|2,0,1]=4 2423 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_100011740631_200025704644 [0,1,0,0,0,0|2,0,1]=4 2424 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_200025704644_100011740631 [0,1,0,0,0,0|2,0,1]=4 2425 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_100000188473_200025704644 [0,1,0,0,0,0|2,0,1]=4 2426 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_200025704644_100000188473 [0,1,0,0,0,0|2,0,1]=4 2427 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_100000187853_200025704644 [0,1,0,0,0,0|2,0,1]=4 2428 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_200025704644_100000187853 [0,1,0,0,0,0|2,0,1]=4 2429 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_100000211606_200025704644 [0,1,0,0,0,0|2,0,1]=4 2430 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_200025704644_100000211606 [0,1,0,0,0,0|2,0,1]=4 2431 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_100000709361_200025704644 [0,1,0,0,0,0|2,0,1]=4 2432 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_200025704644_100000709361 [0,1,0,0,0,0|2,0,1]=4 2433 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_100000748237_200025704644 [0,1,0,0,0,0|2,0,1]=4 2434 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_200025704644_100000748237 [0,1,0,0,0,0|2,0,1]=4 2435 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_100010244991_200025704644 [0,1,0,0,0,0|2,0,1]=4 2436 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_200025704644_100010244991 [0,1,0,0,0,0|2,0,1]=4 2437 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_100010146615_200025704644 [0,1,0,0,0,0|2,0,1]=4 2438 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_200025704644_100010146615 [0,1,0,0,0,0|2,0,1]=4 2439 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_100010254388_200025704644 [0,1,0,0,0,0|2,0,1]=4 2440 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_200025704644_100010254388 [0,1,0,0,0,0|2,0,1]=4 2441 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_100012354799_200025704644 [0,1,0,0,0,0|2,0,1]=4 2442 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_200025704644_100012354799 [0,1,0,0,0,0|2,0,1]=4 2443 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [0,1,0,0,0,0|1,0,2]=4 2444 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,1,0,0,0,0|1,0,2]=4 2445 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [0,1,0,0,0,0|1,0,2]=4 2446 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [0,1,0,0,0,0|1,0,2]=4 2447 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [0,1,0,0,0,0|1,0,2]=4 2448 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [0,1,0,0,0,0|0,0,2]=3 2449 B11R1.86 CC(=Cc1ccncc1O)C 271570a_100102525489_100009817591 [0,1,0,0,0,0|1,0,2]=4 2450 B11R1.86 CC(=Cc1ncccc1O)C 271570a_100102525489_100000034122 [0,1,0,0,0,0|1,0,2]=4 2451 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [0,1,0,0,0,0|1,0,1]=3 2452 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [0,1,0,0,0,0|1,0,1]=3 2453 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,1,0,0,0,0|1,0,1]=3 2454 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,1,0,0,0,0|1,0,1]=3 2455 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [0,1,0,0,0,0|1,0,1]=3 2456 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [0,1,0,0,0,0|1,0,1]=3 2457 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [0,1,0,0,0,0|1,0,1]=3 2458 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [0,1,0,0,0,0|1,0,1]=3 2459 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [0,1,0,0,0,0|1,0,1]=3 2460 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [0,1,0,0,0,0|1,0,1]=3 2461 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,1,0,0,0,0|0,0,1]=2 2462 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,1,0,0,0,0|0,0,1]=2 2463 B11R1.86 CC(=O)Cc1cccnc1Br 1458a_100000070787_100010140945 [0,1,0,0,0,0|2,0,1]=4 2464 B11R1.86 CC(=O)Cc1cccnc1C 1458a_100000070787_100000732876 [0,1,0,0,0,0|2,0,1]=4 2465 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000070787_100000045678 [0,1,0,0,0,0|2,0,1]=4 2466 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000093521_200000210301 [0,1,0,0,0,0|2,0,1]=4 2467 B11R1.86 CC(=O)Cc1cccnc1F 1458a_100000070787_100000099810 [0,1,0,0,0,0|2,0,1]=4 2468 B11R1.86 CC(=O)Cc1ccncc1C 1458a_100000070787_100020672808 [0,1,0,0,0,0|2,0,1]=4 2469 B11R1.86 CC(=O)Cc1ccncc1Cl 1458a_100000070787_100000763264 [0,1,0,0,0,0|2,0,1]=4 2470 B11R1.86 CC(=O)Cc1cnccc1C 1458a_100000070787_100000690890 [0,1,0,0,0,0|2,0,1]=4 2471 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_100000070787_100025702911 [0,1,0,0,0,0|2,0,1]=4 2472 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_200012357574_200000210301 [0,1,0,0,0,0|2,0,1]=4 2473 B11R1.86 CC(=O)Cc1ncccc1C 1458a_100000070787_100000696600 [0,1,0,0,0,0|2,0,1]=4 2474 B11R1.86 CC(=O)Cc1ncccc1C 1458a_200000722269_200000210301 [0,1,0,0,0,0|2,0,1]=4 2475 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100000070787_100000099807 [0,1,0,0,0,0|2,0,1]=4 2476 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100011998755_200000210301 [0,1,0,0,0,0|2,0,1]=4 2477 B11R1.86 CC(=O)Cc1ncccc1F 1458a_100000070787_100000104219 [0,1,0,0,0,0|2,0,1]=4 2478 B11R1.86 CC(=O)Cc1ncccc1O 1458a_100000070787_200020655725 [0,1,0,0,0,0|1,0,1]=3 2479 B11R1.86 CC(=O)Cn1ccccc1=O 1458a_100000189665_200000210301 [0,1,0,0,0,0|1,0,2]=4 2480 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,1,0,0,0,0|2,0,1]=4 2481 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,1,0,0,0,0|2,0,1]=4 2482 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,1,0,0,0,0|2,0,1]=4 2483 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,1,0,0,0,0|2,0,1]=4 2484 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,1,0,0,0,0|2,0,1]=4 2485 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,1,0,0,0,0|2,0,1]=4 2486 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,1,0,0,0,0|2,0,1]=4 2487 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,1,0,0,0,0|2,0,1]=4 2488 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,1,0,0,0,0|2,0,1]=4 2489 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,1,0,0,0,0|2,0,1]=4 2490 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,1,0,0,0,0|2,0,1]=4 2491 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,1,0,0,0,0|2,0,1]=4 2492 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,1,0,0,0,0|2,0,1]=4 2493 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,1,0,0,0,0|2,0,1]=4 2494 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,1,0,0,0,0|2,0,1]=4 2495 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,1,0,0,0,0|2,0,1]=4 2496 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,1,0,0,0,0|1,0,1]=3 2497 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,1,0,0,0,0|1,0,1]=3 2498 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,1,0,0,0,0|1,0,1]=3 2499 B11R1.86 CC(=O)Nc1ccncc1O 271570a_203496583355_100016132053 [0,1,0,0,0,0|2,0,1]=4 2500 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,1,0,0,0,0|1,0,1]=3 2501 B11R1.86 CC(=O)Oc1cccnc1O 271570a_203496583355_200009815371 [0,1,0,0,0,0|2,0,1]=4 2502 B11R1.86 CC(C)Nc1ccccc1O 271570a_203496583355_100000219599 [0,1,0,0,0,0|1,0,2]=4 2503 B11R1.86 CC(C)Nc1ccccc1O 34a_100000185747_100000210206 [0,1,0,0,0,0|1,0,2]=4 2504 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [0,1,0,0,0,0|1,0,2]=4 2505 B11R1.86 CC(C)Sc1ccccc1O 62a_100000210206_100000739446 [0,1,0,0,0,0|1,0,2]=4 2506 B11R1.86 CC(C)Sc1ccccc1O 62a_100000739446_100000210206 [0,1,0,0,0,0|1,0,2]=4 2507 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100000184654_200000210301 [0,1,0,0,0,0|2,0,1]=4 2508 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100102631434_100000184730 [0,1,0,0,0,0|2,0,1]=4 2509 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100000184654_200000210301 [0,1,0,0,0,0|2,0,1]=4 2510 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100102631434_100000184730 [0,1,0,0,0,0|2,0,1]=4 2511 B11R1.86 CN(C)Cc1ccccc1Br 270004a_100102631434_100000211189 [0,1,0,0,0,0|2,0,1]=4 2512 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100000184507_200000210301 [0,1,0,0,0,0|2,0,1]=4 2513 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100102631434_100000187162 [0,1,0,0,0,0|2,0,1]=4 2514 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100000184507_200000210301 [0,1,0,0,0,0|2,0,1]=4 2515 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100102631434_100000187162 [0,1,0,0,0,0|2,0,1]=4 2516 B11R1.86 CN(C)Cc1ccccc1Cl 270004a_100102631434_100000210073 [0,1,0,0,0,0|2,0,1]=4 2517 B11R1.86 CN(C)Cc1ccccc1F 2230a_100000742528_200000210301 [0,1,0,0,0,0|2,0,1]=4 2518 B11R1.86 CN(C)Cc1ccccc1F 2230a_100102631434_100000211605 [0,1,0,0,0,0|2,0,1]=4 2519 B11R1.86 CN(C)Cc1ccccc1F 269982a_100000742528_200000210301 [0,1,0,0,0,0|2,0,1]=4 2520 B11R1.86 CN(C)Cc1ccccc1F 269982a_100102631434_100000211605 [0,1,0,0,0,0|2,0,1]=4 2521 B11R1.86 CN(C)Cc1ccccc1F 270004a_100102631434_100000210811 [0,1,0,0,0,0|2,0,1]=4 2522 B11R1.86 CN(C)Cc1ccccc1F 34a_100000742528_200000210301 [0,1,0,0,0,0|2,0,1]=4 2523 B11R1.86 CN(C)Cc1ccccc1I 2230a_100102631434_100011215278 [0,1,0,0,0,0|2,0,1]=4 2524 B11R1.86 CN(C)Cc1ccccc1I 269982a_100102631434_100011215278 [0,1,0,0,0,0|2,0,1]=4 2525 B11R1.86 CN(C)Cc1ccccc1I 270004a_100102631434_100000010305 [0,1,0,0,0,0|2,0,1]=4 2526 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [0,1,0,0,0,0|1,0,1]=3 2527 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [0,1,0,0,0,0|1,0,1]=3 2528 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [0,1,0,0,0,0|1,0,1]=3 2529 B11R1.86 CN(C)Cc1cccnc1O 270004a_100102631434_100011998315 [0,1,0,0,0,0|2,0,1]=4 2530 B11R1.86 CN([13CH3])Cc1ccccc1Br 2230a_100000184654_200025704644 [0,1,0,0,0,0|2,0,1]=4 2531 B11R1.86 CN([13CH3])Cc1ccccc1Br 269982a_100000184654_200025704644 [0,1,0,0,0,0|2,0,1]=4 2532 B11R1.86 CN([13CH3])Cc1ccccc1Cl 2230a_100000184507_200025704644 [0,1,0,0,0,0|2,0,1]=4 2533 B11R1.86 CN([13CH3])Cc1ccccc1Cl 269982a_100000184507_200025704644 [0,1,0,0,0,0|2,0,1]=4 2534 B11R1.86 CN([13CH3])Cc1ccccc1F 2230a_100000742528_200025704644 [0,1,0,0,0,0|2,0,1]=4 2535 B11R1.86 CN([13CH3])Cc1ccccc1F 269982a_100000742528_200025704644 [0,1,0,0,0,0|2,0,1]=4 2536 B11R1.86 CN([13CH3])Cc1ccccc1F 34a_100000742528_200025704644 [0,1,0,0,0,0|2,0,1]=4 2537 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [0,1,0,0,0,0|1,0,1]=3 2538 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [0,1,0,0,0,0|1,0,1]=3 2539 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,1,0,0,0,0|1,0,1]=3 2540 B11R1.86 Cc1ccccc1CN(C)C 2230a_100000184421_200000210301 [0,1,0,0,0,0|2,0,1]=4 2541 B11R1.86 Cc1ccccc1CN(C)C 2230a_100102631434_100000211839 [0,1,0,0,0,0|2,0,1]=4 2542 B11R1.86 Cc1ccccc1CN(C)C 269982a_100000184421_200000210301 [0,1,0,0,0,0|2,0,1]=4 2543 B11R1.86 Cc1ccccc1CN(C)C 269982a_100102631434_100000211839 [0,1,0,0,0,0|2,0,1]=4 2544 B11R1.86 Cc1ccccc1CN(C)C 270004a_100102631434_100000211143 [0,1,0,0,0,0|2,0,1]=4 2545 B11R1.86 Cc1ccccc1CN(C)[13CH3] 2230a_100000184421_200025704644 [0,1,0,0,0,0|2,0,1]=4 2546 B11R1.86 Cc1ccccc1CN(C)[13CH3] 269982a_100000184421_200025704644 [0,1,0,0,0,0|2,0,1]=4 2547 B11R1.86 Cc1cccnc1CC(=O)[13CH3] 1458a_200000722269_200025704644 [0,1,0,0,0,0|2,0,1]=4 2548 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,1,0,0,0,0|1,0,0]=2 2549 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,1,0,0,0,0|2,0,0]=3 2550 B11R1.86 Oc1ccccc1OC(F)F 271570a_203496583355_100000742724 [0,1,0,0,0,0|2,0,1]=4 2551 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [0,1,0,0,0,0|1,0,1]=3 2552 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [0,1,0,0,0,0|1,0,1]=3 2553 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [0,1,0,0,0,0|1,0,1]=3 2554 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [0,1,0,0,0,0|1,0,1]=3 2555 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,1,0,0,0,0|0,0,1]=2 2556 B11R1.86 [13CH3]C(=O)Cc1cccnc1Cl 1458a_100000093521_200025704644 [0,1,0,0,0,0|2,0,1]=4 2557 B11R1.86 [13CH3]C(=O)Cc1ncccc1Br 1458a_200012357574_200025704644 [0,1,0,0,0,0|2,0,1]=4 2558 B11R1.86 [13CH3]C(=O)Cc1ncccc1Cl 1458a_100011998755_200025704644 [0,1,0,0,0,0|2,0,1]=4 2559 B11R1.86 [13CH3]C(=O)Cn1ccccc1=O 1458a_100000189665_200025704644 [0,1,0,0,0,0|1,0,2]=4 2560 B11R1.182 C=C=Cc1cc(ccc1Br)Br 271570a_100015277604_100011483371 [0,1,0,0,0,0|1,0,2]=4 2561 B11R1.182 C=C=Cc1cc(ccc1Br)C 271570a_100015277604_100012353751 [0,1,0,0,0,0|1,0,2]=4 2562 B11R1.182 C=C=Cc1cc(ccc1Br)Cl 271570a_100015277604_100012339723 [0,1,0,0,0,0|1,0,2]=4 2563 B11R1.182 C=C=Cc1cc(ccc1Br)F 271570a_100015277604_100011217576 [0,1,0,0,0,0|1,0,2]=4 2564 B11R1.182 C=C=Cc1cc(ccc1Br)N 271570a_100015277604_100000750459 [0,1,0,0,0,0|1,0,2]=4 2565 B11R1.182 C=C=Cc1cc(ccc1Br)O 271570a_100015277604_100012339312 [0,1,0,0,0,0|1,0,2]=4 2566 B11R1.182 C=C=Cc1cc(ccc1C)Br 271570a_100015277604_100011344865 [0,1,0,0,0,0|1,0,2]=4 2567 B11R1.182 C=C=Cc1cc(ccc1C)C 271570a_100015277604_100000210833 [0,1,0,0,0,0|1,0,2]=4 2568 B11R1.182 C=C=Cc1cc(ccc1C)Cl 271570a_100015277604_100011263213 [0,1,0,0,0,0|1,0,2]=4 2569 B11R1.182 C=C=Cc1cc(ccc1C)F 271570a_100015277604_100011218078 [0,1,0,0,0,0|1,0,2]=4 2570 B11R1.182 C=C=Cc1cc(ccc1C)N 271570a_100015277604_100000736455 [0,1,0,0,0,0|1,0,2]=4 2571 B11R1.182 C=C=Cc1cc(ccc1C)O 271570a_100015277604_100011380479 [0,1,0,0,0,0|1,0,2]=4 2572 B11R1.182 C=C=Cc1cc(ccc1Cl)Br 271570a_100015277604_100011772130 [0,1,0,0,0,0|1,0,2]=4 2573 B11R1.182 C=C=Cc1cc(ccc1Cl)C 271570a_100015277604_100012356289 [0,1,0,0,0,0|1,0,2]=4 2574 B11R1.182 C=C=Cc1cc(ccc1Cl)Cl 271570a_100015277604_100000707729 [0,1,0,0,0,0|1,0,2]=4 2575 B11R1.182 C=C=Cc1cc(ccc1Cl)F 271570a_100015277604_100011217299 [0,1,0,0,0,0|1,0,2]=4 2576 B11R1.182 C=C=Cc1cc(ccc1Cl)N 271570a_100015277604_100012360549 [0,1,0,0,0,0|1,0,2]=4 2577 B11R1.182 C=C=Cc1cc(ccc1Cl)O 271570a_100015277604_100000049588 [0,1,0,0,0,0|1,0,2]=4 2578 B11R1.182 C=C=Cc1cc(ccc1F)Br 271570a_100015277604_100011217312 [0,1,0,0,0,0|1,0,2]=4 2579 B11R1.182 C=C=Cc1cc(ccc1F)C 271570a_100015277604_100000736223 [0,1,0,0,0,0|1,0,2]=4 2580 B11R1.182 C=C=Cc1cc(ccc1F)Cl 271570a_100015277604_100011218116 [0,1,0,0,0,0|1,0,2]=4 2581 B11R1.182 C=C=Cc1cc(ccc1F)F 271570a_100015277604_100000750033 [0,1,0,0,0,0|1,0,2]=4 2582 B11R1.182 C=C=Cc1cc(ccc1F)N 271570a_100015277604_100000760356 [0,1,0,0,0,0|1,0,2]=4 2583 B11R1.182 C=C=Cc1cc(ccc1F)O 271570a_100015277604_100000693481 [0,1,0,0,0,0|1,0,2]=4 2584 B11R1.182 C=C=Cc1cc(ccc1N)Br 271570a_100015277604_100000187925 [0,1,0,0,0,0|1,0,2]=4 2585 B11R1.182 C=C=Cc1cc(ccc1N)C 271570a_100015277604_100000210942 [0,1,0,0,0,0|1,0,2]=4 2586 B11R1.182 C=C=Cc1cc(ccc1N)Cl 271570a_100015277604_100000761889 [0,1,0,0,0,0|1,0,2]=4 2587 B11R1.182 C=C=Cc1cc(ccc1N)F 271570a_100015277604_100000760547 [0,1,0,0,0,0|1,0,2]=4 2588 B11R1.182 C=C=Cc1cc(ccc1N)N 271570a_100015277604_100011534242 [0,1,0,0,0,0|1,0,2]=4 2589 B11R1.182 C=C=Cc1cc(ccc1N)O 271570a_100015277604_100012001276 [0,1,0,0,0,0|1,0,2]=4 2590 B11R1.182 C=C=Cc1cc(ccc1O)Br 271570a_100015277604_100012355227 [0,1,0,0,0,0|0,0,2]=3 2591 B11R1.182 C=C=Cc1cc(ccc1O)C 271570a_100015277604_100000765521 [0,1,0,0,0,0|0,0,2]=3 2592 B11R1.182 C=C=Cc1cc(ccc1O)Cl 271570a_100015277604_100011356953 [0,1,0,0,0,0|0,0,2]=3 2593 B11R1.182 C=C=Cc1cc(ccc1O)F 271570a_100015277604_100000211999 [0,1,0,0,0,0|0,0,2]=3 2594 B11R1.182 C=C=Cc1cc(ccc1O)N 271570a_100015277604_100011534360 [0,1,0,0,0,0|0,0,2]=3 2595 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [0,1,0,0,0,0|0,0,2]=3 2596 B11R1.182 C=C=Cc1cc(cnc1O)Br 271570a_100015277604_100010197142 [0,1,0,0,0,0|1,0,2]=4 2597 B11R1.182 C=C=Cc1cc(cnc1O)C 271570a_100015277604_100000049931 [0,1,0,0,0,0|1,0,2]=4 2598 B11R1.182 C=C=Cc1cc(cnc1O)Cl 271570a_100015277604_100010188700 [0,1,0,0,0,0|1,0,2]=4 2599 B11R1.182 C=C=Cc1cc(ncc1O)C 271570a_100015277604_100009843476 [0,1,0,0,0,0|1,0,2]=4 2600 B11R1.182 C=C=Cc1cc(ncc1O)Cl 271570a_100015277604_100000698892 [0,1,0,0,0,0|1,0,2]=4 2601 B11R1.182 C=C=Cc1nc(ccc1O)Br 271570a_100015277604_100010253912 [0,1,0,0,0,0|1,0,2]=4 2602 B11R1.182 C=C=Cc1nc(ccc1O)C 271570a_100015277604_100000702858 [0,1,0,0,0,0|1,0,2]=4 2603 B11R1.182 C=C=Cc1nc(ccc1O)Cl 271570a_100015277604_100000696390 [0,1,0,0,0,0|1,0,2]=4 2604 B11R1.182 C=C=Cc1nc(ccc1O)F 271570a_100015277604_100010382442 [0,1,0,0,0,0|1,0,2]=4 2605 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [0,1,0,0,0,0|1,0,2]=4 2606 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [0,1,0,0,0,0|1,0,2]=4 2607 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [0,1,0,0,0,0|1,0,2]=4 2608 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [0,1,0,0,0,0|1,0,2]=4 2609 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [0,1,0,0,0,0|1,0,2]=4 2610 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [0,1,0,0,0,0|1,0,2]=4 2611 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [0,1,0,0,0,0|1,0,2]=4 2612 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [0,1,0,0,0,0|1,0,2]=4 2613 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [0,1,0,0,0,0|1,0,2]=4 2614 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [0,1,0,0,0,0|1,0,2]=4 2615 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [0,1,0,0,0,0|1,0,2]=4 2616 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [0,1,0,0,0,0|1,0,2]=4 2617 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [0,1,0,0,0,0|1,0,2]=4 2618 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [0,1,0,0,0,0|1,0,2]=4 2619 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [0,1,0,0,0,0|1,0,2]=4 2620 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [0,1,0,0,0,0|1,0,2]=4 2621 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [0,1,0,0,0,0|1,0,2]=4 2622 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [0,1,0,0,0,0|1,0,2]=4 2623 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [0,1,0,0,0,0|1,0,2]=4 2624 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [0,1,0,0,0,0|1,0,2]=4 2625 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [0,1,0,0,0,0|1,0,2]=4 2626 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [0,1,0,0,0,0|1,0,2]=4 2627 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [0,1,0,0,0,0|1,0,2]=4 2628 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [0,1,0,0,0,0|1,0,2]=4 2629 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [0,1,0,0,0,0|1,0,2]=4 2630 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [0,1,0,0,0,0|1,0,2]=4 2631 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [0,1,0,0,0,0|1,0,2]=4 2632 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [0,1,0,0,0,0|1,0,2]=4 2633 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [0,1,0,0,0,0|1,0,2]=4 2634 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [0,1,0,0,0,0|1,0,2]=4 2635 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [0,1,0,0,0,0|0,0,2]=3 2636 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [0,1,0,0,0,0|0,0,2]=3 2637 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [0,1,0,0,0,0|0,0,2]=3 2638 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [0,1,0,0,0,0|0,0,2]=3 2639 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [0,1,0,0,0,0|0,0,2]=3 2640 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [0,1,0,0,0,0|0,0,2]=3 2641 B11R1.182 CC=Cc1cc(cnc1O)Br 271570a_100016259895_100010197142 [0,1,0,0,0,0|1,0,2]=4 2642 B11R1.182 CC=Cc1cc(cnc1O)C 271570a_100016259895_100000049931 [0,1,0,0,0,0|1,0,2]=4 2643 B11R1.182 CC=Cc1cc(cnc1O)Cl 271570a_100016259895_100010188700 [0,1,0,0,0,0|1,0,2]=4 2644 B11R1.182 CC=Cc1cc(ncc1O)C 271570a_100016259895_100009843476 [0,1,0,0,0,0|1,0,2]=4 2645 B11R1.182 CC=Cc1cc(ncc1O)Cl 271570a_100016259895_100000698892 [0,1,0,0,0,0|1,0,2]=4 2646 B11R1.182 CC=Cc1nc(ccc1O)Br 271570a_100016259895_100010253912 [0,1,0,0,0,0|1,0,2]=4 2647 B11R1.182 CC=Cc1nc(ccc1O)C 271570a_100016259895_100000702858 [0,1,0,0,0,0|1,0,2]=4 2648 B11R1.182 CC=Cc1nc(ccc1O)Cl 271570a_100016259895_100000696390 [0,1,0,0,0,0|1,0,2]=4 2649 B11R1.182 CC=Cc1nc(ccc1O)F 271570a_100016259895_100010382442 [0,1,0,0,0,0|1,0,2]=4 2650 B11R1.182 CCNc1cc(ccc1O)Br 34a_100000752626_100000210202 [0,1,0,0,0,0|1,0,2]=4 2651 B11R1.182 CCNc1cc(ccc1O)C 34a_100011215204_100000210202 [0,1,0,0,0,0|1,0,2]=4 2652 B11R1.182 CCNc1cc(ccc1O)Cl 34a_100000210500_100000210202 [0,1,0,0,0,0|1,0,2]=4 2653 B11R1.182 CCNc1cc(ccc1O)F 34a_100000759472_100000210202 [0,1,0,0,0,0|1,0,2]=4 2654 B11R1.182 CCOc1cc(ccc1O)C 271570a_203496583355_200010713166 [0,1,0,0,0,0|1,0,2]=4 2655 B11R1.182 CCOc1cc(ccc1O)F 271570a_203496583355_200012340411 [0,1,0,0,0,0|1,0,2]=4 2656 B11R1.182 CCOc1cc(ccc1O)N 271570a_203496583355_200016990551 [0,1,0,0,0,0|1,0,2]=4 2657 B11R1.182 CCSc1cc(ccc1O)Br 62a_100000210202_100012355227 [0,1,0,0,0,0|1,0,2]=4 2658 B11R1.182 CCSc1cc(ccc1O)Br 62a_100012355227_100000210202 [0,1,0,0,0,0|1,0,2]=4 2659 B11R1.182 CCSc1cc(ccc1O)C 62a_100000210202_100000765521 [0,1,0,0,0,0|1,0,2]=4 2660 B11R1.182 CCSc1cc(ccc1O)C 62a_100000765521_100000210202 [0,1,0,0,0,0|1,0,2]=4 2661 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100000210202_100011356953 [0,1,0,0,0,0|1,0,2]=4 2662 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100011356953_100000210202 [0,1,0,0,0,0|1,0,2]=4 2663 B11R1.182 CCSc1cc(ccc1O)F 62a_100000210202_100000211999 [0,1,0,0,0,0|1,0,2]=4 2664 B11R1.182 CCSc1cc(ccc1O)F 62a_100000211999_100000210202 [0,1,0,0,0,0|1,0,2]=4 2665 B11R1.182 CCSc1cc(ccc1O)N 62a_100000210202_100011534360 [0,1,0,0,0,0|1,0,2]=4 2666 B11R1.182 CCSc1cc(ccc1O)N 62a_100011534360_100000210202 [0,1,0,0,0,0|1,0,2]=4 2667 B11R1.182 CCSc1cc(ccc1O)O 62a_100000210202_100009813629 [0,1,0,0,0,0|1,0,2]=4 2668 B11R1.182 CNCc1cc(ccc1Br)Br 207a_100102657272_100011266429 [0,1,0,0,0,0|2,0,1]=4 2669 B11R1.182 CNCc1cc(ccc1Br)Br 2230a_106832991635_100011982794 [0,1,0,0,0,0|2,0,1]=4 2670 B11R1.182 CNCc1cc(ccc1Br)Br 26a_100102657272_100011220040 [0,1,0,0,0,0|2,0,1]=4 2671 B11R1.182 CNCc1cc(ccc1Br)Br 270004a_106832991635_100011266429 [0,1,0,0,0,0|2,0,1]=4 2672 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100000707832_200000210301 [0,1,0,0,0,0|2,0,1]=4 2673 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100102657272_100011982794 [0,1,0,0,0,0|2,0,1]=4 2674 B11R1.182 CNCc1cc(ccc1Br)Br 7a_106832991635_100011982794 [0,1,0,0,0,0|2,0,1]=4 2675 B11R1.182 CNCc1cc(ccc1Br)C 207a_100102657272_100011551863 [0,1,0,0,0,0|2,0,1]=4 2676 B11R1.182 CNCc1cc(ccc1Br)C 26a_100102657272_100012002257 [0,1,0,0,0,0|2,0,1]=4 2677 B11R1.182 CNCc1cc(ccc1Br)C 270004a_106832991635_100011551863 [0,1,0,0,0,0|2,0,1]=4 2678 B11R1.182 CNCc1cc(ccc1Br)Cl 207a_100102657272_100000746314 [0,1,0,0,0,0|2,0,1]=4 2679 B11R1.182 CNCc1cc(ccc1Br)Cl 2230a_106832991635_100000733903 [0,1,0,0,0,0|2,0,1]=4 2680 B11R1.182 CNCc1cc(ccc1Br)Cl 26a_100102657272_100012339455 [0,1,0,0,0,0|2,0,1]=4 2681 B11R1.182 CNCc1cc(ccc1Br)Cl 270004a_106832991635_100000746314 [0,1,0,0,0,0|2,0,1]=4 2682 B11R1.182 CNCc1cc(ccc1Br)Cl 34a_100102657272_100000733903 [0,1,0,0,0,0|2,0,1]=4 2683 B11R1.182 CNCc1cc(ccc1Br)Cl 7a_106832991635_100000733903 [0,1,0,0,0,0|2,0,1]=4 2684 B11R1.182 CNCc1cc(ccc1Br)F 207a_100102657272_100000766564 [0,1,0,0,0,0|2,0,1]=4 2685 B11R1.182 CNCc1cc(ccc1Br)F 2230a_100000742738_200000210301 [0,1,0,0,0,0|2,0,1]=4 2686 B11R1.182 CNCc1cc(ccc1Br)F 2230a_106832991635_100000736370 [0,1,0,0,0,0|2,0,1]=4 2687 B11R1.182 CNCc1cc(ccc1Br)F 26a_100102657272_100000690578 [0,1,0,0,0,0|2,0,1]=4 2688 B11R1.182 CNCc1cc(ccc1Br)F 270004a_106832991635_100000766564 [0,1,0,0,0,0|2,0,1]=4 2689 B11R1.182 CNCc1cc(ccc1Br)F 34a_100000742738_200000210301 [0,1,0,0,0,0|2,0,1]=4 2690 B11R1.182 CNCc1cc(ccc1Br)F 34a_100102657272_100000736370 [0,1,0,0,0,0|2,0,1]=4 2691 B11R1.182 CNCc1cc(ccc1Br)F 7a_106832991635_100000736370 [0,1,0,0,0,0|2,0,1]=4 2692 B11R1.182 CNCc1cc(ccc1Br)I 207a_100102657272_100010185652 [0,1,0,0,0,0|2,0,1]=4 2693 B11R1.182 CNCc1cc(ccc1Br)I 2230a_106832991635_100012355412 [0,1,0,0,0,0|2,0,1]=4 2694 B11R1.182 CNCc1cc(ccc1Br)I 26a_100102657272_100012356990 [0,1,0,0,0,0|2,0,1]=4 2695 B11R1.182 CNCc1cc(ccc1Br)I 34a_100102657272_100012355412 [0,1,0,0,0,0|2,0,1]=4 2696 B11R1.182 CNCc1cc(ccc1Br)I 7a_106832991635_100012355412 [0,1,0,0,0,0|2,0,1]=4 2697 B11R1.182 CNCc1cc(ccc1C)Br 207a_100102657272_100011361606 [0,1,0,0,0,0|2,0,1]=4 2698 B11R1.182 CNCc1cc(ccc1C)Br 26a_100102657272_100000685420 [0,1,0,0,0,0|2,0,1]=4 2699 B11R1.182 CNCc1cc(ccc1C)Br 270004a_106832991635_100011361606 [0,1,0,0,0,0|2,0,1]=4 2700 B11R1.182 CNCc1cc(ccc1C)C 207a_100102657272_100000211343 [0,1,0,0,0,0|2,0,1]=4 2701 B11R1.182 CNCc1cc(ccc1C)C 2230a_106832991635_100000184699 [0,1,0,0,0,0|2,0,1]=4 2702 B11R1.182 CNCc1cc(ccc1C)C 270004a_106832991635_100000211343 [0,1,0,0,0,0|2,0,1]=4 2703 B11R1.182 CNCc1cc(ccc1C)C 34a_100000174964_200000210301 [0,1,0,0,0,0|2,0,1]=4 2704 B11R1.182 CNCc1cc(ccc1C)C 34a_100102657272_100000184699 [0,1,0,0,0,0|2,0,1]=4 2705 B11R1.182 CNCc1cc(ccc1C)C 7a_106832991635_100000184699 [0,1,0,0,0,0|2,0,1]=4 2706 B11R1.182 CNCc1cc(ccc1C)Cl 207a_100102657272_100011551331 [0,1,0,0,0,0|2,0,1]=4 2707 B11R1.182 CNCc1cc(ccc1C)Cl 2230a_106832991635_100012186985 [0,1,0,0,0,0|2,0,1]=4 2708 B11R1.182 CNCc1cc(ccc1C)Cl 270004a_106832991635_100011551331 [0,1,0,0,0,0|2,0,1]=4 2709 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100000717755_200000210301 [0,1,0,0,0,0|2,0,1]=4 2710 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100102657272_100012186985 [0,1,0,0,0,0|2,0,1]=4 2711 B11R1.182 CNCc1cc(ccc1C)Cl 7a_106832991635_100012186985 [0,1,0,0,0,0|2,0,1]=4 2712 B11R1.182 CNCc1cc(ccc1C)F 207a_100102657272_100000697687 [0,1,0,0,0,0|2,0,1]=4 2713 B11R1.182 CNCc1cc(ccc1C)F 2230a_106832991635_100000709795 [0,1,0,0,0,0|2,0,1]=4 2714 B11R1.182 CNCc1cc(ccc1C)F 270004a_106832991635_100000697687 [0,1,0,0,0,0|2,0,1]=4 2715 B11R1.182 CNCc1cc(ccc1C)F 34a_100011217291_200000210301 [0,1,0,0,0,0|2,0,1]=4 2716 B11R1.182 CNCc1cc(ccc1C)F 34a_100102657272_100000709795 [0,1,0,0,0,0|2,0,1]=4 2717 B11R1.182 CNCc1cc(ccc1C)F 7a_106832991635_100000709795 [0,1,0,0,0,0|2,0,1]=4 2718 B11R1.182 CNCc1cc(ccc1C)O 271570a_203496583355_106744473289 [0,1,0,0,0,0|2,0,1]=4 2719 B11R1.182 CNCc1cc(ccc1C)O 34a_200009844824_200000210301 [0,1,0,0,0,0|2,0,1]=4 2720 B11R1.182 CNCc1cc(ccc1Cl)Br 207a_100102657272_100000746309 [0,1,0,0,0,0|2,0,1]=4 2721 B11R1.182 CNCc1cc(ccc1Cl)Br 2230a_106832991635_100000763347 [0,1,0,0,0,0|2,0,1]=4 2722 B11R1.182 CNCc1cc(ccc1Cl)Br 26a_100102657272_100000738945 [0,1,0,0,0,0|2,0,1]=4 2723 B11R1.182 CNCc1cc(ccc1Cl)Br 270004a_106832991635_100000746309 [0,1,0,0,0,0|2,0,1]=4 2724 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100025772652_200000210301 [0,1,0,0,0,0|2,0,1]=4 2725 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100102657272_100000763347 [0,1,0,0,0,0|2,0,1]=4 2726 B11R1.182 CNCc1cc(ccc1Cl)Br 7a_106832991635_100000763347 [0,1,0,0,0,0|2,0,1]=4 2727 B11R1.182 CNCc1cc(ccc1Cl)C 207a_100102657272_100011551332 [0,1,0,0,0,0|2,0,1]=4 2728 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_100025705715_200000210301 [0,1,0,0,0,0|2,0,1]=4 2729 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_106832991635_100009871730 [0,1,0,0,0,0|2,0,1]=4 2730 B11R1.182 CNCc1cc(ccc1Cl)C 26a_100102657272_100000211493 [0,1,0,0,0,0|2,0,1]=4 2731 B11R1.182 CNCc1cc(ccc1Cl)C 270004a_106832991635_100011551332 [0,1,0,0,0,0|2,0,1]=4 2732 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100025705715_200000210301 [0,1,0,0,0,0|2,0,1]=4 2733 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100102657272_100009871730 [0,1,0,0,0,0|2,0,1]=4 2734 B11R1.182 CNCc1cc(ccc1Cl)C 7a_106832991635_100009871730 [0,1,0,0,0,0|2,0,1]=4 2735 B11R1.182 CNCc1cc(ccc1Cl)Cl 207a_100102657272_100000746308 [0,1,0,0,0,0|2,0,1]=4 2736 B11R1.182 CNCc1cc(ccc1Cl)Cl 2230a_106832991635_100000756322 [0,1,0,0,0,0|2,0,1]=4 2737 B11R1.182 CNCc1cc(ccc1Cl)Cl 26a_100102657272_100000211422 [0,1,0,0,0,0|2,0,1]=4 2738 B11R1.182 CNCc1cc(ccc1Cl)Cl 270004a_106832991635_100000746308 [0,1,0,0,0,0|2,0,1]=4 2739 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102657272_100000756322 [0,1,0,0,0,0|2,0,1]=4 2740 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102946428_200000210301 [0,1,0,0,0,0|2,0,1]=4 2741 B11R1.182 CNCc1cc(ccc1Cl)Cl 7a_106832991635_100000756322 [0,1,0,0,0,0|2,0,1]=4 2742 B11R1.182 CNCc1cc(ccc1Cl)F 207a_100102657272_100011218309 [0,1,0,0,0,0|2,0,1]=4 2743 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_100011830483_200000210301 [0,1,0,0,0,0|2,0,1]=4 2744 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_106832991635_100000709952 [0,1,0,0,0,0|2,0,1]=4 2745 B11R1.182 CNCc1cc(ccc1Cl)F 26a_100102657272_100000692107 [0,1,0,0,0,0|2,0,1]=4 2746 B11R1.182 CNCc1cc(ccc1Cl)F 270004a_106832991635_100011218309 [0,1,0,0,0,0|2,0,1]=4 2747 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100011830483_200000210301 [0,1,0,0,0,0|2,0,1]=4 2748 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100102657272_100000709952 [0,1,0,0,0,0|2,0,1]=4 2749 B11R1.182 CNCc1cc(ccc1Cl)F 7a_106832991635_100000709952 [0,1,0,0,0,0|2,0,1]=4 2750 B11R1.182 CNCc1cc(ccc1Cl)I 207a_100102657272_100010254384 [0,1,0,0,0,0|2,0,1]=4 2751 B11R1.182 CNCc1cc(ccc1Cl)I 2230a_106832991635_100010188191 [0,1,0,0,0,0|2,0,1]=4 2752 B11R1.182 CNCc1cc(ccc1Cl)I 34a_100102657272_100010188191 [0,1,0,0,0,0|2,0,1]=4 2753 B11R1.182 CNCc1cc(ccc1Cl)I 7a_106832991635_100010188191 [0,1,0,0,0,0|2,0,1]=4 2754 B11R1.182 CNCc1cc(ccc1F)Br 207a_100102657272_100000211465 [0,1,0,0,0,0|2,0,1]=4 2755 B11R1.182 CNCc1cc(ccc1F)Br 2230a_106832991635_100000736399 [0,1,0,0,0,0|2,0,1]=4 2756 B11R1.182 CNCc1cc(ccc1F)Br 26a_100102657272_100000686035 [0,1,0,0,0,0|2,0,1]=4 2757 B11R1.182 CNCc1cc(ccc1F)Br 270004a_106832991635_100000211465 [0,1,0,0,0,0|2,0,1]=4 2758 B11R1.182 CNCc1cc(ccc1F)Br 34a_100009815772_200000210301 [0,1,0,0,0,0|2,0,1]=4 2759 B11R1.182 CNCc1cc(ccc1F)Br 34a_100102657272_100000736399 [0,1,0,0,0,0|2,0,1]=4 2760 B11R1.182 CNCc1cc(ccc1F)Br 7a_106832991635_100000736399 [0,1,0,0,0,0|2,0,1]=4 2761 B11R1.182 CNCc1cc(ccc1F)C 207a_100102657272_100000756917 [0,1,0,0,0,0|2,0,1]=4 2762 B11R1.182 CNCc1cc(ccc1F)C 2230a_106832991635_100011260760 [0,1,0,0,0,0|2,0,1]=4 2763 B11R1.182 CNCc1cc(ccc1F)C 270004a_106832991635_100000756917 [0,1,0,0,0,0|2,0,1]=4 2764 B11R1.182 CNCc1cc(ccc1F)C 34a_100102657272_100011260760 [0,1,0,0,0,0|2,0,1]=4 2765 B11R1.182 CNCc1cc(ccc1F)C 34a_100102693586_200000210301 [0,1,0,0,0,0|2,0,1]=4 2766 B11R1.182 CNCc1cc(ccc1F)C 7a_106832991635_100011260760 [0,1,0,0,0,0|2,0,1]=4 2767 B11R1.182 CNCc1cc(ccc1F)Cl 207a_100102657272_100000745245 [0,1,0,0,0,0|2,0,1]=4 2768 B11R1.182 CNCc1cc(ccc1F)Cl 2230a_106832991635_100000716957 [0,1,0,0,0,0|2,0,1]=4 2769 B11R1.182 CNCc1cc(ccc1F)Cl 270004a_106832991635_100000745245 [0,1,0,0,0,0|2,0,1]=4 2770 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100011211646_200000210301 [0,1,0,0,0,0|2,0,1]=4 2771 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100102657272_100000716957 [0,1,0,0,0,0|2,0,1]=4 2772 B11R1.182 CNCc1cc(ccc1F)Cl 7a_106832991635_100000716957 [0,1,0,0,0,0|2,0,1]=4 2773 B11R1.182 CNCc1cc(ccc1F)F 207a_100102657272_100000740046 [0,1,0,0,0,0|2,0,1]=4 2774 B11R1.182 CNCc1cc(ccc1F)F 2230a_106832991635_100000741279 [0,1,0,0,0,0|2,0,1]=4 2775 B11R1.182 CNCc1cc(ccc1F)F 270004a_106832991635_100000740046 [0,1,0,0,0,0|2,0,1]=4 2776 B11R1.182 CNCc1cc(ccc1F)F 34a_100000752317_200000210301 [0,1,0,0,0,0|2,0,1]=4 2777 B11R1.182 CNCc1cc(ccc1F)F 34a_100102657272_100000741279 [0,1,0,0,0,0|2,0,1]=4 2778 B11R1.182 CNCc1cc(ccc1F)F 7a_106832991635_100000741279 [0,1,0,0,0,0|2,0,1]=4 2779 B11R1.182 CNCc1cc(ccc1F)I 207a_100102657272_100000050626 [0,1,0,0,0,0|2,0,1]=4 2780 B11R1.182 CNCc1cc(ccc1F)I 2230a_106832991635_200010149601 [0,1,0,0,0,0|2,0,1]=4 2781 B11R1.182 CNCc1cc(ccc1F)I 34a_100102657272_200010149601 [0,1,0,0,0,0|2,0,1]=4 2782 B11R1.182 CNCc1cc(ccc1F)I 7a_106832991635_200010149601 [0,1,0,0,0,0|2,0,1]=4 2783 B11R1.182 CNCc1cc(ccc1F)O 271570a_203496583355_100000748472 [0,1,0,0,0,0|2,0,1]=4 2784 B11R1.182 CNCc1cc(ccc1I)Br 207a_100102657272_100010185651 [0,1,0,0,0,0|2,0,1]=4 2785 B11R1.182 CNCc1cc(ccc1I)Br 2230a_106832991635_100012362523 [0,1,0,0,0,0|2,0,1]=4 2786 B11R1.182 CNCc1cc(ccc1I)Br 26a_100102657272_100012344904 [0,1,0,0,0,0|2,0,1]=4 2787 B11R1.182 CNCc1cc(ccc1I)Br 270004a_106832991635_100010185651 [0,1,0,0,0,0|2,0,1]=4 2788 B11R1.182 CNCc1cc(ccc1I)Br 34a_100102657272_100012362523 [0,1,0,0,0,0|2,0,1]=4 2789 B11R1.182 CNCc1cc(ccc1I)Br 7a_106832991635_100012362523 [0,1,0,0,0,0|2,0,1]=4 2790 B11R1.182 CNCc1cc(ccc1I)C 207a_100102657272_100010150105 [0,1,0,0,0,0|2,0,1]=4 2791 B11R1.182 CNCc1cc(ccc1I)C 270004a_106832991635_100010150105 [0,1,0,0,0,0|2,0,1]=4 2792 B11R1.182 CNCc1cc(ccc1I)Cl 207a_100102657272_100010254386 [0,1,0,0,0,0|2,0,1]=4 2793 B11R1.182 CNCc1cc(ccc1I)Cl 2230a_106832991635_100012348826 [0,1,0,0,0,0|2,0,1]=4 2794 B11R1.182 CNCc1cc(ccc1I)Cl 270004a_106832991635_100010254386 [0,1,0,0,0,0|2,0,1]=4 2795 B11R1.182 CNCc1cc(ccc1I)Cl 34a_100102657272_100012348826 [0,1,0,0,0,0|2,0,1]=4 2796 B11R1.182 CNCc1cc(ccc1I)Cl 7a_106832991635_100012348826 [0,1,0,0,0,0|2,0,1]=4 2797 B11R1.182 CNCc1cc(ccc1I)F 207a_100102657272_100010186294 [0,1,0,0,0,0|2,0,1]=4 2798 B11R1.182 CNCc1cc(ccc1I)F 2230a_106832991635_100010149606 [0,1,0,0,0,0|2,0,1]=4 2799 B11R1.182 CNCc1cc(ccc1I)F 270004a_106832991635_100010186294 [0,1,0,0,0,0|2,0,1]=4 2800 B11R1.182 CNCc1cc(ccc1I)F 34a_100102657272_100010149606 [0,1,0,0,0,0|2,0,1]=4 2801 B11R1.182 CNCc1cc(ccc1I)F 7a_106832991635_100010149606 [0,1,0,0,0,0|2,0,1]=4 2802 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [0,1,0,0,0,0|1,0,1]=3 2803 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [0,1,0,0,0,0|1,0,1]=3 2804 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [0,1,0,0,0,0|1,0,1]=3 2805 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [0,1,0,0,0,0|1,0,1]=3 2806 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [0,1,0,0,0,0|1,0,1]=3 2807 B11R1.182 CNCc1cc(cnc1O)Br 207a_100102657272_100010064889 [0,1,0,0,0,0|2,0,1]=4 2808 B11R1.182 CNCc1cc(cnc1O)Br 270004a_106832991635_100010064889 [0,1,0,0,0,0|2,0,1]=4 2809 B11R1.182 CNCc1nc(ccc1O)C 2230a_106832991635_100020630696 [0,1,0,0,0,0|2,0,1]=4 2810 B11R1.182 CNCc1nc(ccc1O)C 34a_100102657272_100020630696 [0,1,0,0,0,0|2,0,1]=4 2811 B11R1.182 CNCc1nc(ccc1O)C 7a_106832991635_100020630696 [0,1,0,0,0,0|2,0,1]=4 2812 B11R1.182 COCc1cc(ccc1Br)Br 34a_100011266457_200000210301 [0,1,0,0,0,0|2,0,1]=4 2813 B11R1.182 COCc1cc(ccc1Br)Br 34a_100138415774_100011982794 [0,1,0,0,0,0|2,0,1]=4 2814 B11R1.182 COCc1cc(ccc1Br)Br 7a_100011266457_200000210301 [0,1,0,0,0,0|2,0,1]=4 2815 B11R1.182 COCc1cc(ccc1Br)C 34a_100012361352_200000210301 [0,1,0,0,0,0|2,0,1]=4 2816 B11R1.182 COCc1cc(ccc1Br)C 7a_100012361352_200000210301 [0,1,0,0,0,0|2,0,1]=4 2817 B11R1.182 COCc1cc(ccc1Br)Cl 34a_100012355668_200000210301 [0,1,0,0,0,0|2,0,1]=4 2818 B11R1.182 COCc1cc(ccc1Br)Cl 34a_100138415774_100000733903 [0,1,0,0,0,0|2,0,1]=4 2819 B11R1.182 COCc1cc(ccc1Br)Cl 7a_100012355668_200000210301 [0,1,0,0,0,0|2,0,1]=4 2820 B11R1.182 COCc1cc(ccc1Br)F 34a_100011217561_200000210301 [0,1,0,0,0,0|2,0,1]=4 2821 B11R1.182 COCc1cc(ccc1Br)F 34a_100138415774_100000736370 [0,1,0,0,0,0|2,0,1]=4 2822 B11R1.182 COCc1cc(ccc1Br)F 7a_100011217561_200000210301 [0,1,0,0,0,0|2,0,1]=4 2823 B11R1.182 COCc1cc(ccc1Br)I 34a_100138415774_100012355412 [0,1,0,0,0,0|2,0,1]=4 2824 B11R1.182 COCc1cc(ccc1Br)I 7a_100012359683_200000210301 [0,1,0,0,0,0|2,0,1]=4 2825 B11R1.182 COCc1cc(ccc1Br)N 34a_100012347228_200000210301 [0,1,0,0,0,0|2,0,1]=4 2826 B11R1.182 COCc1cc(ccc1Br)O 271570a_203496583355_202125822959 [0,1,0,0,0,0|2,0,1]=4 2827 B11R1.182 COCc1cc(ccc1C)Br 34a_100000700630_200000210301 [0,1,0,0,0,0|2,0,1]=4 2828 B11R1.182 COCc1cc(ccc1C)Br 7a_100000700630_200000210301 [0,1,0,0,0,0|2,0,1]=4 2829 B11R1.182 COCc1cc(ccc1C)C 34a_100138415774_100000184699 [0,1,0,0,0,0|2,0,1]=4 2830 B11R1.182 COCc1cc(ccc1C)C 34a_200011215349_200000210301 [0,1,0,0,0,0|2,0,1]=4 2831 B11R1.182 COCc1cc(ccc1C)C 7a_200011215349_200000210301 [0,1,0,0,0,0|2,0,1]=4 2832 B11R1.182 COCc1cc(ccc1C)Cl 34a_100012002407_200000210301 [0,1,0,0,0,0|2,0,1]=4 2833 B11R1.182 COCc1cc(ccc1C)Cl 34a_100138415774_100012186985 [0,1,0,0,0,0|2,0,1]=4 2834 B11R1.182 COCc1cc(ccc1C)Cl 7a_100012002407_200000210301 [0,1,0,0,0,0|2,0,1]=4 2835 B11R1.182 COCc1cc(ccc1C)F 34a_100011219218_200000210301 [0,1,0,0,0,0|2,0,1]=4 2836 B11R1.182 COCc1cc(ccc1C)F 34a_100138415774_100000709795 [0,1,0,0,0,0|2,0,1]=4 2837 B11R1.182 COCc1cc(ccc1C)F 7a_100011219218_200000210301 [0,1,0,0,0,0|2,0,1]=4 2838 B11R1.182 COCc1cc(ccc1C)I 34a_100010150140_200000210301 [0,1,0,0,0,0|2,0,1]=4 2839 B11R1.182 COCc1cc(ccc1C)I 7a_100010150140_200000210301 [0,1,0,0,0,0|2,0,1]=4 2840 B11R1.182 COCc1cc(ccc1Cl)Br 34a_100011215897_200000210301 [0,1,0,0,0,0|2,0,1]=4 2841 B11R1.182 COCc1cc(ccc1Cl)Br 34a_100138415774_100000763347 [0,1,0,0,0,0|2,0,1]=4 2842 B11R1.182 COCc1cc(ccc1Cl)Br 7a_100011215897_200000210301 [0,1,0,0,0,0|2,0,1]=4 2843 B11R1.182 COCc1cc(ccc1Cl)C 34a_100009878994_200000210301 [0,1,0,0,0,0|2,0,1]=4 2844 B11R1.182 COCc1cc(ccc1Cl)C 34a_100138415774_100009871730 [0,1,0,0,0,0|2,0,1]=4 2845 B11R1.182 COCc1cc(ccc1Cl)C 7a_100009878994_200000210301 [0,1,0,0,0,0|2,0,1]=4 2846 B11R1.182 COCc1cc(ccc1Cl)Cl 34a_100000698905_200000210301 [0,1,0,0,0,0|2,0,1]=4 2847 B11R1.182 COCc1cc(ccc1Cl)Cl 34a_100138415774_100000756322 [0,1,0,0,0,0|2,0,1]=4 2848 B11R1.182 COCc1cc(ccc1Cl)Cl 7a_100000698905_200000210301 [0,1,0,0,0,0|2,0,1]=4 2849 B11R1.182 COCc1cc(ccc1Cl)F 34a_100011218361_200000210301 [0,1,0,0,0,0|2,0,1]=4 2850 B11R1.182 COCc1cc(ccc1Cl)F 34a_100138415774_100000709952 [0,1,0,0,0,0|2,0,1]=4 2851 B11R1.182 COCc1cc(ccc1Cl)F 7a_100011218361_200000210301 [0,1,0,0,0,0|2,0,1]=4 2852 B11R1.182 COCc1cc(ccc1Cl)I 34a_100010128486_200000210301 [0,1,0,0,0,0|2,0,1]=4 2853 B11R1.182 COCc1cc(ccc1Cl)I 34a_100138415774_100010188191 [0,1,0,0,0,0|2,0,1]=4 2854 B11R1.182 COCc1cc(ccc1Cl)I 7a_100010128486_200000210301 [0,1,0,0,0,0|2,0,1]=4 2855 B11R1.182 COCc1cc(ccc1Cl)N 34a_100011273577_200000210301 [0,1,0,0,0,0|2,0,1]=4 2856 B11R1.182 COCc1cc(ccc1F)Br 34a_100000246282_200000210301 [0,1,0,0,0,0|2,0,1]=4 2857 B11R1.182 COCc1cc(ccc1F)Br 34a_100138415774_100000736399 [0,1,0,0,0,0|2,0,1]=4 2858 B11R1.182 COCc1cc(ccc1F)Br 7a_100000246282_200000210301 [0,1,0,0,0,0|2,0,1]=4 2859 B11R1.182 COCc1cc(ccc1F)C 34a_100011692775_200000210301 [0,1,0,0,0,0|2,0,1]=4 2860 B11R1.182 COCc1cc(ccc1F)C 34a_100138415774_100011260760 [0,1,0,0,0,0|2,0,1]=4 2861 B11R1.182 COCc1cc(ccc1F)C 7a_100011692775_200000210301 [0,1,0,0,0,0|2,0,1]=4 2862 B11R1.182 COCc1cc(ccc1F)Cl 34a_100011217248_200000210301 [0,1,0,0,0,0|2,0,1]=4 2863 B11R1.182 COCc1cc(ccc1F)Cl 34a_100138415774_100000716957 [0,1,0,0,0,0|2,0,1]=4 2864 B11R1.182 COCc1cc(ccc1F)Cl 7a_100011217248_200000210301 [0,1,0,0,0,0|2,0,1]=4 2865 B11R1.182 COCc1cc(ccc1F)F 34a_100011217725_200000210301 [0,1,0,0,0,0|2,0,1]=4 2866 B11R1.182 COCc1cc(ccc1F)F 34a_100138415774_100000741279 [0,1,0,0,0,0|2,0,1]=4 2867 B11R1.182 COCc1cc(ccc1F)F 7a_100011217725_200000210301 [0,1,0,0,0,0|2,0,1]=4 2868 B11R1.182 COCc1cc(ccc1F)I 34a_100000049604_200000210301 [0,1,0,0,0,0|2,0,1]=4 2869 B11R1.182 COCc1cc(ccc1F)I 34a_100138415774_200010149601 [0,1,0,0,0,0|2,0,1]=4 2870 B11R1.182 COCc1cc(ccc1F)I 7a_100000049604_200000210301 [0,1,0,0,0,0|2,0,1]=4 2871 B11R1.182 COCc1cc(ccc1F)N 34a_100011218011_200000210301 [0,1,0,0,0,0|2,0,1]=4 2872 B11R1.182 COCc1cc(ccc1F)O 271570a_203496583355_100010140362 [0,1,0,0,0,0|2,0,1]=4 2873 B11R1.182 COCc1cc(ccc1I)Br 34a_100011356890_200000210301 [0,1,0,0,0,0|2,0,1]=4 2874 B11R1.182 COCc1cc(ccc1I)Br 34a_100138415774_100012362523 [0,1,0,0,0,0|2,0,1]=4 2875 B11R1.182 COCc1cc(ccc1I)Br 7a_100011356890_200000210301 [0,1,0,0,0,0|2,0,1]=4 2876 B11R1.182 COCc1cc(ccc1I)Cl 34a_100138415774_100012348826 [0,1,0,0,0,0|2,0,1]=4 2877 B11R1.182 COCc1cc(ccc1I)F 34a_100010255287_200000210301 [0,1,0,0,0,0|2,0,1]=4 2878 B11R1.182 COCc1cc(ccc1I)F 34a_100138415774_100010149606 [0,1,0,0,0,0|2,0,1]=4 2879 B11R1.182 COCc1cc(ccc1I)F 7a_100010255287_200000210301 [0,1,0,0,0,0|2,0,1]=4 2880 B11R1.182 COCc1cc(ccc1N)Br 34a_100012353972_200000210301 [0,1,0,0,0,0|2,0,1]=4 2881 B11R1.182 COCc1cc(ccc1N)Br 7a_100012353972_200000210301 [0,1,0,0,0,0|2,0,1]=4 2882 B11R1.182 COCc1cc(ccc1N)C 34a_100011215565_200000210301 [0,1,0,0,0,0|2,0,1]=4 2883 B11R1.182 COCc1cc(ccc1N)C 7a_100011215565_200000210301 [0,1,0,0,0,0|2,0,1]=4 2884 B11R1.182 COCc1cc(ccc1N)Cl 34a_100011214999_200000210301 [0,1,0,0,0,0|2,0,1]=4 2885 B11R1.182 COCc1cc(ccc1N)Cl 7a_100011214999_200000210301 [0,1,0,0,0,0|2,0,1]=4 2886 B11R1.182 COCc1cc(ccc1N)F 34a_100011296978_200000210301 [0,1,0,0,0,0|2,0,1]=4 2887 B11R1.182 COCc1cc(ccc1N)F 7a_100011296978_200000210301 [0,1,0,0,0,0|2,0,1]=4 2888 B11R1.182 COCc1cc(ccc1O)F 34a_100138415774_100010161318 [0,1,0,0,0,0|1,0,1]=3 2889 B11R1.182 COCc1nc(ccc1O)C 34a_100138415774_100020630696 [0,1,0,0,0,0|2,0,1]=4 2890 B11R1.182 CSCc1cc(ccc1Br)Br 62a_100011982794_200000210301 [0,1,0,0,0,0|2,0,1]=4 2891 B11R1.182 CSCc1cc(ccc1Br)Br 62a_200000210301_100011982794 [0,1,0,0,0,0|2,0,1]=4 2892 B11R1.182 CSCc1cc(ccc1Br)Cl 62a_100000733903_200000210301 [0,1,0,0,0,0|2,0,1]=4 2893 B11R1.182 CSCc1cc(ccc1Br)Cl 62a_200000210301_100000733903 [0,1,0,0,0,0|2,0,1]=4 2894 B11R1.182 CSCc1cc(ccc1Br)F 62a_100000736370_200000210301 [0,1,0,0,0,0|2,0,1]=4 2895 B11R1.182 CSCc1cc(ccc1Br)F 62a_200000210301_100000736370 [0,1,0,0,0,0|2,0,1]=4 2896 B11R1.182 CSCc1cc(ccc1Br)I 62a_100012355412_200000210301 [0,1,0,0,0,0|2,0,1]=4 2897 B11R1.182 CSCc1cc(ccc1Br)I 62a_200000210301_100012355412 [0,1,0,0,0,0|2,0,1]=4 2898 B11R1.182 CSCc1cc(ccc1C)C 62a_100000184699_200000210301 [0,1,0,0,0,0|2,0,1]=4 2899 B11R1.182 CSCc1cc(ccc1C)C 62a_200000210301_100000184699 [0,1,0,0,0,0|2,0,1]=4 2900 B11R1.182 CSCc1cc(ccc1C)Cl 62a_100012186985_200000210301 [0,1,0,0,0,0|2,0,1]=4 2901 B11R1.182 CSCc1cc(ccc1C)Cl 62a_200000210301_100012186985 [0,1,0,0,0,0|2,0,1]=4 2902 B11R1.182 CSCc1cc(ccc1C)F 62a_100000709795_200000210301 [0,1,0,0,0,0|2,0,1]=4 2903 B11R1.182 CSCc1cc(ccc1C)F 62a_200000210301_100000709795 [0,1,0,0,0,0|2,0,1]=4 2904 B11R1.182 CSCc1cc(ccc1Cl)Br 62a_100000763347_200000210301 [0,1,0,0,0,0|2,0,1]=4 2905 B11R1.182 CSCc1cc(ccc1Cl)Br 62a_200000210301_100000763347 [0,1,0,0,0,0|2,0,1]=4 2906 B11R1.182 CSCc1cc(ccc1Cl)C 62a_100009871730_200000210301 [0,1,0,0,0,0|2,0,1]=4 2907 B11R1.182 CSCc1cc(ccc1Cl)C 62a_200000210301_100009871730 [0,1,0,0,0,0|2,0,1]=4 2908 B11R1.182 CSCc1cc(ccc1Cl)Cl 62a_100000756322_200000210301 [0,1,0,0,0,0|2,0,1]=4 2909 B11R1.182 CSCc1cc(ccc1Cl)Cl 62a_200000210301_100000756322 [0,1,0,0,0,0|2,0,1]=4 2910 B11R1.182 CSCc1cc(ccc1Cl)F 62a_100000709952_200000210301 [0,1,0,0,0,0|2,0,1]=4 2911 B11R1.182 CSCc1cc(ccc1Cl)F 62a_200000210301_100000709952 [0,1,0,0,0,0|2,0,1]=4 2912 B11R1.182 CSCc1cc(ccc1Cl)I 62a_100010188191_200000210301 [0,1,0,0,0,0|2,0,1]=4 2913 B11R1.182 CSCc1cc(ccc1Cl)I 62a_200000210301_100010188191 [0,1,0,0,0,0|2,0,1]=4 2914 B11R1.182 CSCc1cc(ccc1F)Br 62a_100000736399_200000210301 [0,1,0,0,0,0|2,0,1]=4 2915 B11R1.182 CSCc1cc(ccc1F)Br 62a_200000210301_100000736399 [0,1,0,0,0,0|2,0,1]=4 2916 B11R1.182 CSCc1cc(ccc1F)C 62a_100011260760_200000210301 [0,1,0,0,0,0|2,0,1]=4 2917 B11R1.182 CSCc1cc(ccc1F)C 62a_200000210301_100011260760 [0,1,0,0,0,0|2,0,1]=4 2918 B11R1.182 CSCc1cc(ccc1F)Cl 62a_100000716957_200000210301 [0,1,0,0,0,0|2,0,1]=4 2919 B11R1.182 CSCc1cc(ccc1F)Cl 62a_200000210301_100000716957 [0,1,0,0,0,0|2,0,1]=4 2920 B11R1.182 CSCc1cc(ccc1F)F 62a_100000685659_200000210301 [0,1,0,0,0,0|2,0,1]=4 2921 B11R1.182 CSCc1cc(ccc1F)F 62a_200000210301_100000685659 [0,1,0,0,0,0|2,0,1]=4 2922 B11R1.182 CSCc1cc(ccc1F)I 62a_200000210301_200010149601 [0,1,0,0,0,0|2,0,1]=4 2923 B11R1.182 CSCc1cc(ccc1F)I 62a_200010149601_200000210301 [0,1,0,0,0,0|2,0,1]=4 2924 B11R1.182 CSCc1cc(ccc1I)Br 62a_100012362523_200000210301 [0,1,0,0,0,0|2,0,1]=4 2925 B11R1.182 CSCc1cc(ccc1I)Br 62a_200000210301_100012362523 [0,1,0,0,0,0|2,0,1]=4 2926 B11R1.182 CSCc1cc(ccc1I)Cl 62a_100012348826_200000210301 [0,1,0,0,0,0|2,0,1]=4 2927 B11R1.182 CSCc1cc(ccc1I)Cl 62a_200000210301_100012348826 [0,1,0,0,0,0|2,0,1]=4 2928 B11R1.182 CSCc1cc(ccc1I)F 62a_100010149606_200000210301 [0,1,0,0,0,0|2,0,1]=4 2929 B11R1.182 CSCc1cc(ccc1I)F 62a_200000210301_100010149606 [0,1,0,0,0,0|2,0,1]=4 2930 B11R1.182 CSCc1cc(ccc1O)F 62a_100010161318_200000210301 [0,1,0,0,0,0|1,0,1]=3 2931 B11R1.182 CSCc1cc(ccc1O)F 62a_200000210301_100010161318 [0,1,0,0,0,0|1,0,1]=3 2932 B11R1.182 CSCc1nc(ccc1O)C 62a_100020630696_200000210301 [0,1,0,0,0,0|2,0,1]=4 2933 B11R1.182 CSCc1nc(ccc1O)C 62a_200000210301_100020630696 [0,1,0,0,0,0|2,0,1]=4 2934 B11R1.182 Cc1ccc(c(c1)CC#N)O 271570a_203496583355_100010147026 [0,1,0,0,0,0|1,0,1]=3 2935 B11R1.182 Cc1ccc(c(c1)CN[13CH3])C 34a_100000174964_200025704644 [0,1,0,0,0,0|2,0,1]=4 2936 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 2230a_100025705715_200025704644 [0,1,0,0,0,0|2,0,1]=4 2937 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 34a_100025705715_200025704644 [0,1,0,0,0,0|2,0,1]=4 2938 B11R1.182 Cc1ccc(c(c1)CN[13CH3])F 34a_100102693586_200025704644 [0,1,0,0,0,0|2,0,1]=4 2939 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 34a_100012361352_200025704644 [0,1,0,0,0,0|2,0,1]=4 2940 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 7a_100012361352_200025704644 [0,1,0,0,0,0|2,0,1]=4 2941 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 34a_200011215349_200025704644 [0,1,0,0,0,0|2,0,1]=4 2942 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 7a_200011215349_200025704644 [0,1,0,0,0,0|2,0,1]=4 2943 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 34a_100009878994_200025704644 [0,1,0,0,0,0|2,0,1]=4 2944 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 7a_100009878994_200025704644 [0,1,0,0,0,0|2,0,1]=4 2945 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 34a_100011692775_200025704644 [0,1,0,0,0,0|2,0,1]=4 2946 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 7a_100011692775_200025704644 [0,1,0,0,0,0|2,0,1]=4 2947 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 34a_100011215565_200025704644 [0,1,0,0,0,0|2,0,1]=4 2948 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 7a_100011215565_200025704644 [0,1,0,0,0,0|2,0,1]=4 2949 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_100000184699_200025704644 [0,1,0,0,0,0|2,0,1]=4 2950 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_200025704644_100000184699 [0,1,0,0,0,0|2,0,1]=4 2951 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_100009871730_200025704644 [0,1,0,0,0,0|2,0,1]=4 2952 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100009871730 [0,1,0,0,0,0|2,0,1]=4 2953 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_100011260760_200025704644 [0,1,0,0,0,0|2,0,1]=4 2954 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_200025704644_100011260760 [0,1,0,0,0,0|2,0,1]=4 2955 B11R1.182 Cc1ccc(c(c1)NCF)O 34a_100011215204_100015361967 [0,1,0,0,0,0|2,0,1]=4 2956 B11R1.182 Cc1ccc(c(c1)SCF)O 62a_100000765521_100015361967 [0,1,0,0,0,0|2,0,1]=4 2957 B11R1.182 Cc1ccc(c(c1)SCF)O 62a_100015361967_100000765521 [0,1,0,0,0,0|2,0,1]=4 2958 B11R1.182 Cc1ccc(c(n1)CS[13CH3])O 62a_100020630696_200025704644 [0,1,0,0,0,0|2,0,1]=4 2959 B11R1.182 Cc1ccc(c(n1)CS[13CH3])O 62a_200025704644_100020630696 [0,1,0,0,0,0|2,0,1]=4 2960 B11R1.182 Cc1ccc(cc1CC#N)O 271570a_203496583355_100010147029 [0,1,0,0,0,0|2,0,1]=4 2961 B11R1.182 Cc1ccc(cc1CN[13CH3])Cl 34a_100000717755_200025704644 [0,1,0,0,0,0|2,0,1]=4 2962 B11R1.182 Cc1ccc(cc1CN[13CH3])F 34a_100011217291_200025704644 [0,1,0,0,0,0|2,0,1]=4 2963 B11R1.182 Cc1ccc(cc1CN[13CH3])O 34a_200009844824_200025704644 [0,1,0,0,0,0|2,0,1]=4 2964 B11R1.182 Cc1ccc(cc1CO[13CH3])Br 34a_100000700630_200025704644 [0,1,0,0,0,0|2,0,1]=4 2965 B11R1.182 Cc1ccc(cc1CO[13CH3])Br 7a_100000700630_200025704644 [0,1,0,0,0,0|2,0,1]=4 2966 B11R1.182 Cc1ccc(cc1CO[13CH3])Cl 34a_100012002407_200025704644 [0,1,0,0,0,0|2,0,1]=4 2967 B11R1.182 Cc1ccc(cc1CO[13CH3])Cl 7a_100012002407_200025704644 [0,1,0,0,0,0|2,0,1]=4 2968 B11R1.182 Cc1ccc(cc1CO[13CH3])F 34a_100011219218_200025704644 [0,1,0,0,0,0|2,0,1]=4 2969 B11R1.182 Cc1ccc(cc1CO[13CH3])F 7a_100011219218_200025704644 [0,1,0,0,0,0|2,0,1]=4 2970 B11R1.182 Cc1ccc(cc1CO[13CH3])I 34a_100010150140_200025704644 [0,1,0,0,0,0|2,0,1]=4 2971 B11R1.182 Cc1ccc(cc1CO[13CH3])I 7a_100010150140_200025704644 [0,1,0,0,0,0|2,0,1]=4 2972 B11R1.182 Cc1ccc(cc1CS[13CH3])Cl 62a_100012186985_200025704644 [0,1,0,0,0,0|2,0,1]=4 2973 B11R1.182 Cc1ccc(cc1CS[13CH3])Cl 62a_200025704644_100012186985 [0,1,0,0,0,0|2,0,1]=4 2974 B11R1.182 Cc1ccc(cc1CS[13CH3])F 62a_100000709795_200025704644 [0,1,0,0,0,0|2,0,1]=4 2975 B11R1.182 Cc1ccc(cc1CS[13CH3])F 62a_200025704644_100000709795 [0,1,0,0,0,0|2,0,1]=4 2976 B11R1.182 N#CCc1cc(ccc1Br)O 271570a_203496583355_100010146707 [0,1,0,0,0,0|2,0,1]=4 2977 B11R1.182 N#CCc1cc(ccc1F)O 271570a_203496583355_100000739769 [0,1,0,0,0,0|2,0,1]=4 2978 B11R1.182 N#CCc1cc(ccc1N)O 271570a_203496583355_100010188562 [0,1,0,0,0,0|2,0,1]=4 2979 B11R1.182 N#CCc1cc(ccc1O)F 271570a_203496583355_100011206898 [0,1,0,0,0,0|1,0,1]=3 2980 B11R1.182 Nc1ccc(c(c1)SCF)O 62a_100011534360_100015361967 [0,1,0,0,0,0|2,0,1]=4 2981 B11R1.182 Nc1ccc(c(c1)SCF)O 62a_100015361967_100011534360 [0,1,0,0,0,0|2,0,1]=4 2982 B11R1.182 Oc1ccc(c(c1)SCF)O 62a_100015361967_100009813629 [0,1,0,0,0,0|2,0,1]=4 2983 B11R1.182 Oc1ccc(cc1NCF)Br 34a_100000752626_100015361967 [0,1,0,0,0,0|2,0,1]=4 2984 B11R1.182 Oc1ccc(cc1NCF)Cl 34a_100000210500_100015361967 [0,1,0,0,0,0|2,0,1]=4 2985 B11R1.182 Oc1ccc(cc1NCF)F 34a_100000759472_100015361967 [0,1,0,0,0,0|2,0,1]=4 2986 B11R1.182 Oc1ccc(cc1SCF)Br 62a_100012355227_100015361967 [0,1,0,0,0,0|2,0,1]=4 2987 B11R1.182 Oc1ccc(cc1SCF)Br 62a_100015361967_100012355227 [0,1,0,0,0,0|2,0,1]=4 2988 B11R1.182 Oc1ccc(cc1SCF)Cl 62a_100011356953_100015361967 [0,1,0,0,0,0|2,0,1]=4 2989 B11R1.182 Oc1ccc(cc1SCF)Cl 62a_100015361967_100011356953 [0,1,0,0,0,0|2,0,1]=4 2990 B11R1.182 Oc1ccc(cc1SCF)F 62a_100000211999_100015361967 [0,1,0,0,0,0|2,0,1]=4 2991 B11R1.182 Oc1ccc(cc1SCF)F 62a_100015361967_100000211999 [0,1,0,0,0,0|2,0,1]=4 2992 B11R1.182 [13CH3]NCc1cc(ccc1Br)Br 34a_100000707832_200025704644 [0,1,0,0,0,0|2,0,1]=4 2993 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 2230a_100000742738_200025704644 [0,1,0,0,0,0|2,0,1]=4 2994 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 34a_100000742738_200025704644 [0,1,0,0,0,0|2,0,1]=4 2995 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Br 34a_100025772652_200025704644 [0,1,0,0,0,0|2,0,1]=4 2996 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Cl 34a_100102946428_200025704644 [0,1,0,0,0,0|2,0,1]=4 2997 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 2230a_100011830483_200025704644 [0,1,0,0,0,0|2,0,1]=4 2998 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 34a_100011830483_200025704644 [0,1,0,0,0,0|2,0,1]=4 2999 B11R1.182 [13CH3]NCc1cc(ccc1F)Br 34a_100009815772_200025704644 [0,1,0,0,0,0|2,0,1]=4 3000 B11R1.182 [13CH3]NCc1cc(ccc1F)Cl 34a_100011211646_200025704644 [0,1,0,0,0,0|2,0,1]=4 3001 B11R1.182 [13CH3]NCc1cc(ccc1F)F 34a_100000752317_200025704644 [0,1,0,0,0,0|2,0,1]=4 3002 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [0,1,0,0,0,0|1,0,1]=3 3003 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [0,1,0,0,0,0|1,0,1]=3 3004 B11R1.182 [13CH3]OCc1cc(ccc1Br)Br 34a_100011266457_200025704644 [0,1,0,0,0,0|2,0,1]=4 3005 B11R1.182 [13CH3]OCc1cc(ccc1Br)Br 7a_100011266457_200025704644 [0,1,0,0,0,0|2,0,1]=4 3006 B11R1.182 [13CH3]OCc1cc(ccc1Br)Cl 34a_100012355668_200025704644 [0,1,0,0,0,0|2,0,1]=4 3007 B11R1.182 [13CH3]OCc1cc(ccc1Br)Cl 7a_100012355668_200025704644 [0,1,0,0,0,0|2,0,1]=4 3008 B11R1.182 [13CH3]OCc1cc(ccc1Br)F 34a_100011217561_200025704644 [0,1,0,0,0,0|2,0,1]=4 3009 B11R1.182 [13CH3]OCc1cc(ccc1Br)F 7a_100011217561_200025704644 [0,1,0,0,0,0|2,0,1]=4 3010 B11R1.182 [13CH3]OCc1cc(ccc1Br)I 7a_100012359683_200025704644 [0,1,0,0,0,0|2,0,1]=4 3011 B11R1.182 [13CH3]OCc1cc(ccc1Br)N 34a_100012347228_200025704644 [0,1,0,0,0,0|2,0,1]=4 3012 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Br 34a_100011215897_200025704644 [0,1,0,0,0,0|2,0,1]=4 3013 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Br 7a_100011215897_200025704644 [0,1,0,0,0,0|2,0,1]=4 3014 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Cl 34a_100000698905_200025704644 [0,1,0,0,0,0|2,0,1]=4 3015 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Cl 7a_100000698905_200025704644 [0,1,0,0,0,0|2,0,1]=4 3016 B11R1.182 [13CH3]OCc1cc(ccc1Cl)F 34a_100011218361_200025704644 [0,1,0,0,0,0|2,0,1]=4 3017 B11R1.182 [13CH3]OCc1cc(ccc1Cl)F 7a_100011218361_200025704644 [0,1,0,0,0,0|2,0,1]=4 3018 B11R1.182 [13CH3]OCc1cc(ccc1Cl)I 34a_100010128486_200025704644 [0,1,0,0,0,0|2,0,1]=4 3019 B11R1.182 [13CH3]OCc1cc(ccc1Cl)I 7a_100010128486_200025704644 [0,1,0,0,0,0|2,0,1]=4 3020 B11R1.182 [13CH3]OCc1cc(ccc1Cl)N 34a_100011273577_200025704644 [0,1,0,0,0,0|2,0,1]=4 3021 B11R1.182 [13CH3]OCc1cc(ccc1F)Br 34a_100000246282_200025704644 [0,1,0,0,0,0|2,0,1]=4 3022 B11R1.182 [13CH3]OCc1cc(ccc1F)Br 7a_100000246282_200025704644 [0,1,0,0,0,0|2,0,1]=4 3023 B11R1.182 [13CH3]OCc1cc(ccc1F)Cl 34a_100011217248_200025704644 [0,1,0,0,0,0|2,0,1]=4 3024 B11R1.182 [13CH3]OCc1cc(ccc1F)Cl 7a_100011217248_200025704644 [0,1,0,0,0,0|2,0,1]=4 3025 B11R1.182 [13CH3]OCc1cc(ccc1F)F 34a_100011217725_200025704644 [0,1,0,0,0,0|2,0,1]=4 3026 B11R1.182 [13CH3]OCc1cc(ccc1F)F 7a_100011217725_200025704644 [0,1,0,0,0,0|2,0,1]=4 3027 B11R1.182 [13CH3]OCc1cc(ccc1F)I 34a_100000049604_200025704644 [0,1,0,0,0,0|2,0,1]=4 3028 B11R1.182 [13CH3]OCc1cc(ccc1F)I 7a_100000049604_200025704644 [0,1,0,0,0,0|2,0,1]=4 3029 B11R1.182 [13CH3]OCc1cc(ccc1F)N 34a_100011218011_200025704644 [0,1,0,0,0,0|2,0,1]=4 3030 B11R1.182 [13CH3]OCc1cc(ccc1I)Br 34a_100011356890_200025704644 [0,1,0,0,0,0|2,0,1]=4 3031 B11R1.182 [13CH3]OCc1cc(ccc1I)Br 7a_100011356890_200025704644 [0,1,0,0,0,0|2,0,1]=4 3032 B11R1.182 [13CH3]OCc1cc(ccc1I)F 34a_100010255287_200025704644 [0,1,0,0,0,0|2,0,1]=4 3033 B11R1.182 [13CH3]OCc1cc(ccc1I)F 7a_100010255287_200025704644 [0,1,0,0,0,0|2,0,1]=4 3034 B11R1.182 [13CH3]OCc1cc(ccc1N)Br 34a_100012353972_200025704644 [0,1,0,0,0,0|2,0,1]=4 3035 B11R1.182 [13CH3]OCc1cc(ccc1N)Br 7a_100012353972_200025704644 [0,1,0,0,0,0|2,0,1]=4 3036 B11R1.182 [13CH3]OCc1cc(ccc1N)Cl 34a_100011214999_200025704644 [0,1,0,0,0,0|2,0,1]=4 3037 B11R1.182 [13CH3]OCc1cc(ccc1N)Cl 7a_100011214999_200025704644 [0,1,0,0,0,0|2,0,1]=4 3038 B11R1.182 [13CH3]OCc1cc(ccc1N)F 34a_100011296978_200025704644 [0,1,0,0,0,0|2,0,1]=4 3039 B11R1.182 [13CH3]OCc1cc(ccc1N)F 7a_100011296978_200025704644 [0,1,0,0,0,0|2,0,1]=4 3040 B11R1.182 [13CH3]SCc1cc(ccc1Br)Br 62a_100011982794_200025704644 [0,1,0,0,0,0|2,0,1]=4 3041 B11R1.182 [13CH3]SCc1cc(ccc1Br)Br 62a_200025704644_100011982794 [0,1,0,0,0,0|2,0,1]=4 3042 B11R1.182 [13CH3]SCc1cc(ccc1Br)Cl 62a_100000733903_200025704644 [0,1,0,0,0,0|2,0,1]=4 3043 B11R1.182 [13CH3]SCc1cc(ccc1Br)Cl 62a_200025704644_100000733903 [0,1,0,0,0,0|2,0,1]=4 3044 B11R1.182 [13CH3]SCc1cc(ccc1Br)F 62a_100000736370_200025704644 [0,1,0,0,0,0|2,0,1]=4 3045 B11R1.182 [13CH3]SCc1cc(ccc1Br)F 62a_200025704644_100000736370 [0,1,0,0,0,0|2,0,1]=4 3046 B11R1.182 [13CH3]SCc1cc(ccc1Br)I 62a_100012355412_200025704644 [0,1,0,0,0,0|2,0,1]=4 3047 B11R1.182 [13CH3]SCc1cc(ccc1Br)I 62a_200025704644_100012355412 [0,1,0,0,0,0|2,0,1]=4 3048 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Br 62a_100000763347_200025704644 [0,1,0,0,0,0|2,0,1]=4 3049 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Br 62a_200025704644_100000763347 [0,1,0,0,0,0|2,0,1]=4 3050 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Cl 62a_100000756322_200025704644 [0,1,0,0,0,0|2,0,1]=4 3051 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Cl 62a_200025704644_100000756322 [0,1,0,0,0,0|2,0,1]=4 3052 B11R1.182 [13CH3]SCc1cc(ccc1Cl)F 62a_100000709952_200025704644 [0,1,0,0,0,0|2,0,1]=4 3053 B11R1.182 [13CH3]SCc1cc(ccc1Cl)F 62a_200025704644_100000709952 [0,1,0,0,0,0|2,0,1]=4 3054 B11R1.182 [13CH3]SCc1cc(ccc1Cl)I 62a_100010188191_200025704644 [0,1,0,0,0,0|2,0,1]=4 3055 B11R1.182 [13CH3]SCc1cc(ccc1Cl)I 62a_200025704644_100010188191 [0,1,0,0,0,0|2,0,1]=4 3056 B11R1.182 [13CH3]SCc1cc(ccc1F)Br 62a_100000736399_200025704644 [0,1,0,0,0,0|2,0,1]=4 3057 B11R1.182 [13CH3]SCc1cc(ccc1F)Br 62a_200025704644_100000736399 [0,1,0,0,0,0|2,0,1]=4 3058 B11R1.182 [13CH3]SCc1cc(ccc1F)Cl 62a_100000716957_200025704644 [0,1,0,0,0,0|2,0,1]=4 3059 B11R1.182 [13CH3]SCc1cc(ccc1F)Cl 62a_200025704644_100000716957 [0,1,0,0,0,0|2,0,1]=4 3060 B11R1.182 [13CH3]SCc1cc(ccc1F)F 62a_100000685659_200025704644 [0,1,0,0,0,0|2,0,1]=4 3061 B11R1.182 [13CH3]SCc1cc(ccc1F)F 62a_200025704644_100000685659 [0,1,0,0,0,0|2,0,1]=4 3062 B11R1.182 [13CH3]SCc1cc(ccc1F)I 62a_200010149601_200025704644 [0,1,0,0,0,0|2,0,1]=4 3063 B11R1.182 [13CH3]SCc1cc(ccc1F)I 62a_200025704644_200010149601 [0,1,0,0,0,0|2,0,1]=4 3064 B11R1.182 [13CH3]SCc1cc(ccc1I)Br 62a_100012362523_200025704644 [0,1,0,0,0,0|2,0,1]=4 3065 B11R1.182 [13CH3]SCc1cc(ccc1I)Br 62a_200025704644_100012362523 [0,1,0,0,0,0|2,0,1]=4 3066 B11R1.182 [13CH3]SCc1cc(ccc1I)Cl 62a_100012348826_200025704644 [0,1,0,0,0,0|2,0,1]=4 3067 B11R1.182 [13CH3]SCc1cc(ccc1I)Cl 62a_200025704644_100012348826 [0,1,0,0,0,0|2,0,1]=4 3068 B11R1.182 [13CH3]SCc1cc(ccc1I)F 62a_100010149606_200025704644 [0,1,0,0,0,0|2,0,1]=4 3069 B11R1.182 [13CH3]SCc1cc(ccc1I)F 62a_200025704644_100010149606 [0,1,0,0,0,0|2,0,1]=4 3070 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_100010161318_200025704644 [0,1,0,0,0,0|1,0,1]=3 3071 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_200025704644_100010161318 [0,1,0,0,0,0|1,0,1]=3 3072 B11R1.222 CC(C#N)c1ccccc1O 271570a_203496583355_200010232107 [0,1,0,0,0,0|1,0,1]=3 3073 B11R1.222 CC(N[13CH3])c1ccccc1Br 2230a_100000181357_200025704644 [0,1,0,0,0,0|2,0,1]=4 3074 B11R1.222 CC(N[13CH3])c1ccccc1Cl 2230a_100000174978_200025704644 [0,1,0,0,0,0|2,0,1]=4 3075 B11R1.222 CC(N[13CH3])c1ccccc1Cl 34a_100000174978_200025704644 [0,1,0,0,0,0|2,0,1]=4 3076 B11R1.222 CC(N[13CH3])c1ccccc1F 2230a_100000181408_200025704644 [0,1,0,0,0,0|2,0,1]=4 3077 B11R1.222 CC(N[13CH3])c1ccccc1F 34a_100000181408_200025704644 [0,1,0,0,0,0|2,0,1]=4 3078 B11R1.222 CC(N[13CH3])c1cccnc1O 2230a_100159269580_200025704644 [0,1,0,0,0,0|2,0,1]=4 3079 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [0,1,0,0,0,0|2,0,1]=4 3080 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [0,1,0,0,0,0|2,0,1]=4 3081 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [0,1,0,0,0,0|2,0,1]=4 3082 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [0,1,0,0,0,0|2,0,1]=4 3083 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [0,1,0,0,0,0|2,0,1]=4 3084 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [0,1,0,0,0,0|2,0,1]=4 3085 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [0,1,0,0,0,0|2,0,1]=4 3086 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_100000181259_200025704644 [0,1,0,0,0,0|2,0,1]=4 3087 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_200025704644_100000181259 [0,1,0,0,0,0|2,0,1]=4 3088 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200000741388_200025704644 [0,1,0,0,0,0|2,0,1]=4 3089 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200025704644_200000741388 [0,1,0,0,0,0|2,0,1]=4 3090 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [0,1,0,0,0,0|0,0,3]=4 3091 B11R1.222 CCN(C)c1ccccc1O 269982a_100000033821_100000204670 [0,1,0,0,0,0|1,0,2]=4 3092 B11R1.222 CCN(C)c1ccccc1O 269982a_103624766699_200000210301 [0,1,0,0,0,0|1,0,2]=4 3093 B11R1.222 CCN([13CH3])c1ccccc1O 269982a_103624766699_200025704644 [0,1,0,0,0,0|1,0,2]=4 3094 B11R1.222 CN(CF)c1ccccc1O 269982a_100000033821_100015361967 [0,1,0,0,0,0|2,0,1]=4 3095 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [0,1,0,0,0,0|1,0,2]=4 3096 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [0,1,0,0,0,0|1,0,2]=4 3097 B11R1.222 CNC(C)c1ccccc1Br 2230a_100000181357_200000210301 [0,1,0,0,0,0|2,0,1]=4 3098 B11R1.222 CNC(C)c1ccccc1Br 269862a_106832991636_100000187085 [0,1,0,0,0,0|2,0,1]=4 3099 B11R1.222 CNC(C)c1ccccc1C 2230a_100000181355_200000210301 [0,1,0,0,0,0|2,0,1]=4 3100 B11R1.222 CNC(C)c1ccccc1C 269862a_106832991636_100000211656 [0,1,0,0,0,0|2,0,1]=4 3101 B11R1.222 CNC(C)c1ccccc1C 34a_100000181355_200000210301 [0,1,0,0,0,0|2,0,1]=4 3102 B11R1.222 CNC(C)c1ccccc1Cl 2230a_100000174978_200000210301 [0,1,0,0,0,0|2,0,1]=4 3103 B11R1.222 CNC(C)c1ccccc1Cl 2230a_106832991635_100000181259 [0,1,0,0,0,0|2,0,1]=4 3104 B11R1.222 CNC(C)c1ccccc1Cl 269862a_106832991636_100000210134 [0,1,0,0,0,0|2,0,1]=4 3105 B11R1.222 CNC(C)c1ccccc1Cl 34a_100000174978_200000210301 [0,1,0,0,0,0|2,0,1]=4 3106 B11R1.222 CNC(C)c1ccccc1Cl 7a_106832991635_100000181259 [0,1,0,0,0,0|2,0,1]=4 3107 B11R1.222 CNC(C)c1ccccc1F 2230a_100000181408_200000210301 [0,1,0,0,0,0|2,0,1]=4 3108 B11R1.222 CNC(C)c1ccccc1F 2230a_106832991635_200000741388 [0,1,0,0,0,0|2,0,1]=4 3109 B11R1.222 CNC(C)c1ccccc1F 269862a_106832991636_100000210632 [0,1,0,0,0,0|2,0,1]=4 3110 B11R1.222 CNC(C)c1ccccc1F 34a_100000181408_200000210301 [0,1,0,0,0,0|2,0,1]=4 3111 B11R1.222 CNC(C)c1ccccc1F 34a_100102657272_200000741388 [0,1,0,0,0,0|2,0,1]=4 3112 B11R1.222 CNC(C)c1ccccc1F 7a_106832991635_200000741388 [0,1,0,0,0,0|2,0,1]=4 3113 B11R1.222 CNC(C)c1ccccc1I 269862a_106832991636_100000751169 [0,1,0,0,0,0|2,0,1]=4 3114 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [0,1,0,0,0,0|1,0,1]=3 3115 B11R1.222 CNC(C)c1cccnc1O 2230a_100159269580_200000210301 [0,1,0,0,0,0|2,0,1]=4 3116 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [0,1,0,0,0,0|1,0,1]=3 3117 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [0,1,0,0,0,0|1,0,2]=4 3118 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [0,1,0,0,0,0|2,0,1]=4 3119 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [0,1,0,0,0,0|2,0,1]=4 3120 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [0,1,0,0,0,0|2,0,1]=4 3121 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [0,1,0,0,0,0|2,0,1]=4 3122 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [0,1,0,0,0,0|2,0,1]=4 3123 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [0,1,0,0,0,0|2,0,1]=4 3124 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [0,1,0,0,0,0|2,0,1]=4 3125 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [0,1,0,0,0,0|2,0,1]=4 3126 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [0,1,0,0,0,0|2,0,1]=4 3127 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [0,1,0,0,0,0|2,0,1]=4 3128 B11R1.222 CO[C@@H](C)c1ncccc1O 271570a_203496583355_106256553109 [0,1,0,0,0,0|2,0,1]=4 3129 B11R1.222 CSC(C)c1ccccc1Cl 62a_100000181259_200000210301 [0,1,0,0,0,0|2,0,1]=4 3130 B11R1.222 CSC(C)c1ccccc1Cl 62a_200000210301_100000181259 [0,1,0,0,0,0|2,0,1]=4 3131 B11R1.222 CSC(C)c1ccccc1F 62a_200000210301_200000741388 [0,1,0,0,0,0|2,0,1]=4 3132 B11R1.222 CSC(C)c1ccccc1F 62a_200000741388_200000210301 [0,1,0,0,0,0|2,0,1]=4 3133 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [0,1,0,0,0,0|1,0,1]=3 3134 B11R1.222 Cc1ccccc1C(C)N[13CH3] 2230a_100000181355_200025704644 [0,1,0,0,0,0|2,0,1]=4 3135 B11R1.222 Cc1ccccc1C(C)N[13CH3] 34a_100000181355_200025704644 [0,1,0,0,0,0|2,0,1]=4 3136 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [0,1,0,0,0,0|2,0,1]=4 3137 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [0,1,0,0,0,0|2,0,1]=4 3138 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [0,1,0,0,0,0|1,0,1]=3 3139 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [0,1,0,0,0,0|2,0,1]=4 3140 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [0,1,0,0,0,0|1,0,1]=3 3141 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [0,1,0,0,0,0|1,0,2]=4 3142 B11R1.605 C=C=Cc1c(cccc1Br)Br 271570a_100015277604_100009994525 [0,1,0,0,0,0|1,0,2]=4 3143 B11R1.605 C=C=Cc1c(cccc1Br)Cl 271570a_100015277604_100010214488 [0,1,0,0,0,0|1,0,2]=4 3144 B11R1.605 C=C=Cc1c(cccc1Br)F 271570a_100015277604_100011219512 [0,1,0,0,0,0|1,0,2]=4 3145 B11R1.605 C=C=Cc1c(cccc1Br)N 271570a_100015277604_100020590159 [0,1,0,0,0,0|1,0,2]=4 3146 B11R1.605 C=C=Cc1c(cccc1Br)O 271570a_100015277604_100010187912 [0,1,0,0,0,0|0,0,2]=3 3147 B11R1.605 C=C=Cc1c(cccc1C)C 271570a_100015277604_100000033847 [0,1,0,0,0,0|1,0,2]=4 3148 B11R1.605 C=C=Cc1c(cccc1Cl)C 271570a_100015277604_100000043165 [0,1,0,0,0,0|1,0,2]=4 3149 B11R1.605 C=C=Cc1c(cccc1Cl)Cl 271570a_100015277604_100000034237 [0,1,0,0,0,0|1,0,2]=4 3150 B11R1.605 C=C=Cc1c(cccc1Cl)F 271570a_100015277604_100000050007 [0,1,0,0,0,0|1,0,2]=4 3151 B11R1.605 C=C=Cc1c(cccc1Cl)N 271570a_100015277604_100000049713 [0,1,0,0,0,0|1,0,2]=4 3152 B11R1.605 C=C=Cc1c(cccc1Cl)O 271570a_100015277604_100000050174 [0,1,0,0,0,0|0,0,2]=3 3153 B11R1.605 C=C=Cc1c(cccc1F)C 271570a_100015277604_100012349962 [0,1,0,0,0,0|1,0,2]=4 3154 B11R1.605 C=C=Cc1c(cccc1F)F 271570a_100015277604_100000693133 [0,1,0,0,0,0|1,0,2]=4 3155 B11R1.605 C=C=Cc1c(cccc1F)N 271570a_100015277604_100011934729 [0,1,0,0,0,0|1,0,2]=4 3156 B11R1.605 C=C=Cc1c(cccc1F)O 271570a_100015277604_100009820682 [0,1,0,0,0,0|0,0,2]=3 3157 B11R1.605 C=C=Cc1c(cccc1N)C 271570a_100015277604_100000684715 [0,1,0,0,0,0|1,0,2]=4 3158 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [0,1,0,0,0,0|0,0,2]=3 3159 B11R1.605 C=C=Cc1c(cccc1O)N 271570a_100015277604_100012183704 [0,1,0,0,0,0|0,0,2]=3 3160 B11R1.605 C=C=Cc1c(cccc1O)O 271570a_100015277604_100010205330 [0,1,0,0,0,0|0,0,2]=3 3161 B11R1.605 C=C=Cc1c(ccnc1O)C 271570a_100015277604_100012000493 [0,1,0,0,0,0|1,0,2]=4 3162 B11R1.605 C=C=Cc1c(ccnc1O)O 271570a_100015277604_200009817435 [0,1,0,0,0,0|1,0,2]=4 3163 B11R1.605 C=CCc1c(ccnc1F)O 271570a_203496583355_200010238768 [0,1,0,0,0,0|1,0,0]=2 3164 B11R1.605 CC=Cc1c(cccc1Br)Br 271570a_100016259895_100009994525 [0,1,0,0,0,0|1,0,2]=4 3165 B11R1.605 CC=Cc1c(cccc1Br)Cl 271570a_100016259895_100010214488 [0,1,0,0,0,0|1,0,2]=4 3166 B11R1.605 CC=Cc1c(cccc1Br)F 271570a_100016259895_100011219512 [0,1,0,0,0,0|1,0,2]=4 3167 B11R1.605 CC=Cc1c(cccc1Br)N 271570a_100016259895_100020590159 [0,1,0,0,0,0|1,0,2]=4 3168 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [0,1,0,0,0,0|0,0,2]=3 3169 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [0,1,0,0,0,0|1,0,2]=4 3170 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [0,1,0,0,0,0|1,0,2]=4 3171 B11R1.605 CC=Cc1c(cccc1Cl)Cl 271570a_100016259895_100000034237 [0,1,0,0,0,0|1,0,2]=4 3172 B11R1.605 CC=Cc1c(cccc1Cl)F 271570a_100016259895_100000050007 [0,1,0,0,0,0|1,0,2]=4 3173 B11R1.605 CC=Cc1c(cccc1Cl)N 271570a_100016259895_100000049713 [0,1,0,0,0,0|1,0,2]=4 3174 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [0,1,0,0,0,0|0,0,2]=3 3175 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [0,1,0,0,0,0|1,0,2]=4 3176 B11R1.605 CC=Cc1c(cccc1F)F 271570a_100016259895_100000693133 [0,1,0,0,0,0|1,0,2]=4 3177 B11R1.605 CC=Cc1c(cccc1F)N 271570a_100016259895_100011934729 [0,1,0,0,0,0|1,0,2]=4 3178 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [0,1,0,0,0,0|0,0,2]=3 3179 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [0,1,0,0,0,0|1,0,2]=4 3180 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [0,1,0,0,0,0|0,0,2]=3 3181 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [0,1,0,0,0,0|0,0,2]=3 3182 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [0,1,0,0,0,0|0,0,2]=3 3183 B11R1.605 CC=Cc1c(ccnc1O)C 271570a_100016259895_100012000493 [0,1,0,0,0,0|1,0,2]=4 3184 B11R1.605 CC=Cc1c(ccnc1O)O 271570a_100016259895_200009817435 [0,1,0,0,0,0|1,0,2]=4 3185 B11R1.605 CCNc1c(cccc1Br)O 34a_100011934926_100000210202 [0,1,0,0,0,0|1,0,2]=4 3186 B11R1.605 CCNc1c(cccc1Cl)O 34a_100012022510_100000210202 [0,1,0,0,0,0|1,0,2]=4 3187 B11R1.605 CCNc1c(cccc1F)O 34a_100020591140_100000210202 [0,1,0,0,0,0|1,0,2]=4 3188 B11R1.605 CCNc1c(cccc1O)C 34a_100000743429_100000210202 [0,1,0,0,0,0|1,0,2]=4 3189 B11R1.605 CCOc1c(cccc1F)O 271570a_203496583355_100010232518 [0,1,0,0,0,0|1,0,2]=4 3190 B11R1.605 CCSc1c(cccc1Br)O 62a_100000210202_100010187912 [0,1,0,0,0,0|1,0,2]=4 3191 B11R1.605 CCSc1c(cccc1Br)O 62a_100010187912_100000210202 [0,1,0,0,0,0|1,0,2]=4 3192 B11R1.605 CCSc1c(cccc1Cl)O 62a_100000210202_100000050174 [0,1,0,0,0,0|1,0,2]=4 3193 B11R1.605 CCSc1c(cccc1F)O 62a_100000210202_100009820682 [0,1,0,0,0,0|1,0,2]=4 3194 B11R1.605 CCSc1c(cccc1F)O 62a_100009820682_100000210202 [0,1,0,0,0,0|1,0,2]=4 3195 B11R1.605 CCSc1c(cccc1O)C 62a_100000210202_100000686692 [0,1,0,0,0,0|1,0,2]=4 3196 B11R1.605 CCSc1c(cccc1O)C 62a_100000686692_100000210202 [0,1,0,0,0,0|1,0,2]=4 3197 B11R1.605 CCSc1c(cccc1O)N 62a_100000210202_100012183704 [0,1,0,0,0,0|1,0,2]=4 3198 B11R1.605 CCSc1c(cccc1O)N 62a_100012183704_100000210202 [0,1,0,0,0,0|1,0,2]=4 3199 B11R1.605 CCSc1c(cccc1O)O 62a_100000210202_100010205330 [0,1,0,0,0,0|1,0,2]=4 3200 B11R1.605 CNCc1c(cccc1Br)Br 207a_100102657272_100010233043 [0,1,0,0,0,0|2,0,1]=4 3201 B11R1.605 CNCc1c(cccc1Br)Br 26a_100102657272_100000736428 [0,1,0,0,0,0|2,0,1]=4 3202 B11R1.605 CNCc1c(cccc1Br)Br 270004a_106832991635_100010233043 [0,1,0,0,0,0|2,0,1]=4 3203 B11R1.605 CNCc1c(cccc1Br)C 207a_100102657272_100009881667 [0,1,0,0,0,0|2,0,1]=4 3204 B11R1.605 CNCc1c(cccc1Br)C 2230a_106832991635_100010146847 [0,1,0,0,0,0|2,0,1]=4 3205 B11R1.605 CNCc1c(cccc1Br)C 26a_100102657272_100009817157 [0,1,0,0,0,0|2,0,1]=4 3206 B11R1.605 CNCc1c(cccc1Br)C 270004a_106832991635_100009881667 [0,1,0,0,0,0|2,0,1]=4 3207 B11R1.605 CNCc1c(cccc1Br)C 34a_100102657272_100010146847 [0,1,0,0,0,0|2,0,1]=4 3208 B11R1.605 CNCc1c(cccc1Br)C 7a_106832991635_100010146847 [0,1,0,0,0,0|2,0,1]=4 3209 B11R1.605 CNCc1c(cccc1Br)Cl 207a_100102657272_100011249081 [0,1,0,0,0,0|2,0,1]=4 3210 B11R1.605 CNCc1c(cccc1Br)Cl 2230a_106832991635_100010138402 [0,1,0,0,0,0|2,0,1]=4 3211 B11R1.605 CNCc1c(cccc1Br)Cl 26a_100102657272_100010214474 [0,1,0,0,0,0|2,0,1]=4 3212 B11R1.605 CNCc1c(cccc1Br)Cl 270004a_106832991635_100011249081 [0,1,0,0,0,0|2,0,1]=4 3213 B11R1.605 CNCc1c(cccc1Br)Cl 34a_100102657272_100010138402 [0,1,0,0,0,0|2,0,1]=4 3214 B11R1.605 CNCc1c(cccc1Br)Cl 7a_106832991635_100010138402 [0,1,0,0,0,0|2,0,1]=4 3215 B11R1.605 CNCc1c(cccc1Br)F 207a_100102657272_100000752695 [0,1,0,0,0,0|2,0,1]=4 3216 B11R1.605 CNCc1c(cccc1Br)F 2230a_106832991635_100012145669 [0,1,0,0,0,0|2,0,1]=4 3217 B11R1.605 CNCc1c(cccc1Br)F 26a_100102657272_100009813666 [0,1,0,0,0,0|2,0,1]=4 3218 B11R1.605 CNCc1c(cccc1Br)F 270004a_106832991635_100000752695 [0,1,0,0,0,0|2,0,1]=4 3219 B11R1.605 CNCc1c(cccc1Br)F 34a_100012349121_200000210301 [0,1,0,0,0,0|2,0,1]=4 3220 B11R1.605 CNCc1c(cccc1Br)F 34a_100102657272_100012145669 [0,1,0,0,0,0|2,0,1]=4 3221 B11R1.605 CNCc1c(cccc1Br)F 7a_106832991635_100000696636 [0,1,0,0,0,0|2,0,1]=4 3222 B11R1.605 CNCc1c(cccc1C)C 207a_100102657272_100000758299 [0,1,0,0,0,0|2,0,1]=4 3223 B11R1.605 CNCc1c(cccc1C)C 2230a_106832991635_100000758300 [0,1,0,0,0,0|2,0,1]=4 3224 B11R1.605 CNCc1c(cccc1C)C 270004a_106832991635_100000758299 [0,1,0,0,0,0|2,0,1]=4 3225 B11R1.605 CNCc1c(cccc1C)C 34a_100000689800_200000210301 [0,1,0,0,0,0|2,0,1]=4 3226 B11R1.605 CNCc1c(cccc1C)C 34a_100102657272_100000758300 [0,1,0,0,0,0|2,0,1]=4 3227 B11R1.605 CNCc1c(cccc1C)C 7a_106832991635_100000758300 [0,1,0,0,0,0|2,0,1]=4 3228 B11R1.605 CNCc1c(cccc1Cl)C 207a_100102657272_100000041122 [0,1,0,0,0,0|2,0,1]=4 3229 B11R1.605 CNCc1c(cccc1Cl)C 270004a_106832991635_100000041122 [0,1,0,0,0,0|2,0,1]=4 3230 B11R1.605 CNCc1c(cccc1Cl)Cl 207a_100102657272_100000189306 [0,1,0,0,0,0|2,0,1]=4 3231 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_100000174884_200000210301 [0,1,0,0,0,0|2,0,1]=4 3232 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_106832991635_100000187851 [0,1,0,0,0,0|2,0,1]=4 3233 B11R1.605 CNCc1c(cccc1Cl)Cl 26a_100102657272_100000211709 [0,1,0,0,0,0|2,0,1]=4 3234 B11R1.605 CNCc1c(cccc1Cl)Cl 270004a_106832991635_100000189306 [0,1,0,0,0,0|2,0,1]=4 3235 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100000174884_200000210301 [0,1,0,0,0,0|2,0,1]=4 3236 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100102657272_100000187851 [0,1,0,0,0,0|2,0,1]=4 3237 B11R1.605 CNCc1c(cccc1Cl)Cl 7a_106832991635_100000187851 [0,1,0,0,0,0|2,0,1]=4 3238 B11R1.605 CNCc1c(cccc1Cl)F 207a_100102657272_100000210083 [0,1,0,0,0,0|2,0,1]=4 3239 B11R1.605 CNCc1c(cccc1Cl)F 2230a_106832991635_100000187852 [0,1,0,0,0,0|2,0,1]=4 3240 B11R1.605 CNCc1c(cccc1Cl)F 270004a_106832991635_100000210083 [0,1,0,0,0,0|2,0,1]=4 3241 B11R1.605 CNCc1c(cccc1Cl)F 34a_100000174883_200000210301 [0,1,0,0,0,0|2,0,1]=4 3242 B11R1.605 CNCc1c(cccc1Cl)F 34a_100102657272_100000187852 [0,1,0,0,0,0|2,0,1]=4 3243 B11R1.605 CNCc1c(cccc1Cl)F 7a_106832991635_100000187852 [0,1,0,0,0,0|2,0,1]=4 3244 B11R1.605 CNCc1c(cccc1F)C 207a_100102657272_100000069827 [0,1,0,0,0,0|2,0,1]=4 3245 B11R1.605 CNCc1c(cccc1F)C 2230a_106832991635_100009814554 [0,1,0,0,0,0|2,0,1]=4 3246 B11R1.605 CNCc1c(cccc1F)C 270004a_106832991635_100000069827 [0,1,0,0,0,0|2,0,1]=4 3247 B11R1.605 CNCc1c(cccc1F)C 34a_100000762012_200000210301 [0,1,0,0,0,0|2,0,1]=4 3248 B11R1.605 CNCc1c(cccc1F)C 34a_100102657272_100009814554 [0,1,0,0,0,0|2,0,1]=4 3249 B11R1.605 CNCc1c(cccc1F)C 7a_106832991635_100009814554 [0,1,0,0,0,0|2,0,1]=4 3250 B11R1.605 CNCc1c(cccc1F)F 207a_100102657272_100000211061 [0,1,0,0,0,0|2,0,1]=4 3251 B11R1.605 CNCc1c(cccc1F)F 2230a_106832991635_100000698325 [0,1,0,0,0,0|2,0,1]=4 3252 B11R1.605 CNCc1c(cccc1F)F 270004a_106832991635_100000211061 [0,1,0,0,0,0|2,0,1]=4 3253 B11R1.605 CNCc1c(cccc1F)F 34a_100000688400_200000210301 [0,1,0,0,0,0|2,0,1]=4 3254 B11R1.605 CNCc1c(cccc1F)F 34a_100102657272_100000698325 [0,1,0,0,0,0|2,0,1]=4 3255 B11R1.605 CNCc1c(cccc1F)F 7a_106832991635_100000698325 [0,1,0,0,0,0|2,0,1]=4 3256 B11R1.605 CNCc1c(cccc1F)O 271570a_203496583355_106744473292 [0,1,0,0,0,0|1,0,1]=3 3257 B11R1.605 CNCc1c(cccc1I)Br 2230a_106832991635_100010146611 [0,1,0,0,0,0|2,0,1]=4 3258 B11R1.605 CNCc1c(cccc1I)Br 26a_100102657272_100010084509 [0,1,0,0,0,0|2,0,1]=4 3259 B11R1.605 CNCc1c(cccc1I)Br 34a_100102657272_100010146611 [0,1,0,0,0,0|2,0,1]=4 3260 B11R1.605 CNCc1c(cccc1I)Br 7a_106832991635_100010146611 [0,1,0,0,0,0|2,0,1]=4 3261 B11R1.605 CNCc1c(cccc1I)C 2230a_106832991635_100010150146 [0,1,0,0,0,0|2,0,1]=4 3262 B11R1.605 CNCc1c(cccc1I)C 34a_100102657272_100010150146 [0,1,0,0,0,0|2,0,1]=4 3263 B11R1.605 CNCc1c(cccc1I)C 7a_106832991635_100010150146 [0,1,0,0,0,0|2,0,1]=4 3264 B11R1.605 CNCc1c(cccc1I)Cl 207a_100102657272_100010147682 [0,1,0,0,0,0|2,0,1]=4 3265 B11R1.605 CNCc1c(cccc1I)Cl 270004a_106832991635_100010147682 [0,1,0,0,0,0|2,0,1]=4 3266 B11R1.605 CNCc1c(cccc1I)F 207a_100102657272_100010178011 [0,1,0,0,0,0|2,0,1]=4 3267 B11R1.605 CNCc1c(cccc1I)F 2230a_106832991635_100010149602 [0,1,0,0,0,0|2,0,1]=4 3268 B11R1.605 CNCc1c(cccc1I)F 270004a_106832991635_100010178011 [0,1,0,0,0,0|2,0,1]=4 3269 B11R1.605 CNCc1c(cccc1I)F 34a_100102657272_100010149602 [0,1,0,0,0,0|2,0,1]=4 3270 B11R1.605 CNCc1c(cccc1I)F 7a_106832991635_100010149602 [0,1,0,0,0,0|2,0,1]=4 3271 B11R1.605 COCc1c(cccc1Br)Br 34a_100010172814_200000210301 [0,1,0,0,0,0|2,0,1]=4 3272 B11R1.605 COCc1c(cccc1Br)Br 7a_100010172814_200000210301 [0,1,0,0,0,0|2,0,1]=4 3273 B11R1.605 COCc1c(cccc1Br)C 34a_100138415774_100010146847 [0,1,0,0,0,0|2,0,1]=4 3274 B11R1.605 COCc1c(cccc1Br)Cl 34a_100138415774_100010138402 [0,1,0,0,0,0|2,0,1]=4 3275 B11R1.605 COCc1c(cccc1Br)F 34a_100012355691_200000210301 [0,1,0,0,0,0|2,0,1]=4 3276 B11R1.605 COCc1c(cccc1Br)F 34a_100138415774_100012145669 [0,1,0,0,0,0|2,0,1]=4 3277 B11R1.605 COCc1c(cccc1Br)F 7a_100012355691_200000210301 [0,1,0,0,0,0|2,0,1]=4 3278 B11R1.605 COCc1c(cccc1Br)N 34a_100000747656_200000210301 [0,1,0,0,0,0|2,0,1]=4 3279 B11R1.605 COCc1c(cccc1C)C 34a_100011933981_200000210301 [0,1,0,0,0,0|2,0,1]=4 3280 B11R1.605 COCc1c(cccc1C)C 34a_100138415774_100000758300 [0,1,0,0,0,0|2,0,1]=4 3281 B11R1.605 COCc1c(cccc1C)C 7a_100011933981_200000210301 [0,1,0,0,0,0|2,0,1]=4 3282 B11R1.605 COCc1c(cccc1Cl)C 34a_100000082531_200000210301 [0,1,0,0,0,0|2,0,1]=4 3283 B11R1.605 COCc1c(cccc1Cl)C 7a_100000082531_200000210301 [0,1,0,0,0,0|2,0,1]=4 3284 B11R1.605 COCc1c(cccc1Cl)Cl 34a_100000215722_200000210301 [0,1,0,0,0,0|2,0,1]=4 3285 B11R1.605 COCc1c(cccc1Cl)Cl 34a_100138415774_100000187851 [0,1,0,0,0,0|2,0,1]=4 3286 B11R1.605 COCc1c(cccc1Cl)Cl 7a_100000215722_200000210301 [0,1,0,0,0,0|2,0,1]=4 3287 B11R1.605 COCc1c(cccc1Cl)F 34a_100000215723_200000210301 [0,1,0,0,0,0|2,0,1]=4 3288 B11R1.605 COCc1c(cccc1Cl)F 34a_100138415774_100000187852 [0,1,0,0,0,0|2,0,1]=4 3289 B11R1.605 COCc1c(cccc1Cl)F 7a_100000215723_200000210301 [0,1,0,0,0,0|2,0,1]=4 3290 B11R1.605 COCc1c(cccc1Cl)N 34a_100011916388_200000210301 [0,1,0,0,0,0|2,0,1]=4 3291 B11R1.605 COCc1c(cccc1F)C 34a_100000057874_200000210301 [0,1,0,0,0,0|2,0,1]=4 3292 B11R1.605 COCc1c(cccc1F)C 34a_100138415774_100009814554 [0,1,0,0,0,0|2,0,1]=4 3293 B11R1.605 COCc1c(cccc1F)C 7a_100000057874_200000210301 [0,1,0,0,0,0|2,0,1]=4 3294 B11R1.605 COCc1c(cccc1F)F 34a_100000698215_200000210301 [0,1,0,0,0,0|2,0,1]=4 3295 B11R1.605 COCc1c(cccc1F)F 34a_100138415774_100000698325 [0,1,0,0,0,0|2,0,1]=4 3296 B11R1.605 COCc1c(cccc1F)F 7a_100000698215_200000210301 [0,1,0,0,0,0|2,0,1]=4 3297 B11R1.605 COCc1c(cccc1F)N 34a_100011846719_200000210301 [0,1,0,0,0,0|2,0,1]=4 3298 B11R1.605 COCc1c(cccc1I)Br 34a_100138415774_100010146611 [0,1,0,0,0,0|2,0,1]=4 3299 B11R1.605 COCc1c(cccc1I)C 34a_100138415774_100010150146 [0,1,0,0,0,0|2,0,1]=4 3300 B11R1.605 COCc1c(cccc1I)F 34a_100010214973_200000210301 [0,1,0,0,0,0|2,0,1]=4 3301 B11R1.605 COCc1c(cccc1I)F 34a_100138415774_100010149602 [0,1,0,0,0,0|2,0,1]=4 3302 B11R1.605 COCc1c(cccc1I)F 7a_100010214973_200000210301 [0,1,0,0,0,0|2,0,1]=4 3303 B11R1.605 CSCc1c(cccc1Br)C 62a_100010146847_200000210301 [0,1,0,0,0,0|2,0,1]=4 3304 B11R1.605 CSCc1c(cccc1Br)C 62a_200000210301_100010146847 [0,1,0,0,0,0|2,0,1]=4 3305 B11R1.605 CSCc1c(cccc1Br)Cl 62a_100010138402_200000210301 [0,1,0,0,0,0|2,0,1]=4 3306 B11R1.605 CSCc1c(cccc1Br)Cl 62a_200000210301_100010138402 [0,1,0,0,0,0|2,0,1]=4 3307 B11R1.605 CSCc1c(cccc1Br)F 62a_100012145669_200000210301 [0,1,0,0,0,0|2,0,1]=4 3308 B11R1.605 CSCc1c(cccc1Br)F 62a_200000210301_100012145669 [0,1,0,0,0,0|2,0,1]=4 3309 B11R1.605 CSCc1c(cccc1C)C 62a_100000758300_200000210301 [0,1,0,0,0,0|2,0,1]=4 3310 B11R1.605 CSCc1c(cccc1C)C 62a_200000210301_100000758300 [0,1,0,0,0,0|2,0,1]=4 3311 B11R1.605 CSCc1c(cccc1Cl)Cl 62a_100000187851_200000210301 [0,1,0,0,0,0|2,0,1]=4 3312 B11R1.605 CSCc1c(cccc1Cl)Cl 62a_200000210301_100000187851 [0,1,0,0,0,0|2,0,1]=4 3313 B11R1.605 CSCc1c(cccc1Cl)F 62a_100000187852_200000210301 [0,1,0,0,0,0|2,0,1]=4 3314 B11R1.605 CSCc1c(cccc1Cl)F 62a_200000210301_100000187852 [0,1,0,0,0,0|2,0,1]=4 3315 B11R1.605 CSCc1c(cccc1F)C 62a_100009814554_200000210301 [0,1,0,0,0,0|2,0,1]=4 3316 B11R1.605 CSCc1c(cccc1F)C 62a_200000210301_100009814554 [0,1,0,0,0,0|2,0,1]=4 3317 B11R1.605 CSCc1c(cccc1F)F 62a_100000709179_200000210301 [0,1,0,0,0,0|2,0,1]=4 3318 B11R1.605 CSCc1c(cccc1F)F 62a_200000210301_100000698325 [0,1,0,0,0,0|2,0,1]=4 3319 B11R1.605 CSCc1c(cccc1I)Br 62a_100010146611_200000210301 [0,1,0,0,0,0|2,0,1]=4 3320 B11R1.605 CSCc1c(cccc1I)Br 62a_200000210301_100010146611 [0,1,0,0,0,0|2,0,1]=4 3321 B11R1.605 CSCc1c(cccc1I)C 62a_100010150146_200000210301 [0,1,0,0,0,0|2,0,1]=4 3322 B11R1.605 CSCc1c(cccc1I)C 62a_200000210301_100010150146 [0,1,0,0,0,0|2,0,1]=4 3323 B11R1.605 CSCc1c(cccc1I)F 62a_100010149602_200000210301 [0,1,0,0,0,0|2,0,1]=4 3324 B11R1.605 CSCc1c(cccc1I)F 62a_200000210301_100010149602 [0,1,0,0,0,0|2,0,1]=4 3325 B11R1.605 Cc1cccc(c1CC#N)O 271570a_203496583355_100010147027 [0,1,0,0,0,0|1,0,1]=3 3326 B11R1.605 Cc1cccc(c1CN[13CH3])C 34a_100000689800_200025704644 [0,1,0,0,0,0|2,0,1]=4 3327 B11R1.605 Cc1cccc(c1CN[13CH3])F 34a_100000762012_200025704644 [0,1,0,0,0,0|2,0,1]=4 3328 B11R1.605 Cc1cccc(c1CO[13CH3])C 34a_100011933981_200025704644 [0,1,0,0,0,0|2,0,1]=4 3329 B11R1.605 Cc1cccc(c1CO[13CH3])C 7a_100011933981_200025704644 [0,1,0,0,0,0|2,0,1]=4 3330 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 34a_100000082531_200025704644 [0,1,0,0,0,0|2,0,1]=4 3331 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 7a_100000082531_200025704644 [0,1,0,0,0,0|2,0,1]=4 3332 B11R1.605 Cc1cccc(c1CO[13CH3])F 34a_100000057874_200025704644 [0,1,0,0,0,0|2,0,1]=4 3333 B11R1.605 Cc1cccc(c1CO[13CH3])F 7a_100000057874_200025704644 [0,1,0,0,0,0|2,0,1]=4 3334 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_100010146847_200025704644 [0,1,0,0,0,0|2,0,1]=4 3335 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_200025704644_100010146847 [0,1,0,0,0,0|2,0,1]=4 3336 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_100000758300_200025704644 [0,1,0,0,0,0|2,0,1]=4 3337 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_200025704644_100000758300 [0,1,0,0,0,0|2,0,1]=4 3338 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_100009814554_200025704644 [0,1,0,0,0,0|2,0,1]=4 3339 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_200025704644_100009814554 [0,1,0,0,0,0|2,0,1]=4 3340 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_100010150146_200025704644 [0,1,0,0,0,0|2,0,1]=4 3341 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_200025704644_100010150146 [0,1,0,0,0,0|2,0,1]=4 3342 B11R1.605 Cc1cccc(c1NCF)O 34a_100000743429_100015361967 [0,1,0,0,0,0|2,0,1]=4 3343 B11R1.605 Cc1cccc(c1SCF)O 62a_100000686692_100015361967 [0,1,0,0,0,0|2,0,1]=4 3344 B11R1.605 Cc1cccc(c1SCF)O 62a_100015361967_100000686692 [0,1,0,0,0,0|2,0,1]=4 3345 B11R1.605 N#CCc1c(cccc1F)O 271570a_203496583355_100009817144 [0,1,0,0,0,0|1,0,1]=3 3346 B11R1.605 N#CSc1c(cccc1F)O 271570a_203496583355_100025703568 [0,1,0,0,0,0|2,0,1]=4 3347 B11R1.605 Nc1cccc(c1SCF)O 62a_100012183704_100015361967 [0,1,0,0,0,0|2,0,1]=4 3348 B11R1.605 Nc1cccc(c1SCF)O 62a_100015361967_100012183704 [0,1,0,0,0,0|2,0,1]=4 3349 B11R1.605 Oc1cccc(c1NCF)Br 34a_100011934926_100015361967 [0,1,0,0,0,0|2,0,1]=4 3350 B11R1.605 Oc1cccc(c1NCF)Cl 34a_100012022510_100015361967 [0,1,0,0,0,0|2,0,1]=4 3351 B11R1.605 Oc1cccc(c1NCF)F 34a_100020591140_100015361967 [0,1,0,0,0,0|2,0,1]=4 3352 B11R1.605 Oc1cccc(c1SCF)Br 62a_100010187912_100015361967 [0,1,0,0,0,0|2,0,1]=4 3353 B11R1.605 Oc1cccc(c1SCF)Br 62a_100015361967_100010187912 [0,1,0,0,0,0|2,0,1]=4 3354 B11R1.605 Oc1cccc(c1SCF)Cl 62a_100015361967_100000050174 [0,1,0,0,0,0|2,0,1]=4 3355 B11R1.605 Oc1cccc(c1SCF)F 62a_100009820682_100015361967 [0,1,0,0,0,0|2,0,1]=4 3356 B11R1.605 Oc1cccc(c1SCF)F 62a_100015361967_100009820682 [0,1,0,0,0,0|2,0,1]=4 3357 B11R1.605 Oc1cccc(c1SCF)O 62a_100015361967_100010205330 [0,1,0,0,0,0|2,0,1]=4 3358 B11R1.605 [13CH3]NCc1c(cccc1Br)F 34a_100012349121_200025704644 [0,1,0,0,0,0|2,0,1]=4 3359 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 2230a_100000174884_200025704644 [0,1,0,0,0,0|2,0,1]=4 3360 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 34a_100000174884_200025704644 [0,1,0,0,0,0|2,0,1]=4 3361 B11R1.605 [13CH3]NCc1c(cccc1Cl)F 34a_100000174883_200025704644 [0,1,0,0,0,0|2,0,1]=4 3362 B11R1.605 [13CH3]NCc1c(cccc1F)F 34a_100000688400_200025704644 [0,1,0,0,0,0|2,0,1]=4 3363 B11R1.605 [13CH3]OCc1c(cccc1Br)Br 34a_100010172814_200025704644 [0,1,0,0,0,0|2,0,1]=4 3364 B11R1.605 [13CH3]OCc1c(cccc1Br)Br 7a_100010172814_200025704644 [0,1,0,0,0,0|2,0,1]=4 3365 B11R1.605 [13CH3]OCc1c(cccc1Br)F 34a_100012355691_200025704644 [0,1,0,0,0,0|2,0,1]=4 3366 B11R1.605 [13CH3]OCc1c(cccc1Br)F 7a_100012355691_200025704644 [0,1,0,0,0,0|2,0,1]=4 3367 B11R1.605 [13CH3]OCc1c(cccc1Br)N 34a_100000747656_200025704644 [0,1,0,0,0,0|2,0,1]=4 3368 B11R1.605 [13CH3]OCc1c(cccc1Cl)Cl 34a_100000215722_200025704644 [0,1,0,0,0,0|2,0,1]=4 3369 B11R1.605 [13CH3]OCc1c(cccc1Cl)Cl 7a_100000215722_200025704644 [0,1,0,0,0,0|2,0,1]=4 3370 B11R1.605 [13CH3]OCc1c(cccc1Cl)F 34a_100000215723_200025704644 [0,1,0,0,0,0|2,0,1]=4 3371 B11R1.605 [13CH3]OCc1c(cccc1Cl)F 7a_100000215723_200025704644 [0,1,0,0,0,0|2,0,1]=4 3372 B11R1.605 [13CH3]OCc1c(cccc1Cl)N 34a_100011916388_200025704644 [0,1,0,0,0,0|2,0,1]=4 3373 B11R1.605 [13CH3]OCc1c(cccc1F)F 34a_100000698215_200025704644 [0,1,0,0,0,0|2,0,1]=4 3374 B11R1.605 [13CH3]OCc1c(cccc1F)F 7a_100000698215_200025704644 [0,1,0,0,0,0|2,0,1]=4 3375 B11R1.605 [13CH3]OCc1c(cccc1F)N 34a_100011846719_200025704644 [0,1,0,0,0,0|2,0,1]=4 3376 B11R1.605 [13CH3]OCc1c(cccc1I)F 34a_100010214973_200025704644 [0,1,0,0,0,0|2,0,1]=4 3377 B11R1.605 [13CH3]OCc1c(cccc1I)F 7a_100010214973_200025704644 [0,1,0,0,0,0|2,0,1]=4 3378 B11R1.605 [13CH3]SCc1c(cccc1Br)Cl 62a_100010138402_200025704644 [0,1,0,0,0,0|2,0,1]=4 3379 B11R1.605 [13CH3]SCc1c(cccc1Br)Cl 62a_200025704644_100010138402 [0,1,0,0,0,0|2,0,1]=4 3380 B11R1.605 [13CH3]SCc1c(cccc1Br)F 62a_100012145669_200025704644 [0,1,0,0,0,0|2,0,1]=4 3381 B11R1.605 [13CH3]SCc1c(cccc1Br)F 62a_200025704644_100012145669 [0,1,0,0,0,0|2,0,1]=4 3382 B11R1.605 [13CH3]SCc1c(cccc1Cl)Cl 62a_100000187851_200025704644 [0,1,0,0,0,0|2,0,1]=4 3383 B11R1.605 [13CH3]SCc1c(cccc1Cl)Cl 62a_200025704644_100000187851 [0,1,0,0,0,0|2,0,1]=4 3384 B11R1.605 [13CH3]SCc1c(cccc1Cl)F 62a_100000187852_200025704644 [0,1,0,0,0,0|2,0,1]=4 3385 B11R1.605 [13CH3]SCc1c(cccc1Cl)F 62a_200025704644_100000187852 [0,1,0,0,0,0|2,0,1]=4 3386 B11R1.605 [13CH3]SCc1c(cccc1F)F 62a_100000709179_200025704644 [0,1,0,0,0,0|2,0,1]=4 3387 B11R1.605 [13CH3]SCc1c(cccc1F)F 62a_200025704644_100000698325 [0,1,0,0,0,0|2,0,1]=4 3388 B11R1.605 [13CH3]SCc1c(cccc1I)Br 62a_100010146611_200025704644 [0,1,0,0,0,0|2,0,1]=4 3389 B11R1.605 [13CH3]SCc1c(cccc1I)Br 62a_200025704644_100010146611 [0,1,0,0,0,0|2,0,1]=4 3390 B11R1.605 [13CH3]SCc1c(cccc1I)F 62a_100010149602_200025704644 [0,1,0,0,0,0|2,0,1]=4 3391 B11R1.605 [13CH3]SCc1c(cccc1I)F 62a_200025704644_100010149602 [0,1,0,0,0,0|2,0,1]=4 3392 B11R1.605 [N-]=[N+]=Nc1c(cccc1F)O 271570a_203496583355_100102717373 [0,1,0,0,0,0|3,0,0]=4 3393 B9R0.18 C=CC=CC(=O)CCC=C 1458a_100016291481_100000754431 [0,0,1,0,0,0|0,0,2]=3 3394 B9R0.18 C=CC=CC(=O)NCC=C 1626a_100020586998_100016291481 [0,0,1,0,0,0|1,0,1]=3 3395 B9R0.45 C=CCOC/C=C/C=C/C 34a_100016283227_100015514636 [0,0,1,0,0,0|2,0,1]=4 3396 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [0,0,0,1,0,0|2,0,1]=4 3397 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [0,0,0,1,0,0|2,0,1]=4 3398 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [0,0,0,1,0,0|2,0,1]=4 3399 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [0,0,0,1,0,0|2,0,1]=4 3400 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,1,0,0|1,0,1]=3 3401 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [0,0,0,1,0,0|1,1,1]=4 3402 B11R2.10 Oc1nc2ccccc2[nH]1 271570a_203496583355_100009814255 [0,0,0,1,0,0|3,0,0]=4 3403 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [0,0,0,1,0,0|2,1,0]=4 3404 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [0,0,0,1,0,0|2,0,1]=4 3405 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [0,0,0,1,0,0|2,0,1]=4 3406 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [0,0,0,1,0,0|2,0,1]=4 3407 B11R2.55 Brc1ccccc1C2CC2 271570a_100011220607_100000695589 [0,0,0,1,0,0|1,0,2]=4 3408 B11R2.55 Cc1ccccc1C2CC2 271570a_100011220607_100000210755 [0,0,0,1,0,0|1,0,2]=4 3409 B11R2.55 Clc1ccccc1C2CC2 271570a_100011220607_100000764095 [0,0,0,1,0,0|1,0,2]=4 3410 B11R2.55 Fc1ccccc1C2CC2 271570a_100011220607_100011215700 [0,0,0,1,0,0|1,0,2]=4 3411 B11R2.55 Nc1ccccc1C2CC2 271570a_100011220607_100000210017 [0,0,0,1,0,0|1,0,2]=4 3412 B11R2.55 Oc1ccccc1C2CC2 271570a_100011220607_100000739446 [0,0,0,1,0,0|0,0,2]=3 3413 B11R2.55 Oc1ccccc1C2CC2 271570a_203496583355_100009819954 [0,0,0,1,0,0|0,0,2]=3 3414 B11R2.55 Oc1cccnc1C2CC2 271570a_100011220607_100000034122 [0,0,0,1,0,0|1,0,2]=4 3415 B11R2.55 Oc1cnccc1C2CC2 271570a_100011220607_100009817591 [0,0,0,1,0,0|1,0,2]=4 3416 B11R2.55 Oc1ncccc1C2CC2 271570a_203496583355_100009851976 [0,0,0,1,0,0|1,0,2]=4 3417 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [0,0,0,1,0,0|0,0,0]=1 3418 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [0,0,0,1,0,0|0,0,2]=3 3419 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [0,0,0,1,0,0|1,0,1]=3 3420 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [0,0,0,1,0,0|1,0,1]=3 3421 B11R2.106 Oc1cccc2c1CNC2 271570a_203496583355_100000703859 [0,0,0,1,0,0|1,0,1]=3 3422 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [0,0,0,1,0,0|1,0,1]=3 3423 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [0,0,0,1,0,0|1,0,2]=4 3424 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [0,0,0,1,0,0|1,0,2]=4 3425 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [0,0,0,1,0,0|2,0,1]=4 3426 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [0,0,0,1,0,0|1,0,0]=2 3427 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [0,0,0,1,0,0|2,0,0]=3 3428 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [0,0,0,1,0,0|3,0,0]=4 3429 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [0,0,0,1,0,0|1,0,1]=3 3430 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [0,0,0,1,0,0|1,0,1]=3 3431 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [0,0,0,1,0,0|1,0,1]=3 3432 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [0,0,0,1,0,0|2,0,1]=4 3433 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [0,0,0,1,0,0|2,0,1]=4 3434 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [0,0,0,1,0,0|2,0,0]=3 3435 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [0,0,0,1,0,0|2,0,0]=3 3436 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [0,0,0,1,0,0|2,0,0]=3 3437 B11R2.106 Oc1cccc2c1non2 271570a_203496583355_100009820244 [0,0,0,1,0,0|3,0,0]=4 3438 B11R2.106 Oc1cccc2c1nsn2 271570a_203496583355_100000742359 [0,0,0,1,0,0|3,0,0]=4 3439 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [0,0,0,1,0,0|1,0,0]=2 3440 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [0,0,0,1,0,0|2,0,0]=3 3441 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [0,0,0,1,0,0|2,0,0]=3 3442 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [0,0,0,1,0,0|1,0,0]=2 3443 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [0,0,0,1,0,0|2,0,0]=3 3444 B11R2.106 Oc1cccc2n1ccn2 271570a_203496583355_100000762677 [0,0,0,1,0,0|2,0,1]=4 3445 B11R2.106 Oc1cccc2n1cnc2 271570a_203496583355_100009817730 [0,0,0,1,0,0|2,0,1]=4 3446 B11R2.106 Oc1cccc2n1ncc2 271570a_203496583355_100009817731 [0,0,0,1,0,0|2,0,0]=3 3447 B11R2.106 Oc1cccc2n1ncn2 271570a_203496583355_100009819724 [0,0,0,1,0,0|3,0,0]=4 3448 B11R2.106 Oc1cccn2c1ccn2 271570a_203496583355_100010767162 [0,0,0,1,0,0|2,0,1]=4 3449 B11R2.106 Oc1cccn2c1cnc2 271570a_203496583355_100009857155 [0,0,0,1,0,0|2,0,1]=4 3450 B11R2.106 Oc1cccn2c1ncc2 271570a_203496583355_100011934911 [0,0,0,1,0,0|2,0,0]=3 3451 B11R2.106 Oc1cccn2c1ncn2 271570a_203496583355_100009819722 [0,0,0,1,0,0|3,0,0]=4 3452 B11R2.106 Oc1cccn2c1nnc2 271570a_203496583355_100000764285 [0,0,0,1,0,0|3,0,0]=4 3453 B11R2.106 Oc1ccnc2c1CCC2 271570a_203496583355_100000102697 [0,0,0,1,0,0|1,0,2]=4 3454 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [0,0,0,1,0,0|2,0,0]=3 3455 B11R2.106 Oc1ccnc2c1[nH]nc2 271570a_203496583355_100000112858 [0,0,0,1,0,0|3,0,0]=4 3456 B11R2.106 Oc1ccnc2c1cc[nH]2 271570a_203496583355_100000049914 [0,0,0,1,0,0|2,0,1]=4 3457 B11R2.106 Oc1ccnc2c1ccs2 271570a_203496583355_100009861243 [0,0,0,1,0,0|2,0,1]=4 3458 B11R2.106 Oc1ccnc2c1nc[nH]2 271570a_203496583355_100009820729 [0,0,0,1,0,0|3,0,0]=4 3459 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [0,0,0,1,0,0|2,0,0]=3 3460 B11R2.106 Oc1ccnc2c1scc2 271570a_203496583355_100000723842 [0,0,0,1,0,0|2,0,0]=3 3461 B11R2.106 Oc1ccnc2n1ncc2 271570a_203496583355_100000080991 [0,0,0,1,0,0|3,0,0]=4 3462 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [0,0,0,1,0,0|2,0,0]=3 3463 B11R2.106 Oc1cncc2c1[nH]cn2 271570a_203496583355_100000759552 [0,0,0,1,0,0|3,0,0]=4 3464 B11R2.106 Oc1cncc2c1[nH]nc2 271570a_203496583355_100009857261 [0,0,0,1,0,0|3,0,0]=4 3465 B11R2.106 Oc1cncc2c1cc[nH]2 271570a_203496583355_100009840476 [0,0,0,1,0,0|2,0,1]=4 3466 B11R2.106 Oc1nccc2c1CCN2 271570a_203496583355_100000104060 [0,0,0,1,0,0|2,0,1]=4 3467 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [0,0,0,1,0,0|2,0,0]=3 3468 B11R2.106 Oc1nccc2c1[nH]nc2 271570a_203496583355_100009852419 [0,0,0,1,0,0|3,0,0]=4 3469 B11R2.106 Oc1nccc2c1cc[nH]2 271570a_203496583355_100000086534 [0,0,0,1,0,0|2,0,1]=4 3470 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [0,0,0,1,0,0|2,0,1]=4 3471 B11R2.106 Oc1nccc2c1ccs2 271570a_203496583355_100000047778 [0,0,0,1,0,0|2,0,1]=4 3472 B11R2.106 Oc1nccc2c1nc[nH]2 271570a_203496583355_100009820035 [0,0,0,1,0,0|3,0,0]=4 3473 B11R2.106 Oc1nccc2c1scc2 271570a_203496583355_100000117209 [0,0,0,1,0,0|2,0,0]=3 3474 B11R2.106 Oc1nccn2c1ccc2 271570a_203496583355_100000094558 [0,0,0,1,0,0|2,0,1]=4 3475 B11R2.106 Oc1nccn2c1ncc2 271570a_203496583355_100009887225 [0,0,0,1,0,0|3,0,0]=4 3476 B11R2.106 Oc1ncnc2c1[nH]cc2 271570a_203496583355_100000084117 [0,0,0,1,0,0|3,0,0]=4 3477 B11R2.106 Oc1ncnc2c1scc2 271570a_203496583355_100000234879 [0,0,0,1,0,0|3,0,0]=4 3478 B11R2.988 CNC1Cc2c1cccc2 7a_106832991635_100009813401 [0,0,0,1,0,0|2,0,1]=4 3479 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [0,0,0,1,0,0|2,0,1]=4 3480 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [0,0,0,1,0,0|2,0,1]=4 3481 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [0,0,0,1,0,0|2,0,1]=4 3482 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [0,0,0,1,0,0|2,0,1]=4 3483 B9R1.33 CNCc1ccsc1O 271570a_203496583355_100009817074 [0,0,0,0,1,0|2,0,1]=4 3484 B9R1.33 CNCc1cscc1O 271570a_203496583355_100011935083 [0,0,0,0,1,0|2,0,1]=4 3485 B9R1.33 CNCc1sccc1O 271570a_203496583355_100000767120 [0,0,0,0,1,0|2,0,1]=4 3486 B8R0.1 C=CC=CC(=O)CC=C 1458a_100016291481_100000210623 [1,0,1,0,0,0|0,0,1]=3 3487 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,0]=2 3488 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [2,0,0,0,0,0|1,0,0]=3 3489 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [2,0,0,0,0,0|1,0,0]=3 3490 B8R1.2 C=Cc1cccnn1 271570a_100011290941_100016991348 [2,0,0,0,0,0|2,0,0]=4 3491 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [2,0,0,0,0,0|1,0,0]=3 3492 B8R1.2 C=Cc1ccncn1 271570a_100011290941_100000703185 [2,0,0,0,0,0|2,0,0]=4 3493 B8R1.2 C=Cc1ccnnc1 271570a_100011290941_100000732662 [2,0,0,0,0,0|2,0,0]=4 3494 B8R1.2 C=Cc1cnccn1 271570a_100011290941_100000758340 [2,0,0,0,0,0|2,0,0]=4 3495 B8R1.2 C=Cc1cncnc1 271570a_100011290941_100011206942 [2,0,0,0,0,0|2,0,0]=4 3496 B8R1.2 C=Cc1ncccn1 271570a_100011290941_100000211032 [2,0,0,0,0,0|2,0,0]=4 3497 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|1,0,1]=4 3498 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,1]=4 3499 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,1]=4 3500 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,1]=4 3501 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,1]=4 3502 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|1,0,1]=4 3503 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,1]=4 3504 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,1]=4 3505 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,1]=4 3506 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,1]=4 3507 B8R1.5 C[n+]1ccccc1O 271570a_203496583355_100000212160 [2,0,0,0,0,0|1,0,0]=3 3508 B8R1.5 Cc1ccccc1O 271570a_203496583355_100000210755 [2,0,0,0,0,0|0,0,0]=2 3509 B8R1.5 Cc1cccnc1O 271570a_203496583355_100000751373 [2,0,0,0,0,0|1,0,0]=3 3510 B8R1.5 Cc1ccncc1O 271570a_203496583355_100000761580 [2,0,0,0,0,0|1,0,0]=3 3511 B8R1.5 Cc1ccnnc1O 271570a_203496583355_100000089043 [2,0,0,0,0,0|2,0,0]=4 3512 B8R1.5 Cc1cnccc1O 271570a_203496583355_100015191297 [2,0,0,0,0,0|1,0,0]=3 3513 B8R1.5 Cc1cncnc1O 271570a_203496583355_100011998708 [2,0,0,0,0,0|2,0,0]=4 3514 B8R1.5 Cc1ncccc1O 271570a_203496583355_100000751574 [2,0,0,0,0,0|1,0,0]=3 3515 B8R1.5 Cc1nccnc1O 271570a_203496583355_100011999405 [2,0,0,0,0,0|2,0,0]=4 3516 B8R1.5 Cc1ncncc1O 271570a_203496583355_100009819671 [2,0,0,0,0,0|2,0,0]=4 3517 B8R1.5 Nc1ccccc1O 271570a_203496583355_100000210017 [2,0,0,0,0,0|1,0,0]=3 3518 B8R1.5 Nc1cccnc1O 271570a_203496583355_100000688686 [2,0,0,0,0,0|2,0,0]=4 3519 B8R1.5 Nc1ccncc1O 271570a_203496583355_100000047001 [2,0,0,0,0,0|2,0,0]=4 3520 B8R1.5 Nc1cnccc1O 271570a_203496583355_100009815883 [2,0,0,0,0,0|2,0,0]=4 3521 B8R1.5 Nc1ncccc1O 271570a_203496583355_100000045569 [2,0,0,0,0,0|2,0,0]=4 3522 B8R1.5 O=c1[nH]cccc1O 271570a_203496583355_100000050042 [2,0,0,0,0,0|2,0,0]=4 3523 B8R1.5 O=c1cc[nH]cc1O 271570a_203496583355_100009998708 [2,0,0,0,0,0|2,0,0]=4 3524 B8R1.5 Oc1c[nH]ccc1=S 271570a_203496583355_200012280681 [2,0,0,0,0,0|2,0,0]=4 3525 B8R1.5 Oc1ccccc1Br 271570a_203496583355_100000695589 [2,0,0,0,0,0|1,0,0]=3 3526 B8R1.5 Oc1ccccc1Cl 271570a_203496583355_100000764095 [2,0,0,0,0,0|1,0,0]=3 3527 B8R1.5 Oc1ccccc1F 271570a_203496583355_100011215700 [2,0,0,0,0,0|1,0,0]=3 3528 B8R1.5 Oc1ccccc1O 271570a_203496583355_100000739446 [2,0,0,0,0,0|1,0,0]=3 3529 B8R1.5 Oc1cccnc1Br 271570a_203496583355_100010202626 [2,0,0,0,0,0|2,0,0]=4 3530 B8R1.5 Oc1cccnc1Cl 271570a_203496583355_100000036424 [2,0,0,0,0,0|2,0,0]=4 3531 B8R1.5 Oc1cccnc1F 271570a_203496583355_100009816115 [2,0,0,0,0,0|2,0,0]=4 3532 B8R1.5 Oc1cccnc1O 271570a_203496583355_100000034122 [2,0,0,0,0,0|2,0,0]=4 3533 B8R1.5 Oc1ccncc1Br 271570a_203496583355_100000726257 [2,0,0,0,0,0|2,0,0]=4 3534 B8R1.5 Oc1ccncc1Cl 271570a_203496583355_100000708259 [2,0,0,0,0,0|2,0,0]=4 3535 B8R1.5 Oc1ccncc1F 271570a_203496583355_100000047030 [2,0,0,0,0,0|2,0,0]=4 3536 B8R1.5 Oc1ccncc1O 271570a_203496583355_100009817591 [2,0,0,0,0,0|2,0,0]=4 3537 B8R1.5 Oc1cnccc1Br 271570a_203496583355_100010138639 [2,0,0,0,0,0|2,0,0]=4 3538 B8R1.5 Oc1cnccc1Cl 271570a_203496583355_100009995489 [2,0,0,0,0,0|2,0,0]=4 3539 B8R1.5 Oc1cnccc1F 271570a_203496583355_100009820683 [2,0,0,0,0,0|2,0,0]=4 3540 B8R1.5 Oc1ncccc1Br 271570a_203496583355_100000696092 [2,0,0,0,0,0|2,0,0]=4 3541 B8R1.5 Oc1ncccc1Cl 271570a_203496583355_100011356963 [2,0,0,0,0,0|2,0,0]=4 3542 B8R1.5 Oc1ncccc1F 271570a_203496583355_100000685392 [2,0,0,0,0,0|2,0,0]=4 3543 B8R1.5 [O-][n+]1ccccc1O 271570a_203496583355_200000042595 [2,0,0,0,0,0|2,0,0]=4 3544 B10R0.73 C=CCN(CC=C)C(=O)C=C 1626a_100000210471_100000185746 [0,1,1,0,0,0|1,0,1]=4 3545 B10R0.73 C=CCN(CC=C)C(=O)C=C 240690a_100000210471_200121576911 [0,1,1,0,0,0|1,0,1]=4 3546 B10R0.19 C=CC=CC(=O)N(C)CC=C 1626a_100000225617_100016291481 [0,1,1,0,0,0|1,0,1]=4 3547 B10R0.78 C=CC=CC(=O)CCC(=C)C 1458a_100016291481_100000730704 [0,1,1,0,0,0|0,0,2]=4 3548 B10R0.78 C=CC=CC(=O)NCC(=C)C 1626a_100000765925_100016291481 [0,1,1,0,0,0|1,0,1]=4 3549 B10R0.91 C=CC=CC(=O)CCCC=C 1458a_100016291481_100000757094 [0,1,1,0,0,0|0,0,2]=4 3550 B10R0.91 C=CC=CC(=O)CCOC=C 1458a_100016291481_100000039644 [0,1,1,0,0,0|0,0,2]=4 3551 B10R0.91 C=CC=CC(=O)NCCC=C 1626a_100015191253_100016291481 [0,1,1,0,0,0|0,0,2]=4 3552 B10R0.91 C=CC=CC(=O)NNCC=C 22a_100020588587_100016291481 [0,1,1,0,0,0|1,0,1]=4 3553 B10R0.91 C=CCCC(=O)C=C/C=C/C 1458a_100000185730_100000754431 [0,1,1,0,0,0|0,0,2]=4 3554 B10R0.91 C=CCNC(=O)C=C/C=C/C 1626a_100020586998_100000185730 [0,1,1,0,0,0|1,0,1]=4 3555 B10R0.91 C=CCNC(=O)C=C/C=C/C 240690a_100020586998_100000185730 [0,1,1,0,0,0|1,0,1]=4 3556 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|0,0,2]=4 3557 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,1,0,0,0,0|0,0,2]=4 3558 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,1,0,0,0,0|0,0,2]=4 3559 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,1,0,0,0,0|0,0,2]=4 3560 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,1,0,0,0,0|0,0,2]=4 3561 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,1,0,0,0,0|0,0,2]=4 3562 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,1,0,0,0,0|0,0,2]=4 3563 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|0,0,2]=4 3564 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|0,0,2]=4 3565 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|0,0,2]=4 3566 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|0,0,2]=4 3567 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|0,0,2]=4 3568 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|0,0,2]=4 3569 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,1,0,0,0,0|0,0,2]=4 3570 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,1,0,0,0,0|1,0,1]=4 3571 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,1,0,0,0,0|1,0,1]=4 3572 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,1,0,0,0,0|1,0,1]=4 3573 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,1,0,0,0,0|1,0,1]=4 3574 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,1,0,0,0,0|1,0,1]=4 3575 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,1,0,0,0,0|1,0,1]=4 3576 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,1,0,0,0,0|1,0,1]=4 3577 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,1,0,0,0,0|1,0,1]=4 3578 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|1,0,1]=4 3579 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|1,0,1]=4 3580 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|1,0,1]=4 3581 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|1,0,1]=4 3582 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|1,0,1]=4 3583 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|1,0,1]=4 3584 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|1,0,1]=4 3585 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|1,0,1]=4 3586 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,1,0,0,0,0|1,0,1]=4 3587 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,1,0,0,0,0|1,0,1]=4 3588 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,1,0,0,0,0|1,0,1]=4 3589 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,1,0,0,0,0|1,0,1]=4 3590 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,1,0,0,0,0|1,0,1]=4 3591 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,1,0,0,0,0|1,0,1]=4 3592 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,1,0,0,0,0|1,0,1]=4 3593 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,1,0,0,0,0|1,0,1]=4 3594 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,1,0,0,0,0|1,0,1]=4 3595 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,1,0,0,0,0|1,0,1]=4 3596 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,1,0,0,0,0|1,0,1]=4 3597 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,1,0,0,0,0|1,0,1]=4 3598 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,1,0,0,0,0|1,0,1]=4 3599 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,1,0,0,0,0|1,0,1]=4 3600 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,1,0,0,0,0|1,0,1]=4 3601 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,1,0,0,0,0|1,0,1]=4 3602 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,1,0,0,0,0|1,0,1]=4 3603 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,1,0,0,0,0|1,0,1]=4 3604 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,1,0,0,0,0|1,0,1]=4 3605 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,1,0,0,0,0|1,0,1]=4 3606 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,1,0,0,0,0|1,0,1]=4 3607 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,1]=4 3608 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,1,0,0,0,0|1,0,1]=4 3609 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,1,0,0,0,0|1,0,1]=4 3610 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|1,0,1]=4 3611 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|1,0,1]=4 3612 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|1,0,1]=4 3613 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,1,0,0,0,0|1,0,1]=4 3614 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,1,0,0,0,0|1,0,1]=4 3615 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,1,0,0,0,0|1,0,1]=4 3616 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,1,0,0,0,0|1,0,1]=4 3617 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,1,0,0,0,0|1,0,1]=4 3618 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,1,0,0,0,0|1,0,1]=4 3619 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,1,0,0,0,0|1,0,1]=4 3620 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,1,0,0,0,0|1,0,1]=4 3621 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,1,0,0,0,0|1,0,1]=4 3622 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,1]=4 3623 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,1,0,0,0,0|1,0,1]=4 3624 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,1,0,0,0,0|1,0,1]=4 3625 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,1,0,0,0,0|1,0,1]=4 3626 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|1,0,1]=4 3627 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|1,0,1]=4 3628 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,1,0,0,0,0|1,0,1]=4 3629 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,1,0,0,0,0|1,0,1]=4 3630 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,1,0,0,0,0|1,0,1]=4 3631 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,1,0,0,0,0|1,0,1]=4 3632 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,1,0,0,0,0|1,0,1]=4 3633 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,1,0,0,0,0|1,0,1]=4 3634 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|1,0,1]=4 3635 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|1,0,1]=4 3636 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|1,0,1]=4 3637 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|1,0,1]=4 3638 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|1,0,1]=4 3639 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|1,0,1]=4 3640 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [1,1,0,0,0,0|1,0,1]=4 3641 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,1,0,0,0,0|1,0,1]=4 3642 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,1,0,0,0,0|1,0,0]=3 3644 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,1,0,0,0,0|1,0,1]=4 3645 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,1,0,0,0,0|1,0,1]=4 3646 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,1,0,0,0,0|1,0,1]=4 3647 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,1,0,0,0,0|1,0,1]=4 3648 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,1,0,0,0,0|1,0,1]=4 3649 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,1,0,0,0,0|1,0,1]=4 3650 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,1,0,0,0,0|1,0,1]=4 3651 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,1,0,0,0,0|1,0,1]=4 3652 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,1,0,0,0,0|1,0,1]=4 3653 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,1,0,0,0,0|1,0,1]=4 3654 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,1]=4 3655 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,1,0,0,0,0|1,0,1]=4 3656 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,1,0,0,0,0|1,0,1]=4 3657 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,1,0,0,0,0|1,0,1]=4 3658 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,1,0,0,0,0|1,0,1]=4 3659 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,1,0,0,0,0|1,0,1]=4 3660 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,1,0,0,0,0|1,0,1]=4 3661 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,1,0,0,0,0|1,0,1]=4 3662 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,1]=4 3663 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,1,0,0,0,0|1,0,1]=4 3664 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,1,0,0,0,0|1,0,1]=4 3665 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,1,0,0,0,0|1,0,1]=4 3666 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,1,0,0,0,0|1,0,1]=4 3667 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,1,0,0,0,0|1,0,1]=4 3668 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,1,0,0,0,0|1,0,1]=4 3669 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,1,0,0,0,0|1,0,1]=4 3670 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,1,0,0,0,0|1,0,1]=4 3671 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,1,0,0,0,0|0,0,2]=4 3672 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,1,0,0,0,0|0,0,2]=4 3673 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,1,0,0,0,0|0,0,2]=4 3674 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,1,0,0,0,0|0,0,2]=4 3675 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,1,0,0,0,0|0,0,2]=4 3676 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,1,0,0,0,0|0,0,2]=4 3677 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,1,0,0,0,0|0,0,2]=4 3678 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,1,0,0,0,0|0,0,0]=2 3679 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,1,0,0,0,0|0,0,2]=4 3680 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,1,0,0,0,0|0,0,2]=4 3681 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,1,0,0,0,0|0,0,2]=4 3682 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,1,0,0,0,0|0,0,2]=4 3683 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,1,0,0,0,0|0,0,2]=4 3684 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,1,0,0,0,0|0,0,2]=4 3685 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,1,0,0,0,0|0,0,2]=4 3686 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,1,0,0,0,0|0,0,2]=4 3687 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,1,0,0,0,0|1,0,1]=4 3688 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,1,0,0,0,0|1,0,1]=4 3689 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,1,0,0,0,0|1,0,1]=4 3690 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,1,0,0,0,0|1,0,1]=4 3691 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,1,0,0,0,0|1,0,1]=4 3692 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,1,0,0,0,0|1,0,1]=4 3693 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,1,0,0,0,0|1,0,1]=4 3694 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,1,0,0,0,0|1,0,1]=4 3695 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,1,0,0,0,0|1,0,1]=4 3696 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,1,0,0,0,0|1,0,1]=4 3697 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,1,0,0,0,0|1,0,1]=4 3698 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,1,0,0,0,0|1,0,1]=4 3699 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,1,0,0,0,0|1,0,1]=4 3700 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,1,0,0,0,0|1,0,1]=4 3701 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,1,0,0,0,0|1,0,1]=4 3702 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,1,0,0,0,0|1,0,1]=4 3703 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,1,0,0,0,0|1,0,1]=4 3704 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,1,0,0,0,0|1,0,1]=4 3705 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,1,0,0,0,0|1,0,1]=4 3706 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,1,0,0,0,0|1,0,1]=4 3707 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,1,0,0,0,0|1,0,1]=4 3708 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,1,0,0,0,0|1,0,1]=4 3709 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,1,0,0,0,0|1,0,1]=4 3710 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,1,0,0,0,0|1,0,1]=4 3711 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,1,0,0,0,0|1,0,1]=4 3712 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,1,0,0,0,0|1,0,1]=4 3713 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,1,0,0,0,0|1,0,1]=4 3714 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,1,0,0,0,0|1,0,1]=4 3715 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,1,0,0,0,0|1,0,1]=4 3716 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,1,0,0,0,0|1,0,1]=4 3717 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,1,0,0,0,0|1,0,1]=4 3718 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,1,0,0,0,0|1,0,1]=4 3719 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,1,0,0,0,0|1,0,1]=4 3720 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,1,0,0,0,0|1,0,1]=4 3721 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,1,0,0,0,0|1,0,1]=4 3722 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,1,0,0,0,0|1,0,1]=4 3723 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,1,0,0,0,0|1,0,1]=4 3724 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,1,0,0,0,0|1,0,1]=4 3725 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,1,0,0,0,0|1,0,1]=4 3726 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,1,0,0,0,0|1,0,1]=4 3727 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,1,0,0,0,0|1,0,1]=4 3728 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,1,0,0,0,0|1,0,1]=4 3729 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,1,0,0,0,0|1,0,1]=4 3730 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,1,0,0,0,0|1,0,1]=4 3731 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,1,0,0,0,0|1,0,1]=4 3732 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,1,0,0,0,0|1,0,1]=4 3733 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,1,0,0,0,0|1,0,1]=4 3734 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3735 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,1,0,0,0,0|1,0,1]=4 3736 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3737 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,1,0,0,0,0|1,0,1]=4 3738 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,1,0,0,0,0|1,0,1]=4 3739 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,1,0,0,0,0|1,0,1]=4 3740 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,1,0,0,0,0|1,0,1]=4 3741 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,1,0,0,0,0|1,0,1]=4 3742 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,1,0,0,0,0|1,0,1]=4 3743 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,1,0,0,0,0|1,0,1]=4 3744 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,1,0,0,0,0|1,0,1]=4 3745 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,1,0,0,0,0|1,0,1]=4 3746 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,1,0,0,0,0|1,0,1]=4 3747 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,1,0,0,0,0|1,0,1]=4 3748 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,1,0,0,0,0|1,0,1]=4 3749 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,1,0,0,0,0|1,0,1]=4 3750 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,1,0,0,0,0|1,0,1]=4 3751 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,1,0,0,0,0|1,0,1]=4 3752 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,1,0,0,0,0|1,0,1]=4 3753 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,1,0,0,0,0|1,0,1]=4 3754 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,1,0,0,0,0|1,0,1]=4 3755 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,1,0,0,0,0|1,0,1]=4 3756 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,1,0,0,0,0|1,0,1]=4 3757 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,1,0,0,0,0|1,0,1]=4 3758 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,1,0,0,0,0|1,0,1]=4 3759 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,1,0,0,0,0|1,0,1]=4 3760 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,1,0,0,0,0|1,0,1]=4 3761 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,1,0,0,0,0|1,0,1]=4 3762 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,1,0,0,0,0|1,0,1]=4 3763 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3764 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3765 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,1,0,0,0,0|1,0,1]=4 3766 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,1,0,0,0,0|1,0,1]=4 3767 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [1,1,0,0,0,0|1,0,1]=4 3768 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,1,0,0,0,0|1,0,1]=4 3769 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,1,0,0,0,0|2,0,0]=4 3770 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,1,0,0,0,0|1,0,0]=3 3771 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,1,0,0,0,0|1,0,1]=4 3772 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,1,0,0,0,0|1,0,1]=4 3773 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,1,0,0,0,0|1,0,1]=4 3774 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,1,0,0,0,0|1,0,1]=4 3775 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,1,0,0,0,0|1,0,1]=4 3776 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,1,0,0,0,0|1,0,1]=4 3777 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,1,0,0,0,0|1,0,1]=4 3778 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,1,0,0,0,0|1,0,1]=4 3779 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,1,0,0,0,0|1,0,1]=4 3780 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,1,0,0,0,0|1,0,1]=4 3781 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,1,0,0,0,0|1,0,1]=4 3782 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,1,0,0,0,0|1,0,1]=4 3783 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,1,0,0,0,0|1,0,1]=4 3784 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,1,0,0,0,0|1,0,1]=4 3785 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,1,0,0,0,0|1,0,1]=4 3786 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,1,0,0,0,0|1,0,1]=4 3787 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,1,0,0,0,0|1,0,1]=4 3788 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,1,0,0,0,0|1,0,1]=4 3789 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,1,0,0,0,0|1,0,1]=4 3790 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,1,0,0,0,0|1,0,1]=4 3791 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,1,0,0,0,0|1,0,1]=4 3792 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,1,0,0,0,0|1,0,1]=4 3793 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,1,0,0,0,0|1,0,1]=4 3794 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,1,0,0,0,0|1,0,1]=4 3795 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,1,0,0,0,0|1,0,1]=4 3796 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,1,0,0,0,0|1,0,1]=4 3797 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,1,0,0,0,0|1,0,1]=4 3798 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,1,0,0,0,0|1,0,1]=4 3799 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,1,0,0,0,0|1,0,1]=4 3800 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,1,0,0,0,0|1,0,1]=4 3801 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|1,0,1]=4 3802 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|1,0,1]=4 3803 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|1,0,1]=4 3804 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|1,0,1]=4 3805 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|1,0,1]=4 3806 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|1,0,1]=4 3807 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|1,0,1]=4 3808 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|1,0,1]=4 3809 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|1,0,1]=4 3810 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|1,0,1]=4 3811 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|1,0,1]=4 3812 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|1,0,1]=4 3813 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|1,0,1]=4 3814 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|1,0,1]=4 3815 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|1,0,1]=4 3816 B10R1.17 C#CCNc1ccccc1 34a_100000106764_100000184674 [1,1,0,0,0,0|0,0,2]=4 3817 B10R1.17 C#CCOc1ccccc1 34a_100000210340_100000184674 [1,1,0,0,0,0|0,0,2]=4 3818 B10R1.17 C#CCOc1ccccc1 7a_100000210340_100000038162 [1,1,0,0,0,0|0,0,2]=4 3819 B10R1.17 C#CCSc1ccccc1 62a_100000038162_100000041952 [1,1,0,0,0,0|0,0,2]=4 3820 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,1,0,0,0,0|0,0,0]=2 3821 B10R1.17 C=CCNc1cccnn1 27a_100020586998_100016991348 [1,1,0,0,0,0|2,0,0]=4 3822 B10R1.17 C=CCNc1ccncn1 27a_100020586998_100000703185 [1,1,0,0,0,0|2,0,0]=4 3823 B10R1.17 C=CCNc1cnccn1 27a_100020586998_100000211759 [1,1,0,0,0,0|2,0,0]=4 3824 B10R1.17 C=CCNc1ncccn1 27a_100020586998_100000211032 [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,1,0,0,0,0|0,0,0]=2 3826 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,1,0,0,0,0|0,0,0]=2 3827 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [1,1,0,0,0,0|1,0,0]=3 3828 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [1,1,0,0,0,0|1,0,0]=3 3829 B10R1.17 C=CCOc1ccncc1 34a_100000212176_100015514636 [1,1,0,0,0,0|1,0,0]=3 3830 B10R1.17 C=CCOc1ccnnc1 34a_100015204005_100015514636 [1,1,0,0,0,0|2,0,0]=4 3831 B10R1.17 C=CCOc1cncnc1 7a_100000754086_100015514636 [1,1,0,0,0,0|2,0,0]=4 3832 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,1,0,0,0,0|0,0,0]=2 3833 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,1,0,0,0,0|0,0,0]=2 3834 B10R1.17 C=CCSc1ccccn1 62a_100000210623_100011216584 [1,1,0,0,0,0|1,0,0]=3 3835 B10R1.17 C=CCSc1ccccn1 62a_100011216584_100000210623 [1,1,0,0,0,0|1,0,0]=3 3836 B10R1.17 C=CCSc1cccnc1 62a_100000210063_100000210623 [1,1,0,0,0,0|1,0,0]=3 3837 B10R1.17 C=CCSc1cccnc1 62a_100000210623_100000210063 [1,1,0,0,0,0|1,0,0]=3 3838 B10R1.17 C=CCSc1cccnn1 62a_100000210623_100016991348 [1,1,0,0,0,0|2,0,0]=4 3839 B10R1.17 C=CCSc1cccnn1 62a_100016991348_100000210623 [1,1,0,0,0,0|2,0,0]=4 3840 B10R1.17 C=CCSc1ccncc1 62a_100000210623_100000728582 [1,1,0,0,0,0|1,0,0]=3 3841 B10R1.17 C=CCSc1ccncc1 62a_100000728582_100000210623 [1,1,0,0,0,0|1,0,0]=3 3842 B10R1.17 C=CCSc1ccncn1 62a_100000210623_100000703185 [1,1,0,0,0,0|2,0,0]=4 3843 B10R1.17 C=CCSc1ccncn1 62a_100000703185_100000210623 [1,1,0,0,0,0|2,0,0]=4 3844 B10R1.17 C=CCSc1ccnnc1 62a_100000210623_100000732662 [1,1,0,0,0,0|2,0,0]=4 3845 B10R1.17 C=CCSc1ccnnc1 62a_100000732662_100000210623 [1,1,0,0,0,0|2,0,0]=4 3846 B10R1.17 C=CCSc1cnccn1 62a_100000210623_100000211759 [1,1,0,0,0,0|2,0,0]=4 3847 B10R1.17 C=CCSc1cnccn1 62a_100000211759_100000210623 [1,1,0,0,0,0|2,0,0]=4 3848 B10R1.17 C=CCSc1cncnc1 62a_100000210623_100011206942 [1,1,0,0,0,0|2,0,0]=4 3849 B10R1.17 C=CCSc1cncnc1 62a_100011206942_100000210623 [1,1,0,0,0,0|2,0,0]=4 3850 B10R1.17 C=CCSc1ncccn1 62a_100000210623_100000211032 [1,1,0,0,0,0|2,0,0]=4 3851 B10R1.17 C=CCSc1ncccn1 62a_100000211032_100000210623 [1,1,0,0,0,0|2,0,0]=4 3852 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [1,1,0,0,0,0|1,0,1]=4 3853 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [1,1,0,0,0,0|0,0,2]=4 3854 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [1,1,0,0,0,0|0,0,2]=4 3855 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [1,1,0,0,0,0|0,0,2]=4 3856 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [1,1,0,0,0,0|0,0,2]=4 3857 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [1,1,0,0,0,0|0,0,2]=4 3858 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [1,1,0,0,0,0|0,0,2]=4 3859 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [1,1,0,0,0,0|0,0,2]=4 3860 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [1,1,0,0,0,0|0,0,2]=4 3861 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [1,1,0,0,0,0|0,0,2]=4 3862 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [1,1,0,0,0,0|0,0,2]=4 3863 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [1,1,0,0,0,0|0,0,2]=4 3864 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [1,1,0,0,0,0|0,0,2]=4 3865 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [1,1,0,0,0,0|0,0,2]=4 3866 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [1,1,0,0,0,0|0,0,2]=4 3867 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [1,1,0,0,0,0|0,0,2]=4 3868 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [1,1,0,0,0,0|0,0,2]=4 3869 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [1,1,0,0,0,0|0,0,2]=4 3870 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [1,1,0,0,0,0|0,0,2]=4 3871 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [1,1,0,0,0,0|0,0,2]=4 3872 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [1,1,0,0,0,0|0,0,2]=4 3873 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [1,1,0,0,0,0|0,0,2]=4 3874 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [1,1,0,0,0,0|1,0,1]=4 3875 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [1,1,0,0,0,0|0,0,2]=4 3876 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [1,1,0,0,0,0|0,0,2]=4 3877 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [1,1,0,0,0,0|0,0,2]=4 3878 B10R1.17 COCSc1ccccc1 62a_100000719477_100000766300 [1,1,0,0,0,0|1,0,1]=4 3879 B10R1.17 COCSc1ccccc1 62a_100000766300_100000041952 [1,1,0,0,0,0|1,0,1]=4 3880 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [1,1,0,0,0,0|0,0,2]=4 3881 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [1,1,0,0,0,0|0,0,2]=4 3882 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [1,1,0,0,0,0|1,0,1]=4 3883 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [1,1,0,0,0,0|1,0,1]=4 3884 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [1,1,0,0,0,0|1,0,1]=4 3885 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [1,1,0,0,0,0|1,0,1]=4 3886 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [1,1,0,0,0,0|1,0,1]=4 3887 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [1,1,0,0,0,0|1,0,1]=4 3888 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [1,1,0,0,0,0|1,0,1]=4 3889 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [1,1,0,0,0,0|1,0,1]=4 3890 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [1,1,0,0,0,0|1,0,1]=4 3891 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [1,1,0,0,0,0|1,0,1]=4 3892 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [1,1,0,0,0,0|1,0,1]=4 3893 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [1,1,0,0,0,0|1,0,1]=4 3894 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [1,1,0,0,0,0|1,0,1]=4 3895 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [1,1,0,0,0,0|1,0,1]=4 3896 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [1,1,0,0,0,0|1,0,1]=4 3897 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [1,1,0,0,0,0|1,0,1]=4 3898 B10R1.17 N#CCOc1ccccc1 7a_100000210340_100011215382 [1,1,0,0,0,0|1,0,1]=4 3899 B10R1.17 N#CCSc1ccccc1 62a_100000719477_100011215382 [1,1,0,0,0,0|1,0,1]=4 3900 B10R1.17 N#CCSc1ccccc1 62a_100011215382_100000041952 [1,1,0,0,0,0|1,0,1]=4 3901 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [1,1,0,0,0,0|1,0,0]=3 3902 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [1,1,0,0,0,0|1,0,0]=3 3903 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [1,1,0,0,0,0|1,0,0]=3 3904 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [1,1,0,0,0,0|2,0,0]=4 3905 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [1,1,0,0,0,0|2,0,0]=4 3906 B10R1.17 O=CCOc1ccncc1 34a_100000212176_200009817547 [1,1,0,0,0,0|2,0,0]=4 3907 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [1,1,0,0,0,0|1,0,0]=3 3908 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [1,1,0,0,0,0|1,0,0]=3 3909 B10R1.17 O=CCSc1ccccn1 62a_100011216584_200015260668 [1,1,0,0,0,0|2,0,0]=4 3910 B10R1.17 O=CCSc1ccccn1 62a_200015260668_100011216584 [1,1,0,0,0,0|2,0,0]=4 3911 B10R1.17 O=CCSc1cccnc1 62a_100000210063_200015260668 [1,1,0,0,0,0|2,0,0]=4 3912 B10R1.17 O=CCSc1cccnc1 62a_200015260668_100000210063 [1,1,0,0,0,0|2,0,0]=4 3913 B10R1.17 O=CCSc1ccncc1 62a_100000728582_200015260668 [1,1,0,0,0,0|2,0,0]=4 3914 B10R1.17 O=CCSc1ccncc1 62a_200015260668_100000728582 [1,1,0,0,0,0|2,0,0]=4 3915 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [1,1,0,0,0,0|1,0,1]=4 3916 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [1,1,0,0,0,0|1,0,1]=4 3917 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [1,1,0,0,0,0|1,0,1]=4 3918 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [1,1,0,0,0,0|1,0,1]=4 3919 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [1,1,0,0,0,0|1,0,1]=4 3920 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [1,1,0,0,0,0|0,0,2]=4 3921 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [1,1,0,0,0,0|0,0,2]=4 3922 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [1,1,0,0,0,0|0,0,2]=4 3923 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [1,1,0,0,0,0|0,0,2]=4 3924 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [1,1,0,0,0,0|0,0,2]=4 3925 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [1,1,0,0,0,0|0,0,2]=4 3926 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [1,1,0,0,0,0|1,0,1]=4 3927 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [1,1,0,0,0,0|1,0,1]=4 3928 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,1,0,0,0,0|0,0,2]=4 3929 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [1,1,0,0,0,0|1,0,1]=4 3930 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,1,0,0,0,0|0,0,1]=3 3931 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [1,1,0,0,0,0|1,0,1]=4 3932 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [1,1,0,0,0,0|1,0,1]=4 3933 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,1,0,0,0,0|1,0,1]=4 3934 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,1,0,0,0,0|1,0,1]=4 3935 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [1,1,0,0,0,0|1,0,1]=4 3936 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,1,0,0,0,0|1,0,1]=4 3937 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,1,0,0,0,0|1,0,1]=4 3938 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,1,0,0,0,0|1,0,1]=4 3939 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,1,0,0,0,0|1,0,1]=4 3940 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,1,0,0,0,0|1,0,1]=4 3941 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,1,0,0,0,0|1,0,1]=4 3942 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,1,0,0,0,0|1,0,1]=4 3943 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,1,0,0,0,0|1,0,1]=4 3944 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,1,0,0,0,0|1,0,1]=4 3945 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,1,0,0,0,0|1,0,1]=4 3946 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,1,0,0,0,0|1,0,1]=4 3947 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [1,1,0,0,0,0|1,0,1]=4 3948 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [1,1,0,0,0,0|1,0,1]=4 3949 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,1,0,0,0,0|1,0,1]=4 3950 B10R1.2 C=Cc1cccc(=O)n1C 271570a_100011290941_100000726605 [1,1,0,0,0,0|2,0,0]=4 3951 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,1,0,0,0,0|1,0,0]=3 3952 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,1,0,0,0,0|1,0,0]=3 3953 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,1,0,0,0,0|1,0,0]=3 3954 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,1,0,0,0,0|1,0,0]=3 3955 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,1,0,0,0,0|1,0,0]=3 3956 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,1,0,0,0,0|1,0,0]=3 3957 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,1,0,0,0,0|1,0,0]=3 3958 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,1,0,0,0,0|1,0,0]=3 3959 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,1,0,0,0,0|1,0,0]=3 3960 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,1,0,0,0,0|1,0,0]=3 3961 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,1,0,0,0,0|1,0,0]=3 3962 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,1,0,0,0,0|1,0,0]=3 3963 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,1,0,0,0,0|1,0,0]=3 3964 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,1,0,0,0,0|1,0,0]=3 3965 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,1,0,0,0,0|1,0,0]=3 3966 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,1,0,0,0,0|1,0,0]=3 3967 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,1,0,0,0,0|1,0,0]=3 3968 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,1,0,0,0,0|1,0,0]=3 3969 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,1,0,0,0,0|1,0,0]=3 3970 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,1,0,0,0,0|1,0,0]=3 3971 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,1,0,0,0,0|1,0,0]=3 3972 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,1,0,0,0,0|1,0,0]=3 3973 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,1,0,0,0,0|1,0,0]=3 3974 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,1,0,0,0,0|1,0,0]=3 3975 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,1,0,0,0,0|0,0,0]=2 3976 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,1,0,0,0,0|0,0,0]=2 3977 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,1,0,0,0,0|0,0,0]=2 3978 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,1,0,0,0,0|0,0,0]=2 3979 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,1,0,0,0,0|0,0,0]=2 3980 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,1,0,0,0,0|0,0,0]=2 3981 B10R1.2 C=Cc1cccn(c1=O)C 271570a_100011290941_100000687173 [1,1,0,0,0,0|1,0,1]=4 3982 B10R1.2 C=Cc1ccnc(c1C)C 271570a_100011290941_100009846815 [1,1,0,0,0,0|2,0,0]=4 3983 B10R1.2 C=Cc1ccnc(c1C)Cl 271570a_100011290941_100000047055 [1,1,0,0,0,0|2,0,0]=4 3984 B10R1.2 C=Cc1ccnc(c1C)F 271570a_100011290941_100010006593 [1,1,0,0,0,0|2,0,0]=4 3985 B10R1.2 C=Cc1ccnc(c1C)N 271570a_100011290941_100009865460 [1,1,0,0,0,0|2,0,0]=4 3986 B10R1.2 C=Cc1ccnc(c1C)O 271570a_100011290941_100009858498 [1,1,0,0,0,0|2,0,0]=4 3987 B10R1.2 C=Cc1ccnc(c1Cl)C 271570a_100011290941_100000698670 [1,1,0,0,0,0|2,0,0]=4 3988 B10R1.2 C=Cc1ccnc(c1Cl)Cl 271570a_100011290941_100010246212 [1,1,0,0,0,0|2,0,0]=4 3989 B10R1.2 C=Cc1ccnc(c1Cl)F 271570a_100011290941_100010067886 [1,1,0,0,0,0|2,0,0]=4 3990 B10R1.2 C=Cc1ccnc(c1Cl)N 271570a_100011290941_100010735111 [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.2 C=Cc1ccnc(c1F)Br 271570a_100011290941_200015269031 [1,1,0,0,0,0|2,0,0]=4 3992 B10R1.2 C=Cc1ccnc(c1F)C 271570a_100011290941_100009849794 [1,1,0,0,0,0|2,0,0]=4 3993 B10R1.2 C=Cc1ccnc(c1F)Cl 271570a_100011290941_100010150473 [1,1,0,0,0,0|2,0,0]=4 3994 B10R1.2 C=Cc1ccnc(c1F)F 271570a_100011290941_100010214882 [1,1,0,0,0,0|2,0,0]=4 3995 B10R1.2 C=Cc1ccnc(c1F)N 271570a_100011290941_100010077785 [1,1,0,0,0,0|2,0,0]=4 3996 B10R1.2 C=Cc1ccnc(c1N)C 271570a_100011290941_100009885578 [1,1,0,0,0,0|2,0,0]=4 3997 B10R1.2 C=Cc1ccnc(c1N)N 271570a_100011290941_100000124095 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.2 C=Cc1cncc(c1C)Br 271570a_100011290941_100010109657 [1,1,0,0,0,0|2,0,0]=4 3999 B10R1.2 C=Cc1cncc(c1C)C 271570a_100011290941_100009864703 [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.2 C=Cc1cncc(c1C)F 271570a_100011290941_100009881546 [1,1,0,0,0,0|2,0,0]=4 4001 B10R1.2 C=Cc1cncc(c1C)N 271570a_100011290941_100011998293 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.2 C=Cc1cncc(c1N)Br 271570a_100011290941_100011290786 [1,1,0,0,0,0|2,0,0]=4 4003 B10R1.2 C=Cc1cncc(c1N)C 271570a_100011290941_100009818025 [1,1,0,0,0,0|2,0,0]=4 4004 B10R1.2 C=Cc1cncc(c1N)Cl 271570a_100011290941_100000684942 [1,1,0,0,0,0|2,0,0]=4 4005 B10R1.2 C=Cc1cncc(c1N)F 271570a_100011290941_100009880649 [1,1,0,0,0,0|2,0,0]=4 4006 B10R1.2 C=Cc1cncc(c1N)N 271570a_100011290941_100000694774 [1,1,0,0,0,0|2,0,0]=4 4007 B10R1.2 C=Cc1nccc(c1C)C 271570a_100011290941_100009847204 [1,1,0,0,0,0|2,0,0]=4 4008 B10R1.2 C=Cc1nccc(c1C)F 271570a_100011290941_100009846374 [1,1,0,0,0,0|2,0,0]=4 4009 B10R1.2 C=Cc1nccc(c1C)N 271570a_100011290941_100009980296 [1,1,0,0,0,0|2,0,0]=4 4010 B10R1.2 C=Cc1nccc(c1F)C 271570a_100011290941_100009817629 [1,1,0,0,0,0|2,0,0]=4 4011 B10R1.2 C=Cc1nccc(c1F)N 271570a_100011290941_100015205195 [1,1,0,0,0,0|2,0,0]=4 4012 B10R1.2 C=Cc1nccc(c1F)O 271570a_100011290941_100009876375 [1,1,0,0,0,0|2,0,0]=4 4013 B10R1.2 C=Cc1nccc(c1N)C 271570a_100011290941_100000763560 [1,1,0,0,0,0|2,0,0]=4 4014 B10R1.2 C=Cc1nccc(c1N)N 271570a_100011290941_100000085203 [1,1,0,0,0,0|2,0,0]=4 4015 B10R1.2 C=Cc1nccc(c1N)O 271570a_100011290941_100000128729 [1,1,0,0,0,0|2,0,0]=4 4016 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [1,1,0,0,0,0|1,0,0]=3 4017 B10R1.2 C=Cc1nccc(c1O)F 271570a_100011290941_100009867227 [1,1,0,0,0,0|1,0,0]=3 4018 B10R1.2 CCc1cccc(c1O)C 271570a_203496583355_100000036235 [1,1,0,0,0,0|0,0,1]=3 4019 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,1,0,0,0,0|0,0,1]=3 4020 B10R1.2 CNc1cccc(c1O)Br 34a_100011934915_200000210301 [1,1,0,0,0,0|1,0,1]=4 4021 B10R1.2 CNc1cccc(c1O)C 34a_100000756359_200000210301 [1,1,0,0,0,0|1,0,1]=4 4022 B10R1.2 CNc1cccc(c1O)Cl 34a_100000754742_200000210301 [1,1,0,0,0,0|1,0,1]=4 4023 B10R1.2 CNc1cccc(c1O)F 34a_100011934987_200000210301 [1,1,0,0,0,0|1,0,1]=4 4024 B10R1.2 COc1cccc(c1O)Br 271570a_203496583355_100010131421 [1,1,0,0,0,0|1,0,1]=4 4025 B10R1.2 COc1cccc(c1O)F 271570a_203496583355_100000041735 [1,1,0,0,0,0|1,0,1]=4 4026 B10R1.2 COc1cccc(c1O)N 271570a_203496583355_100000703447 [1,1,0,0,0,0|1,0,1]=4 4027 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,1,0,0,0,0|1,0,1]=4 4028 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,1,0,0,0,0|1,0,1]=4 4029 B10R1.2 CSc1cccc(c1O)Br 62a_100010084509_200000210301 [1,1,0,0,0,0|1,0,1]=4 4030 B10R1.2 CSc1cccc(c1O)Br 62a_200000210301_100010084509 [1,1,0,0,0,0|1,0,1]=4 4031 B10R1.2 CSc1cccc(c1O)C 62a_100009817157_200000210301 [1,1,0,0,0,0|1,0,1]=4 4032 B10R1.2 CSc1cccc(c1O)C 62a_200000210301_100009817157 [1,1,0,0,0,0|1,0,1]=4 4033 B10R1.2 CSc1cccc(c1O)Cl 62a_100010202889_200000210301 [1,1,0,0,0,0|1,0,1]=4 4034 B10R1.2 CSc1cccc(c1O)Cl 62a_200000210301_100010202889 [1,1,0,0,0,0|1,0,1]=4 4035 B10R1.2 CSc1cccc(c1O)F 62a_100009813666_200000210301 [1,1,0,0,0,0|1,0,1]=4 4036 B10R1.2 CSc1cccc(c1O)F 62a_200000210301_100009813666 [1,1,0,0,0,0|1,0,1]=4 4037 B10R1.2 CSc1cccc(c1O)N 62a_100011934915_200000210301 [1,1,0,0,0,0|1,0,1]=4 4038 B10R1.2 CSc1cccc(c1O)N 62a_200000210301_100010084371 [1,1,0,0,0,0|1,0,1]=4 4039 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,1,0,0,0,0|1,0,1]=4 4040 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,1,0,0,0,0|2,0,0]=4 4041 B10R1.2 Cc1c(cccc1CN)O 271570a_203496583355_100000724210 [1,1,0,0,0,0|2,0,0]=4 4042 B10R1.2 Cc1c(cccc1CO)O 271570a_203496583355_100000694458 [1,1,0,0,0,0|2,0,0]=4 4043 B10R1.2 Cc1cccc(c1O)C#N 271570a_203496583355_100011934862 [1,1,0,0,0,0|1,0,1]=4 4044 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,1,0,0,0,0|1,0,0]=3 4045 B10R1.2 Cc1cccc(c1O)N[13CH3] 34a_100000756359_200025704644 [1,1,0,0,0,0|1,0,1]=4 4046 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_100009817157_200025704644 [1,1,0,0,0,0|1,0,1]=4 4047 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_200025704644_100009817157 [1,1,0,0,0,0|1,0,1]=4 4048 B10R1.2 N#Cc1cccc(c1O)Br 271570a_203496583355_100000703783 [1,1,0,0,0,0|1,0,1]=4 4049 B10R1.2 N#Cc1cccc(c1O)Cl 271570a_203496583355_100010134094 [1,1,0,0,0,0|1,0,1]=4 4050 B10R1.2 N#Cc1cccc(c1O)F 271570a_203496583355_100011219237 [1,1,0,0,0,0|1,0,1]=4 4051 B10R1.2 N#Cc1cccc(c1O)N 271570a_203496583355_100009877206 [1,1,0,0,0,0|1,0,1]=4 4052 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009817103 [1,1,0,0,0,0|1,0,1]=4 4053 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009818990 [1,1,0,0,0,0|1,0,1]=4 4054 B10R1.2 NCc1cccc(c1F)O 271570a_203496583355_100015189953 [1,1,0,0,0,0|2,0,0]=4 4055 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,1,0,0,0,0|2,0,0]=4 4056 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [1,1,0,0,0,0|2,0,0]=4 4057 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,1,0,0,0,0|2,0,0]=4 4058 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,1,0,0,0,0|1,0,0]=3 4059 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,1,0,0,0,0|1,0,0]=3 4060 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,1,0,0,0,0|1,0,0]=3 4061 B10R1.2 O=Cc1ccnc(c1O)F 271570a_203496583355_100009856171 [1,1,0,0,0,0|2,0,0]=4 4062 B10R1.2 OCc1cccc(c1Br)O 271570a_203496583355_100010240205 [1,1,0,0,0,0|2,0,0]=4 4063 B10R1.2 OCc1cccc(c1F)O 271570a_203496583355_100011935076 [1,1,0,0,0,0|2,0,0]=4 4064 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [1,1,0,0,0,0|1,0,0]=3 4065 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [1,1,0,0,0,0|1,0,0]=3 4066 B10R1.2 [13CH3]Nc1cccc(c1O)Br 34a_100011934915_200025704644 [1,1,0,0,0,0|1,0,1]=4 4067 B10R1.2 [13CH3]Nc1cccc(c1O)Cl 34a_100000754742_200025704644 [1,1,0,0,0,0|1,0,1]=4 4068 B10R1.2 [13CH3]Nc1cccc(c1O)F 34a_100011934987_200025704644 [1,1,0,0,0,0|1,0,1]=4 4069 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_100010084509_200025704644 [1,1,0,0,0,0|1,0,1]=4 4070 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_200025704644_100010084509 [1,1,0,0,0,0|1,0,1]=4 4071 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_100010202889_200025704644 [1,1,0,0,0,0|1,0,1]=4 4072 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_200025704644_100010202889 [1,1,0,0,0,0|1,0,1]=4 4073 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_100009813666_200025704644 [1,1,0,0,0,0|1,0,1]=4 4074 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_200025704644_100009813666 [1,1,0,0,0,0|1,0,1]=4 4075 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_100011934915_200025704644 [1,1,0,0,0,0|1,0,1]=4 4076 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_200025704644_100010084371 [1,1,0,0,0,0|1,0,1]=4 4077 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,1,0,0,0,0|1,0,1]=4 4078 B10R1.20 C#Cc1ccccc1OC 34a_200011470546_200000210301 [1,1,0,0,0,0|0,0,2]=4 4079 B10R1.20 C#Cc1ccccc1OC 7a_200011470546_200000210301 [1,1,0,0,0,0|0,0,2]=4 4080 B10R1.20 C#Cc1ccccc1O[13CH3] 34a_200011470546_200025704644 [1,1,0,0,0,0|0,0,2]=4 4081 B10R1.20 C#Cc1ccccc1O[13CH3] 7a_200011470546_200025704644 [1,1,0,0,0,0|0,0,2]=4 4082 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [1,1,0,0,0,0|1,0,0]=3 4083 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [1,1,0,0,0,0|0,0,1]=3 4084 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [1,1,0,0,0,0|1,0,0]=3 4085 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [1,1,0,0,0,0|1,0,0]=3 4086 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [1,1,0,0,0,0|0,0,0]=2 4087 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [1,1,0,0,0,0|1,0,0]=3 4088 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [1,1,0,0,0,0|1,0,0]=3 4089 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [1,1,0,0,0,0|1,0,0]=3 4090 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [1,1,0,0,0,0|1,0,0]=3 4091 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [1,1,0,0,0,0|0,0,0]=2 4092 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [1,1,0,0,0,0|0,1,0]=3 4093 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [1,1,0,0,0,0|0,1,0]=3 4094 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [1,1,0,0,0,0|0,1,0]=3 4095 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [1,1,0,0,0,0|0,1,0]=3 4096 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [1,1,0,0,0,0|0,1,0]=3 4097 B10R1.20 C=Cc1cccnc1C#N 271570a_100011290941_100000685805 [1,1,0,0,0,0|2,0,0]=4 4098 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [1,1,0,0,0,0|1,0,1]=4 4099 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [1,1,0,0,0,0|2,0,0]=4 4100 B10R1.20 C=Cc1cccnc1CN 271570a_100011290941_100020591323 [1,1,0,0,0,0|2,0,0]=4 4101 B10R1.20 C=Cc1cccnc1CO 271570a_100011290941_100011996772 [1,1,0,0,0,0|1,0,0]=3 4102 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [1,1,0,0,0,0|2,0,0]=4 4103 B10R1.20 C=Cc1cccnc1NN 271570a_100011290941_100011464834 [1,1,0,0,0,0|2,0,0]=4 4104 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [1,1,0,0,0,0|1,0,0]=3 4105 B10R1.20 C=Cc1cccnc1SC 271570a_100011290941_100011465278 [1,1,0,0,0,0|1,1,0]=4 4106 B10R1.20 C=Cc1ccncc1C#N 271570a_100011290941_100000687039 [1,1,0,0,0,0|2,0,0]=4 4107 B10R1.20 C=Cc1ccncc1C=O 271570a_100011290941_100000050567 [1,1,0,0,0,0|1,0,1]=4 4108 B10R1.20 C=Cc1ccncc1CC 271570a_100011290941_100025704421 [1,1,0,0,0,0|2,0,0]=4 4109 B10R1.20 C=Cc1ccncc1CO 271570a_100011290941_100000117392 [1,1,0,0,0,0|1,0,0]=3 4110 B10R1.20 C=Cc1ccncc1OC 271570a_100011290941_100016988167 [1,1,0,0,0,0|1,0,0]=3 4111 B10R1.20 C=Cc1cnccc1C#N 271570a_100011290941_100000684818 [1,1,0,0,0,0|2,0,0]=4 4112 B10R1.20 C=Cc1cnccc1C=O 271570a_100011290941_100011934409 [1,1,0,0,0,0|1,0,1]=4 4113 B10R1.20 C=Cc1cnccc1CC 271570a_100011290941_100009819861 [1,1,0,0,0,0|2,0,0]=4 4114 B10R1.20 C=Cc1cnccc1CN 271570a_100011290941_100020640021 [1,1,0,0,0,0|2,0,0]=4 4115 B10R1.20 C=Cc1cnccc1CO 271570a_100011290941_100009873359 [1,1,0,0,0,0|1,0,0]=3 4116 B10R1.20 C=Cc1cnccc1NC 271570a_100011290941_100010069531 [1,1,0,0,0,0|2,0,0]=4 4117 B10R1.20 C=Cc1cnccc1NN 271570a_100011290941_100013404636 [1,1,0,0,0,0|2,0,0]=4 4118 B10R1.20 C=Cc1cnccc1OC 271570a_100011290941_100011997281 [1,1,0,0,0,0|1,0,0]=3 4119 B10R1.20 C=Cc1cncnc1OC 271570a_100011290941_100000719902 [1,1,0,0,0,0|2,0,0]=4 4120 B10R1.20 C=Cc1ncccc1C#N 271570a_100011290941_100000211984 [1,1,0,0,0,0|2,0,0]=4 4121 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [1,1,0,0,0,0|1,0,1]=4 4122 B10R1.20 C=Cc1ncccc1CN 271570a_100011290941_100015189234 [1,1,0,0,0,0|2,0,0]=4 4123 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [1,1,0,0,0,0|1,0,0]=3 4124 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [1,1,0,0,0,0|2,0,0]=4 4125 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [1,1,0,0,0,0|1,0,0]=3 4126 B10R1.20 C=Cc1nccnc1CO 271570a_100011290941_100000057004 [1,1,0,0,0,0|2,0,0]=4 4127 B10R1.20 C=Cc1nccnc1OC 271570a_100011290941_100000749998 [1,1,0,0,0,0|2,0,0]=4 4128 B10R1.20 C=Cc1ncncc1OC 271570a_100011290941_100012001275 [1,1,0,0,0,0|2,0,0]=4 4129 B10R1.20 CCc1ccccc1NC 2230a_100000212081_200000210301 [1,1,0,0,0,0|1,0,1]=4 4130 B10R1.20 CCc1ccccc1NC 34a_100000212081_200000210301 [1,1,0,0,0,0|1,0,1]=4 4131 B10R1.20 CCc1ccccc1NC 7a_100000212081_200000210301 [1,1,0,0,0,0|1,0,1]=4 4132 B10R1.20 CCc1ccccc1N[13CH3] 2230a_100000212081_200025704644 [1,1,0,0,0,0|1,0,1]=4 4133 B10R1.20 CCc1ccccc1N[13CH3] 34a_100000212081_200025704644 [1,1,0,0,0,0|1,0,1]=4 4134 B10R1.20 CCc1ccccc1N[13CH3] 7a_100000212081_200025704644 [1,1,0,0,0,0|1,0,1]=4 4135 B10R1.20 CCc1ccccc1OC 34a_100000210936_200000210301 [1,1,0,0,0,0|0,0,1]=3 4136 B10R1.20 CCc1ccccc1OC 7a_100000210936_200000210301 [1,1,0,0,0,0|0,0,1]=3 4137 B10R1.20 CCc1ccccc1O[13CH3] 34a_100000210936_200025704644 [1,1,0,0,0,0|0,0,1]=3 4138 B10R1.20 CCc1ccccc1O[13CH3] 7a_100000210936_200025704644 [1,1,0,0,0,0|0,0,1]=3 4139 B10R1.20 CCc1ccccc1SC 62a_100011215823_200000210301 [1,1,0,0,0,0|0,1,1]=4 4140 B10R1.20 CCc1ccccc1SC 62a_200000210301_100011215823 [1,1,0,0,0,0|0,1,1]=4 4141 B10R1.20 CCc1ccccc1S[13CH3] 62a_100011215823_200025704644 [1,1,0,0,0,0|0,1,1]=4 4142 B10R1.20 CCc1ccccc1S[13CH3] 62a_200025704644_100011215823 [1,1,0,0,0,0|0,1,1]=4 4143 B10R1.20 CNc1ccccc1CO 34a_100000212039_200000210301 [1,1,0,0,0,0|1,0,1]=4 4144 B10R1.20 CNc1ccccc1OC 34a_100000033821_200000210301 [1,1,0,0,0,0|1,0,1]=4 4145 B10R1.20 CNc1ccccc1OC 34a_100000210025_200000210301 [1,1,0,0,0,0|1,0,1]=4 4146 B10R1.20 CNc1ccccc1O[13CH3] 34a_100000033821_200025704644 [1,1,0,0,0,0|1,0,1]=4 4147 B10R1.20 COc1ccccc1C#N 34a_100000211048_200000210301 [1,1,0,0,0,0|1,0,1]=4 4148 B10R1.20 COc1ccccc1C#N 7a_100000211048_200000210301 [1,1,0,0,0,0|1,0,1]=4 4149 B10R1.20 COc1ccccc1CN 34a_100000185550_200000210301 [1,1,0,0,0,0|1,0,0]=3 4150 B10R1.20 COc1ccccc1CO 34a_100011216872_200000210301 [1,1,0,0,0,0|1,0,0]=3 4151 B10R1.20 COc1ccccc1N[13CH3] 34a_100000210025_200025704644 [1,1,0,0,0,0|1,0,1]=4 4152 B10R1.20 COc1ccccc1OC 34a_100000210385_200000210301 [1,1,0,0,0,0|1,0,1]=4 4153 B10R1.20 COc1ccccc1O[13CH3] 34a_100000210385_200025704644 [1,1,0,0,0,0|1,0,1]=4 4154 B10R1.20 COc1ccccc1SC 34a_100011216402_200000210301 [1,1,0,0,0,0|1,0,1]=4 4155 B10R1.20 COc1ccccc1SC 62a_100000210334_200000210301 [1,1,0,0,0,0|1,0,1]=4 4156 B10R1.20 COc1ccccc1SC 62a_200000210301_100000210334 [1,1,0,0,0,0|1,0,1]=4 4157 B10R1.20 COc1ccccc1S[13CH3] 62a_100000210334_200025704644 [1,1,0,0,0,0|1,0,1]=4 4158 B10R1.20 COc1ccccc1S[13CH3] 62a_200025704644_100000210334 [1,1,0,0,0,0|1,0,1]=4 4159 B10R1.20 COc1cccnc1CBr 34a_200020655725_200000210301 [1,1,0,0,0,0|2,0,0]=4 4160 B10R1.20 COc1cccnc1CBr 7a_200020655725_200000210301 [1,1,0,0,0,0|2,0,0]=4 4161 B10R1.20 COc1cccnc1CO 34a_100000731849_200000210301 [1,1,0,0,0,0|2,0,0]=4 4162 B10R1.20 COc1cnccc1CO 34a_100000078615_200000210301 [1,1,0,0,0,0|2,0,0]=4 4163 B10R1.20 CSc1ccccc1C=O 62a_100000210073_200000210301 [1,1,0,0,0,0|1,1,0]=4 4164 B10R1.20 CSc1ccccc1C=O 62a_200000210301_100000210073 [1,1,0,0,0,0|1,1,0]=4 4165 B10R1.20 CSc1ccccc1CN 62a_100000689332_200000210301 [1,1,0,0,0,0|1,1,0]=4 4166 B10R1.20 CSc1ccccc1CN 62a_200000210301_100000689332 [1,1,0,0,0,0|1,1,0]=4 4167 B10R1.20 CSc1ccccc1CO 62a_100000187465_200000210301 [1,1,0,0,0,0|1,0,1]=4 4168 B10R1.20 CSc1ccccc1CO 62a_200000210301_100000187465 [1,1,0,0,0,0|1,0,1]=4 4169 B10R1.20 CSc1ccccc1O[13CH3] 34a_100011216402_200025704644 [1,1,0,0,0,0|1,0,1]=4 4170 B10R1.20 [13CH3]Nc1ccccc1CO 34a_100000212039_200025704644 [1,1,0,0,0,0|1,0,1]=4 4171 B10R1.20 [13CH3]Oc1ccccc1C#N 34a_100000211048_200025704644 [1,1,0,0,0,0|1,0,1]=4 4172 B10R1.20 [13CH3]Oc1ccccc1C#N 7a_100000211048_200025704644 [1,1,0,0,0,0|1,0,1]=4 4173 B10R1.20 [13CH3]Oc1ccccc1CN 34a_100000185550_200025704644 [1,1,0,0,0,0|1,0,0]=3 4174 B10R1.20 [13CH3]Oc1ccccc1CO 34a_100011216872_200025704644 [1,1,0,0,0,0|1,0,0]=3 4175 B10R1.20 [13CH3]Oc1cccnc1CBr 34a_200020655725_200025704644 [1,1,0,0,0,0|2,0,0]=4 4176 B10R1.20 [13CH3]Oc1cccnc1CBr 7a_200020655725_200025704644 [1,1,0,0,0,0|2,0,0]=4 4177 B10R1.20 [13CH3]Oc1cccnc1CO 34a_100000731849_200025704644 [1,1,0,0,0,0|2,0,0]=4 4178 B10R1.20 [13CH3]Oc1cnccc1CO 34a_100000078615_200025704644 [1,1,0,0,0,0|2,0,0]=4 4179 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_100000210073_200025704644 [1,1,0,0,0,0|1,1,0]=4 4180 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_200025704644_100000210073 [1,1,0,0,0,0|1,1,0]=4 4181 B10R1.20 [13CH3]Sc1ccccc1CN 62a_100000689332_200025704644 [1,1,0,0,0,0|1,1,0]=4 4182 B10R1.20 [13CH3]Sc1ccccc1CN 62a_200025704644_100000689332 [1,1,0,0,0,0|1,1,0]=4 4183 B10R1.20 [13CH3]Sc1ccccc1CO 62a_100000187465_200025704644 [1,1,0,0,0,0|1,0,1]=4 4184 B10R1.20 [13CH3]Sc1ccccc1CO 62a_200025704644_100000187465 [1,1,0,0,0,0|1,0,1]=4 4185 B10R1.25 C=Cc1c[nH]c(=O)cc1F 271570a_100011290941_100015631685 [1,1,0,0,0,0|2,0,0]=4 4186 B10R1.25 C=Cc1cc[n+](cc1C)[O-] 271570a_100011290941_100000074940 [1,1,0,0,0,0|2,0,0]=4 4187 B10R1.25 C=Cc1ccc(=O)[nH]c1N 271570a_100011290941_100009884077 [1,1,0,0,0,0|2,0,0]=4 4188 B10R1.25 C=Cc1ccc(c[n+]1[O-])C 271570a_100011290941_100009819918 [1,1,0,0,0,0|1,0,1]=4 4189 B10R1.25 C=Cc1ccc(c[n+]1[O-])F 271570a_100011290941_100009817261 [1,1,0,0,0,0|1,0,1]=4 4190 B10R1.25 C=Cc1ccc(cc1Br)Br 271570a_100011290941_100011484698 [1,1,0,0,0,0|1,0,0]=3 4191 B10R1.25 C=Cc1ccc(cc1Br)C 271570a_100011290941_100009813563 [1,1,0,0,0,0|1,0,0]=3 4192 B10R1.25 C=Cc1ccc(cc1Br)Cl 271570a_100011290941_100011219703 [1,1,0,0,0,0|1,0,0]=3 4193 B10R1.25 C=Cc1ccc(cc1Br)F 271570a_100011290941_100011217111 [1,1,0,0,0,0|1,0,0]=3 4194 B10R1.25 C=Cc1ccc(cc1Br)N 271570a_100011290941_100000750458 [1,1,0,0,0,0|1,0,0]=3 4195 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [1,1,0,0,0,0|1,0,0]=3 4196 B10R1.25 C=Cc1ccc(cc1C)Br 271570a_100011290941_100000701812 [1,1,0,0,0,0|1,0,0]=3 4197 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [1,1,0,0,0,0|1,0,0]=3 4198 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [1,1,0,0,0,0|1,0,0]=3 4199 B10R1.25 C=Cc1ccc(cc1C)F 271570a_100011290941_100011205405 [1,1,0,0,0,0|1,0,0]=3 4200 B10R1.25 C=Cc1ccc(cc1C)N 271570a_100011290941_100000210723 [1,1,0,0,0,0|1,0,0]=3 4201 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [1,1,0,0,0,0|1,0,0]=3 4202 B10R1.25 C=Cc1ccc(cc1Cl)Br 271570a_100011290941_100011216062 [1,1,0,0,0,0|1,0,0]=3 4203 B10R1.25 C=Cc1ccc(cc1Cl)C 271570a_100011290941_100011263221 [1,1,0,0,0,0|1,0,0]=3 4204 B10R1.25 C=Cc1ccc(cc1Cl)Cl 271570a_100011290941_100000699841 [1,1,0,0,0,0|1,0,0]=3 4205 B10R1.25 C=Cc1ccc(cc1Cl)F 271570a_100011290941_100000733362 [1,1,0,0,0,0|1,0,0]=3 4206 B10R1.25 C=Cc1ccc(cc1Cl)N 271570a_100011290941_100000761885 [1,1,0,0,0,0|1,0,0]=3 4207 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [1,1,0,0,0,0|1,0,0]=3 4208 B10R1.25 C=Cc1ccc(cc1F)Br 271570a_100011290941_100009814013 [1,1,0,0,0,0|1,0,0]=3 4209 B10R1.25 C=Cc1ccc(cc1F)C 271570a_100011290941_100011216119 [1,1,0,0,0,0|1,0,0]=3 4210 B10R1.25 C=Cc1ccc(cc1F)Cl 271570a_100011290941_100011216042 [1,1,0,0,0,0|1,0,0]=3 4211 B10R1.25 C=Cc1ccc(cc1F)F 271570a_100011290941_100000750030 [1,1,0,0,0,0|1,0,0]=3 4212 B10R1.25 C=Cc1ccc(cc1F)N 271570a_100011290941_100011356925 [1,1,0,0,0,0|1,0,0]=3 4213 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [1,1,0,0,0,0|1,0,0]=3 4214 B10R1.25 C=Cc1ccc(cc1N)Br 271570a_100011290941_100000743836 [1,1,0,0,0,0|1,0,0]=3 4215 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [1,1,0,0,0,0|1,0,0]=3 4216 B10R1.25 C=Cc1ccc(cc1N)Cl 271570a_100011290941_100000761886 [1,1,0,0,0,0|1,0,0]=3 4217 B10R1.25 C=Cc1ccc(cc1N)F 271570a_100011290941_100011218093 [1,1,0,0,0,0|1,0,0]=3 4218 B10R1.25 C=Cc1ccc(cc1N)N 271570a_100011290941_200012175722 [1,1,0,0,0,0|1,0,0]=3 4219 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [1,1,0,0,0,0|1,0,0]=3 4220 B10R1.25 C=Cc1ccc(cc1O)Br 271570a_100011290941_100012344904 [1,1,0,0,0,0|0,0,0]=2 4221 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [1,1,0,0,0,0|0,0,0]=2 4222 B10R1.25 C=Cc1ccc(cc1O)Cl 271570a_100011290941_100000050036 [1,1,0,0,0,0|0,0,0]=2 4223 B10R1.25 C=Cc1ccc(cc1O)F 271570a_100011290941_100000690578 [1,1,0,0,0,0|0,0,0]=2 4224 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,1,0,0,0,0|0,0,0]=2 4225 B10R1.25 C=Cc1ccc(nc1Br)N 271570a_100011290941_100010734177 [1,1,0,0,0,0|2,0,0]=4 4226 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [1,1,0,0,0,0|2,0,0]=4 4227 B10R1.25 C=Cc1ccc(nc1C)Cl 271570a_100011290941_100000062408 [1,1,0,0,0,0|2,0,0]=4 4228 B10R1.25 C=Cc1ccc(nc1C)F 271570a_100011290941_100000688911 [1,1,0,0,0,0|2,0,0]=4 4229 B10R1.25 C=Cc1ccc(nc1C)N 271570a_100011290941_100000013003 [1,1,0,0,0,0|2,0,0]=4 4230 B10R1.25 C=Cc1ccc(nc1C)O 271570a_100011290941_100000691680 [1,1,0,0,0,0|2,0,0]=4 4231 B10R1.25 C=Cc1ccc(nc1Cl)Br 271570a_100011290941_100010246183 [1,1,0,0,0,0|2,0,0]=4 4232 B10R1.25 C=Cc1ccc(nc1Cl)N 271570a_100011290941_100010270343 [1,1,0,0,0,0|2,0,0]=4 4233 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [1,1,0,0,0,0|2,0,0]=4 4234 B10R1.25 C=Cc1ccc(nc1F)Cl 271570a_100011290941_100010168078 [1,1,0,0,0,0|2,0,0]=4 4235 B10R1.25 C=Cc1ccc(nc1F)F 271570a_100011290941_100000070099 [1,1,0,0,0,0|2,0,0]=4 4236 B10R1.25 C=Cc1ccc(nc1F)N 271570a_100011290941_100009882772 [1,1,0,0,0,0|2,0,0]=4 4237 B10R1.25 C=Cc1ccc(nc1F)O 271570a_100011290941_100009879308 [1,1,0,0,0,0|2,0,0]=4 4238 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [1,1,0,0,0,0|2,0,0]=4 4239 B10R1.25 C=Cc1ccc(nc1N)Cl 271570a_100011290941_100010171640 [1,1,0,0,0,0|2,0,0]=4 4240 B10R1.25 C=Cc1ccc(nc1N)F 271570a_100011290941_100009854977 [1,1,0,0,0,0|2,0,0]=4 4241 B10R1.25 C=Cc1ccc(nc1N)N 271570a_100011290941_100011356871 [1,1,0,0,0,0|2,0,0]=4 4242 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [1,1,0,0,0,0|1,0,0]=3 4243 B10R1.25 C=Cc1cnc(cc1Br)F 271570a_100011290941_100015451857 [1,1,0,0,0,0|2,0,0]=4 4244 B10R1.25 C=Cc1cnc(cc1Br)N 271570a_100011290941_100010074611 [1,1,0,0,0,0|2,0,0]=4 4245 B10R1.25 C=Cc1cnc(cc1C)Br 271570a_100011290941_100009816104 [1,1,0,0,0,0|2,0,0]=4 4246 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [1,1,0,0,0,0|2,0,0]=4 4247 B10R1.25 C=Cc1cnc(cc1C)Cl 271570a_100011290941_100010172789 [1,1,0,0,0,0|2,0,0]=4 4248 B10R1.25 C=Cc1cnc(cc1C)F 271570a_100011290941_100009820716 [1,1,0,0,0,0|2,0,0]=4 4249 B10R1.25 C=Cc1cnc(cc1C)N 271570a_100011290941_100000050067 [1,1,0,0,0,0|2,0,0]=4 4250 B10R1.25 C=Cc1cnc(cc1C)O 271570a_100011290941_100010114363 [1,1,0,0,0,0|2,0,0]=4 4251 B10R1.25 C=Cc1cnc(cc1Cl)Br 271570a_100011290941_100010381092 [1,1,0,0,0,0|2,0,0]=4 4252 B10R1.25 C=Cc1cnc(cc1Cl)Cl 271570a_100011290941_100010200927 [1,1,0,0,0,0|2,0,0]=4 4253 B10R1.25 C=Cc1cnc(cc1Cl)N 271570a_100011290941_100000694920 [1,1,0,0,0,0|2,0,0]=4 4254 B10R1.25 C=Cc1cnc(cc1F)Cl 271570a_100011290941_100010128100 [1,1,0,0,0,0|2,0,0]=4 4255 B10R1.25 C=Cc1cnc(cc1F)N 271570a_100011290941_100009844730 [1,1,0,0,0,0|2,0,0]=4 4256 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [1,1,0,0,0,0|2,0,0]=4 4257 B10R1.25 C=Cc1cnc(cc1N)N 271570a_100011290941_200009857908 [1,1,0,0,0,0|2,0,0]=4 4258 B10R1.25 C=Cc1cnc(cc1O)C 271570a_100011290941_100011016184 [1,1,0,0,0,0|1,0,0]=3 4259 B10R1.25 C=Cc1ncc(cc1Br)Cl 271570a_100011290941_100012154958 [1,1,0,0,0,0|2,0,0]=4 4260 B10R1.25 C=Cc1ncc(cc1C)Br 271570a_100011290941_100012353652 [1,1,0,0,0,0|2,0,0]=4 4261 B10R1.25 C=Cc1ncc(cc1C)C 271570a_100011290941_100009864548 [1,1,0,0,0,0|2,0,0]=4 4262 B10R1.25 C=Cc1ncc(cc1C)F 271570a_100011290941_100009817009 [1,1,0,0,0,0|2,0,0]=4 4263 B10R1.25 C=Cc1ncc(cc1C)N 271570a_100011290941_100000761747 [1,1,0,0,0,0|2,0,0]=4 4264 B10R1.25 C=Cc1ncc(cc1C)O 271570a_100011290941_100012000486 [1,1,0,0,0,0|2,0,0]=4 4265 B10R1.25 C=Cc1ncc(cc1F)Br 271570a_100011290941_100012348576 [1,1,0,0,0,0|2,0,0]=4 4266 B10R1.25 C=Cc1ncc(cc1F)C 271570a_100011290941_100009819633 [1,1,0,0,0,0|2,0,0]=4 4267 B10R1.25 C=Cc1ncc(cc1F)Cl 271570a_100011290941_100012348686 [1,1,0,0,0,0|2,0,0]=4 4268 B10R1.25 C=Cc1ncc(cc1F)F 271570a_100011290941_100011219543 [1,1,0,0,0,0|2,0,0]=4 4269 B10R1.25 C=Cc1ncc(cc1F)N 271570a_100011290941_100010280766 [1,1,0,0,0,0|2,0,0]=4 4270 B10R1.25 C=Cc1ncc(cc1F)O 271570a_100011290941_100000063512 [1,1,0,0,0,0|2,0,0]=4 4271 B10R1.25 C=Cc1ncc(cc1N)Br 271570a_100011290941_100010090555 [1,1,0,0,0,0|2,0,0]=4 4272 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [1,1,0,0,0,0|2,0,0]=4 4273 B10R1.25 C=Cc1ncc(cc1N)F 271570a_100011290941_100009817643 [1,1,0,0,0,0|2,0,0]=4 4274 B10R1.25 C=Cc1ncc(cc1N)N 271570a_100011290941_200000093520 [1,1,0,0,0,0|2,0,0]=4 4275 B10R1.25 C=Cc1ncc(cc1O)Br 271570a_100011290941_100010210634 [1,1,0,0,0,0|1,0,0]=3 4276 B10R1.25 C=Cc1ncc(cc1O)C 271570a_100011290941_100012000487 [1,1,0,0,0,0|1,0,0]=3 4277 B10R1.25 C=Cc1ncc(cc1O)Cl 271570a_100011290941_100010233512 [1,1,0,0,0,0|1,0,0]=3 4278 B10R1.25 C=Cc1ncc(cc1O)F 271570a_100011290941_100000079967 [1,1,0,0,0,0|1,0,0]=3 4279 B10R1.25 CCc1ccc(cc1F)O 271570a_203496583355_200010071577 [1,1,0,0,0,0|1,0,1]=4 4280 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [1,1,0,0,0,0|1,0,1]=4 4281 B10R1.25 CCc1cnc(cc1O)C 271570a_203496583355_100010291839 [1,1,0,0,0,0|1,0,1]=4 4282 B10R1.25 CCc1ncc(cc1O)N 271570a_203496583355_100013085292 [1,1,0,0,0,0|1,0,1]=4 4283 B10R1.25 CNc1ccc(cc1O)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|1,0,1]=4 4284 B10R1.25 CNc1ccc(cc1O)C 271570a_203496583355_100000221369 [1,1,0,0,0,0|1,0,1]=4 4285 B10R1.25 CNc1ccc(cc1O)C 34a_100000211527_200000210301 [1,1,0,0,0,0|1,0,1]=4 4286 B10R1.25 CNc1ccc(cc1O)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|1,0,1]=4 4287 B10R1.25 CNc1ccc(cc1O)F 271570a_203496583355_100011246292 [1,1,0,0,0,0|1,0,1]=4 4288 B10R1.25 CNc1ccc(cc1O)F 34a_100000753323_200000210301 [1,1,0,0,0,0|1,0,1]=4 4289 B10R1.25 CNc1ccc(cc1O)O 34a_100000106777_200000210301 [1,1,0,0,0,0|1,0,1]=4 4290 B10R1.25 COc1ccc(cc1O)Br 271570a_203496583355_100012351588 [1,1,0,0,0,0|1,0,1]=4 4291 B10R1.25 COc1ccc(cc1O)C 271570a_203496583355_100000186399 [1,1,0,0,0,0|1,0,1]=4 4292 B10R1.25 COc1ccc(cc1O)Cl 271570a_203496583355_100011215930 [1,1,0,0,0,0|1,0,1]=4 4293 B10R1.25 COc1ccc(cc1O)F 271570a_203496583355_100000171694 [1,1,0,0,0,0|1,0,1]=4 4294 B10R1.25 COc1ccc(cc1O)N 271570a_203496583355_100000187427 [1,1,0,0,0,0|1,0,1]=4 4295 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100009816560 [1,1,0,0,0,0|1,0,1]=4 4296 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100010084122 [1,1,0,0,0,0|1,0,1]=4 4297 B10R1.25 CSc1ccc(cc1O)Br 62a_100012344904_200000210301 [1,1,0,0,0,0|1,0,1]=4 4298 B10R1.25 CSc1ccc(cc1O)Br 62a_200000210301_100012344904 [1,1,0,0,0,0|1,0,1]=4 4299 B10R1.25 CSc1ccc(cc1O)C 271570a_203496583355_200010201864 [1,1,0,0,0,0|1,0,1]=4 4300 B10R1.25 CSc1ccc(cc1O)C 62a_100012002257_200000210301 [1,1,0,0,0,0|1,0,1]=4 4301 B10R1.25 CSc1ccc(cc1O)C 62a_200000210301_100012002257 [1,1,0,0,0,0|1,0,1]=4 4302 B10R1.25 CSc1ccc(cc1O)Cl 62a_100000050036_200000210301 [1,1,0,0,0,0|1,0,1]=4 4303 B10R1.25 CSc1ccc(cc1O)Cl 62a_200000210301_100000050036 [1,1,0,0,0,0|1,0,1]=4 4304 B10R1.25 CSc1ccc(cc1O)F 271570a_203496583355_100009817003 [1,1,0,0,0,0|1,0,1]=4 4305 B10R1.25 CSc1ccc(cc1O)F 62a_100000690578_200000210301 [1,1,0,0,0,0|1,0,1]=4 4306 B10R1.25 CSc1ccc(cc1O)F 62a_200000210301_100000690578 [1,1,0,0,0,0|1,0,1]=4 4307 B10R1.25 CSc1ccc(cc1O)O 62a_200000210301_100009813921 [1,1,0,0,0,0|1,0,1]=4 4308 B10R1.25 Cc1cc(ccc1C=O)O 271570a_203496583355_100000687586 [1,1,0,0,0,0|2,0,0]=4 4309 B10R1.25 Cc1cc(ccc1CF)O 271570a_203496583355_200010711859 [1,1,0,0,0,0|2,0,0]=4 4310 B10R1.25 Cc1cc(ccc1CN)O 271570a_203496583355_100000753881 [1,1,0,0,0,0|2,0,0]=4 4311 B10R1.25 Cc1cc(ccc1CO)O 271570a_203496583355_100000748258 [1,1,0,0,0,0|2,0,0]=4 4312 B10R1.25 Cc1ccc(c(c1)O)C#N 271570a_203496583355_100000693804 [1,1,0,0,0,0|1,0,1]=4 4313 B10R1.25 Cc1ccc(c(c1)O)C=O 271570a_203496583355_100000692596 [1,1,0,0,0,0|1,0,0]=3 4314 B10R1.25 Cc1ccc(c(c1)O)NN 271570a_203496583355_100016996181 [1,1,0,0,0,0|2,0,0]=4 4315 B10R1.25 Cc1ccc(c(c1)O)N[13CH3] 34a_100000211527_200025704644 [1,1,0,0,0,0|1,0,1]=4 4316 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_100012002257_200025704644 [1,1,0,0,0,0|1,0,1]=4 4317 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012002257 [1,1,0,0,0,0|1,0,1]=4 4318 B10R1.25 Cc1ccc(c(n1)O)C=O 271570a_203496583355_100000085379 [1,1,0,0,0,0|2,0,0]=4 4319 B10R1.25 Cc1ccc(c(n1)O)CO 271570a_203496583355_102495338573 [1,1,0,0,0,0|2,0,0]=4 4320 B10R1.25 N#Cc1ccc(cc1O)Br 271570a_203496583355_100010214477 [1,1,0,0,0,0|1,0,1]=4 4321 B10R1.25 N#Cc1ccc(cc1O)Cl 271570a_203496583355_100012355178 [1,1,0,0,0,0|1,0,1]=4 4322 B10R1.25 N#Cc1ccc(cc1O)F 271570a_203496583355_100000747196 [1,1,0,0,0,0|1,0,1]=4 4323 B10R1.25 N#Cc1ccc(cc1O)N 271570a_203496583355_100000689153 [1,1,0,0,0,0|1,0,1]=4 4324 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100011934713 [1,1,0,0,0,0|1,0,1]=4 4325 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100012184851 [1,1,0,0,0,0|1,0,1]=4 4326 B10R1.25 NCc1ccc(cc1F)O 271570a_203496583355_100000754580 [1,1,0,0,0,0|2,0,0]=4 4327 B10R1.25 NCc1ccc(cc1O)F 271570a_203496583355_100000708791 [1,1,0,0,0,0|1,0,0]=3 4328 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [1,1,0,0,0,0|2,0,0]=4 4329 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [1,1,0,0,0,0|2,0,0]=4 4330 B10R1.25 O=Cc1ccc(cc1Br)O 271570a_203496583355_100010185650 [1,1,0,0,0,0|2,0,0]=4 4331 B10R1.25 O=Cc1ccc(cc1Cl)O 271570a_203496583355_100000727542 [1,1,0,0,0,0|2,0,0]=4 4332 B10R1.25 O=Cc1ccc(cc1F)O 271570a_203496583355_100000211676 [1,1,0,0,0,0|2,0,0]=4 4333 B10R1.25 O=Cc1ccc(cc1O)Br 271570a_203496583355_100010146562 [1,1,0,0,0,0|1,0,0]=3 4334 B10R1.25 O=Cc1ccc(cc1O)F 271570a_203496583355_100000752949 [1,1,0,0,0,0|1,0,0]=3 4335 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [1,1,0,0,0,0|1,0,0]=3 4336 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [1,1,0,0,0,0|1,0,0]=3 4337 B10R1.25 O=Cc1ccc(nc1O)F 271570a_203496583355_100009846357 [1,1,0,0,0,0|2,0,0]=4 4338 B10R1.25 O=Cc1cnc(cc1O)F 271570a_203496583355_100009862493 [1,1,0,0,0,0|2,0,0]=4 4339 B10R1.25 OCc1ccc(cc1Br)O 271570a_203496583355_100010240206 [1,1,0,0,0,0|2,0,0]=4 4340 B10R1.25 OCc1ccc(cc1F)O 271570a_203496583355_100011191541 [1,1,0,0,0,0|2,0,0]=4 4341 B10R1.25 OCc1ccc(cc1O)Br 271570a_203496583355_100010146605 [1,1,0,0,0,0|1,0,0]=3 4342 B10R1.25 OCc1ccc(cc1O)Cl 271570a_203496583355_100000722340 [1,1,0,0,0,0|1,0,0]=3 4343 B10R1.25 OCc1ccc(cc1O)F 271570a_203496583355_100000744086 [1,1,0,0,0,0|1,0,0]=3 4344 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100000071718 [1,1,0,0,0,0|1,0,0]=3 4345 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100010146404 [1,1,0,0,0,0|1,0,0]=3 4346 B10R1.25 [13CH3]Nc1ccc(cc1O)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|1,0,1]=4 4347 B10R1.25 [13CH3]Nc1ccc(cc1O)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|1,0,1]=4 4348 B10R1.25 [13CH3]Nc1ccc(cc1O)F 34a_100000753323_200025704644 [1,1,0,0,0,0|1,0,1]=4 4349 B10R1.25 [13CH3]Nc1ccc(cc1O)O 34a_100000106777_200025704644 [1,1,0,0,0,0|1,0,1]=4 4350 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_100012344904_200025704644 [1,1,0,0,0,0|1,0,1]=4 4351 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_200025704644_100012344904 [1,1,0,0,0,0|1,0,1]=4 4352 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_100000050036_200025704644 [1,1,0,0,0,0|1,0,1]=4 4353 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_200025704644_100000050036 [1,1,0,0,0,0|1,0,1]=4 4354 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_100000690578_200025704644 [1,1,0,0,0,0|1,0,1]=4 4355 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_200025704644_100000690578 [1,1,0,0,0,0|1,0,1]=4 4356 B10R1.25 [13CH3]Sc1ccc(cc1O)O 62a_200025704644_100009813921 [1,1,0,0,0,0|1,0,1]=4 4357 B10R1.30 C=Cc1cc(=O)[nH]cc1F 271570a_100011290941_100009817642 [1,1,0,0,0,0|2,0,0]=4 4358 B10R1.30 C=Cc1cc(c[nH]c1=O)F 271570a_100011290941_100009817720 [1,1,0,0,0,0|1,0,1]=4 4359 B10R1.30 C=Cc1cc(ccc1Br)Br 271570a_100011290941_100011483371 [1,1,0,0,0,0|1,0,0]=3 4360 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [1,1,0,0,0,0|1,0,0]=3 4361 B10R1.30 C=Cc1cc(ccc1Br)Cl 271570a_100011290941_100012339723 [1,1,0,0,0,0|1,0,0]=3 4362 B10R1.30 C=Cc1cc(ccc1Br)F 271570a_100011290941_100011217576 [1,1,0,0,0,0|1,0,0]=3 4363 B10R1.30 C=Cc1cc(ccc1Br)N 271570a_100011290941_100000750459 [1,1,0,0,0,0|1,0,0]=3 4364 B10R1.30 C=Cc1cc(ccc1Br)O 271570a_100011290941_100012339312 [1,1,0,0,0,0|1,0,0]=3 4365 B10R1.30 C=Cc1cc(ccc1C)Br 271570a_100011290941_100011344865 [1,1,0,0,0,0|1,0,0]=3 4366 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [1,1,0,0,0,0|1,0,0]=3 4367 B10R1.30 C=Cc1cc(ccc1C)Cl 271570a_100011290941_100011263213 [1,1,0,0,0,0|1,0,0]=3 4368 B10R1.30 C=Cc1cc(ccc1C)F 271570a_100011290941_100011218078 [1,1,0,0,0,0|1,0,0]=3 4369 B10R1.30 C=Cc1cc(ccc1C)N 271570a_100011290941_100000736455 [1,1,0,0,0,0|1,0,0]=3 4370 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [1,1,0,0,0,0|1,0,0]=3 4371 B10R1.30 C=Cc1cc(ccc1Cl)Br 271570a_100011290941_100011772130 [1,1,0,0,0,0|1,0,0]=3 4372 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [1,1,0,0,0,0|1,0,0]=3 4373 B10R1.30 C=Cc1cc(ccc1Cl)Cl 271570a_100011290941_100000707729 [1,1,0,0,0,0|1,0,0]=3 4374 B10R1.30 C=Cc1cc(ccc1Cl)F 271570a_100011290941_100011217299 [1,1,0,0,0,0|1,0,0]=3 4375 B10R1.30 C=Cc1cc(ccc1Cl)N 271570a_100011290941_100012360549 [1,1,0,0,0,0|1,0,0]=3 4376 B10R1.30 C=Cc1cc(ccc1Cl)O 271570a_100011290941_100000049588 [1,1,0,0,0,0|1,0,0]=3 4377 B10R1.30 C=Cc1cc(ccc1F)Br 271570a_100011290941_100011217312 [1,1,0,0,0,0|1,0,0]=3 4378 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [1,1,0,0,0,0|1,0,0]=3 4379 B10R1.30 C=Cc1cc(ccc1F)Cl 271570a_100011290941_100011218116 [1,1,0,0,0,0|1,0,0]=3 4380 B10R1.30 C=Cc1cc(ccc1F)F 271570a_100011290941_100000750033 [1,1,0,0,0,0|1,0,0]=3 4381 B10R1.30 C=Cc1cc(ccc1F)N 271570a_100011290941_100000760356 [1,1,0,0,0,0|1,0,0]=3 4382 B10R1.30 C=Cc1cc(ccc1F)O 271570a_100011290941_100000693481 [1,1,0,0,0,0|1,0,0]=3 4383 B10R1.30 C=Cc1cc(ccc1N)Br 271570a_100011290941_100000187925 [1,1,0,0,0,0|1,0,0]=3 4384 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [1,1,0,0,0,0|1,0,0]=3 4385 B10R1.30 C=Cc1cc(ccc1N)Cl 271570a_100011290941_100000761889 [1,1,0,0,0,0|1,0,0]=3 4386 B10R1.30 C=Cc1cc(ccc1N)F 271570a_100011290941_100000760547 [1,1,0,0,0,0|1,0,0]=3 4387 B10R1.30 C=Cc1cc(ccc1N)N 271570a_100011290941_100011534242 [1,1,0,0,0,0|1,0,0]=3 4388 B10R1.30 C=Cc1cc(ccc1N)O 271570a_100011290941_100012001276 [1,1,0,0,0,0|1,0,0]=3 4389 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [1,1,0,0,0,0|0,0,0]=2 4390 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,1,0,0,0,0|0,0,0]=2 4391 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [1,1,0,0,0,0|0,0,0]=2 4392 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [1,1,0,0,0,0|0,0,0]=2 4393 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [1,1,0,0,0,0|0,0,0]=2 4394 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,1,0,0,0,0|0,0,0]=2 4395 B10R1.30 C=Cc1cc(cnc1Br)N 271570a_100011290941_100010201102 [1,1,0,0,0,0|2,0,0]=4 4396 B10R1.30 C=Cc1cc(cnc1C)Br 271570a_100011290941_200010090566 [1,1,0,0,0,0|2,0,0]=4 4397 B10R1.30 C=Cc1cc(cnc1C)C 271570a_100011290941_100009817436 [1,1,0,0,0,0|2,0,0]=4 4398 B10R1.30 C=Cc1cc(cnc1C)F 271570a_100011290941_100009860710 [1,1,0,0,0,0|2,0,0]=4 4399 B10R1.30 C=Cc1cc(cnc1C)N 271570a_100011290941_100011998591 [1,1,0,0,0,0|2,0,0]=4 4400 B10R1.30 C=Cc1cc(cnc1C)O 271570a_100011290941_100009819603 [1,1,0,0,0,0|2,0,0]=4 4401 B10R1.30 C=Cc1cc(cnc1Cl)Br 271570a_100011290941_100009814771 [1,1,0,0,0,0|2,0,0]=4 4402 B10R1.30 C=Cc1cc(cnc1Cl)C 271570a_100011290941_100010210167 [1,1,0,0,0,0|2,0,0]=4 4403 B10R1.30 C=Cc1cc(cnc1Cl)Cl 271570a_100011290941_200000062399 [1,1,0,0,0,0|2,0,0]=4 4404 B10R1.30 C=Cc1cc(cnc1Cl)N 271570a_100011290941_100010253917 [1,1,0,0,0,0|2,0,0]=4 4405 B10R1.30 C=Cc1cc(cnc1F)Br 271570a_100011290941_100010172738 [1,1,0,0,0,0|2,0,0]=4 4406 B10R1.30 C=Cc1cc(cnc1F)C 271570a_100011290941_100000049784 [1,1,0,0,0,0|2,0,0]=4 4407 B10R1.30 C=Cc1cc(cnc1F)Cl 271570a_100011290941_100010188783 [1,1,0,0,0,0|2,0,0]=4 4408 B10R1.30 C=Cc1cc(cnc1F)F 271570a_100011290941_100009820768 [1,1,0,0,0,0|2,0,0]=4 4409 B10R1.30 C=Cc1cc(cnc1F)N 271570a_100011290941_100009840397 [1,1,0,0,0,0|2,0,0]=4 4410 B10R1.30 C=Cc1cc(cnc1F)O 271570a_100011290941_100009817267 [1,1,0,0,0,0|2,0,0]=4 4411 B10R1.30 C=Cc1cc(cnc1N)Br 271570a_100011290941_100000760472 [1,1,0,0,0,0|2,0,0]=4 4412 B10R1.30 C=Cc1cc(cnc1N)C 271570a_100011290941_100000049664 [1,1,0,0,0,0|2,0,0]=4 4413 B10R1.30 C=Cc1cc(cnc1N)Cl 271570a_100011290941_100000050159 [1,1,0,0,0,0|2,0,0]=4 4414 B10R1.30 C=Cc1cc(cnc1N)F 271570a_100011290941_100009814671 [1,1,0,0,0,0|2,0,0]=4 4415 B10R1.30 C=Cc1cc(cnc1N)N 271570a_100011290941_200011934315 [1,1,0,0,0,0|2,0,0]=4 4416 B10R1.30 C=Cc1cc(cnc1O)Br 271570a_100011290941_100010197142 [1,1,0,0,0,0|1,0,0]=3 4417 B10R1.30 C=Cc1cc(cnc1O)C 271570a_100011290941_100000049931 [1,1,0,0,0,0|1,0,0]=3 4418 B10R1.30 C=Cc1cc(cnc1O)Cl 271570a_100011290941_100010188700 [1,1,0,0,0,0|1,0,0]=3 4419 B10R1.30 C=Cc1cc(ncc1Br)Br 271570a_100011290941_100010171693 [1,1,0,0,0,0|2,0,0]=4 4420 B10R1.30 C=Cc1cc(ncc1Br)Cl 271570a_100011290941_100009815598 [1,1,0,0,0,0|2,0,0]=4 4421 B10R1.30 C=Cc1cc(ncc1C)Br 271570a_100011290941_100010067628 [1,1,0,0,0,0|2,0,0]=4 4422 B10R1.30 C=Cc1cc(ncc1C)C 271570a_100011290941_100009862788 [1,1,0,0,0,0|2,0,0]=4 4423 B10R1.30 C=Cc1cc(ncc1C)Cl 271570a_100011290941_100010068021 [1,1,0,0,0,0|2,0,0]=4 4424 B10R1.30 C=Cc1cc(ncc1C)F 271570a_100011290941_100000049870 [1,1,0,0,0,0|2,0,0]=4 4425 B10R1.30 C=Cc1cc(ncc1C)N 271570a_100011290941_100009819938 [1,1,0,0,0,0|2,0,0]=4 4426 B10R1.30 C=Cc1cc(ncc1C)O 271570a_100011290941_100009831917 [1,1,0,0,0,0|2,0,0]=4 4427 B10R1.30 C=Cc1cc(ncc1Cl)Br 271570a_100011290941_100010223331 [1,1,0,0,0,0|2,0,0]=4 4428 B10R1.30 C=Cc1cc(ncc1Cl)Cl 271570a_100011290941_100010172835 [1,1,0,0,0,0|2,0,0]=4 4429 B10R1.30 C=Cc1cc(ncc1Cl)F 271570a_100011290941_100009892587 [1,1,0,0,0,0|2,0,0]=4 4430 B10R1.30 C=Cc1cc(ncc1Cl)N 271570a_100011290941_100010134119 [1,1,0,0,0,0|2,0,0]=4 4431 B10R1.30 C=Cc1cc(ncc1F)Br 271570a_100011290941_100010193852 [1,1,0,0,0,0|2,0,0]=4 4432 B10R1.30 C=Cc1cc(ncc1F)C 271570a_100011290941_100009867690 [1,1,0,0,0,0|2,0,0]=4 4433 B10R1.30 C=Cc1cc(ncc1F)Cl 271570a_100011290941_100000708277 [1,1,0,0,0,0|2,0,0]=4 4434 B10R1.30 C=Cc1cc(ncc1F)F 271570a_100011290941_100010233071 [1,1,0,0,0,0|2,0,0]=4 4435 B10R1.30 C=Cc1cc(ncc1F)N 271570a_100011290941_100015713587 [1,1,0,0,0,0|2,0,0]=4 4436 B10R1.30 C=Cc1cc(ncc1N)Cl 271570a_100011290941_100000050123 [1,1,0,0,0,0|2,0,0]=4 4437 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [1,1,0,0,0,0|1,0,0]=3 4438 B10R1.30 C=Cc1cc(ncc1O)Cl 271570a_100011290941_100000698892 [1,1,0,0,0,0|1,0,0]=3 4439 B10R1.30 C=Cc1cc(nnc1O)O 271570a_100011290941_100000759565 [1,1,0,0,0,0|2,0,0]=4 4440 B10R1.30 C=Cc1cn(ccc1=O)C 271570a_100011290941_100010750718 [1,1,0,0,0,0|1,0,1]=4 4441 B10R1.30 C=Cc1nc(ccc1Br)N 271570a_100011290941_100010192275 [1,1,0,0,0,0|2,0,0]=4 4442 B10R1.30 C=Cc1nc(ccc1C)C 271570a_100011290941_100009854376 [1,1,0,0,0,0|2,0,0]=4 4443 B10R1.30 C=Cc1nc(ccc1C)N 271570a_100011290941_100000126722 [1,1,0,0,0,0|2,0,0]=4 4444 B10R1.30 C=Cc1nc(ccc1F)C 271570a_100011290941_100009817602 [1,1,0,0,0,0|2,0,0]=4 4445 B10R1.30 C=Cc1nc(ccc1F)Cl 271570a_100011290941_100010136221 [1,1,0,0,0,0|2,0,0]=4 4446 B10R1.30 C=Cc1nc(ccc1F)F 271570a_100011290941_100010997973 [1,1,0,0,0,0|2,0,0]=4 4447 B10R1.30 C=Cc1nc(ccc1F)N 271570a_100011290941_100010892222 [1,1,0,0,0,0|2,0,0]=4 4448 B10R1.30 C=Cc1nc(ccc1N)Br 271570a_100011290941_100010168765 [1,1,0,0,0,0|2,0,0]=4 4449 B10R1.30 C=Cc1nc(ccc1N)C 271570a_100011290941_100000685570 [1,1,0,0,0,0|2,0,0]=4 4450 B10R1.30 C=Cc1nc(ccc1N)Cl 271570a_100011290941_100010233647 [1,1,0,0,0,0|2,0,0]=4 4451 B10R1.30 C=Cc1nc(ccc1N)F 271570a_100011290941_100009879877 [1,1,0,0,0,0|2,0,0]=4 4452 B10R1.30 C=Cc1nc(ccc1N)N 271570a_100011290941_200009884323 [1,1,0,0,0,0|2,0,0]=4 4453 B10R1.30 C=Cc1nc(ccc1O)Br 271570a_100011290941_100010253912 [1,1,0,0,0,0|1,0,0]=3 4454 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [1,1,0,0,0,0|1,0,0]=3 4455 B10R1.30 C=Cc1nc(ccc1O)Cl 271570a_100011290941_100000696390 [1,1,0,0,0,0|1,0,0]=3 4456 B10R1.30 C=Cc1nc(ccc1O)F 271570a_100011290941_100010382442 [1,1,0,0,0,0|1,0,0]=3 4457 B10R1.30 CCc1cc(ccc1Br)O 271570a_203496583355_100010244631 [1,1,0,0,0,0|1,0,1]=4 4458 B10R1.30 CCc1cc(ccc1F)O 271570a_203496583355_100010244625 [1,1,0,0,0,0|1,0,1]=4 4459 B10R1.30 CCc1cc(ccc1N)O 271570a_203496583355_100000686106 [1,1,0,0,0,0|1,0,1]=4 4460 B10R1.30 CCc1cc(ccc1O)Br 271570a_203496583355_100011216195 [1,1,0,0,0,0|0,0,1]=3 4461 B10R1.30 CCc1cc(ccc1O)N 271570a_203496583355_100010109747 [1,1,0,0,0,0|0,0,1]=3 4462 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [1,1,0,0,0,0|0,0,1]=3 4463 B10R1.30 CNc1cc(ccc1O)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|1,0,1]=4 4464 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [1,1,0,0,0,0|1,0,1]=4 4465 B10R1.30 CNc1cc(ccc1O)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|1,0,1]=4 4466 B10R1.30 CNc1cc(ccc1O)F 271570a_203496583355_100020633008 [1,1,0,0,0,0|1,0,1]=4 4467 B10R1.30 CNc1cc(ccc1O)F 34a_100000759472_200000210301 [1,1,0,0,0,0|1,0,1]=4 4468 B10R1.30 COc1cc(ccc1O)Br 271570a_203496583355_100010245111 [1,1,0,0,0,0|1,0,1]=4 4469 B10R1.30 COc1cc(ccc1O)C 271570a_203496583355_100010200004 [1,1,0,0,0,0|1,0,1]=4 4470 B10R1.30 COc1cc(ccc1O)Cl 271570a_203496583355_100000050115 [1,1,0,0,0,0|1,0,1]=4 4471 B10R1.30 COc1cc(ccc1O)F 271570a_203496583355_100000757151 [1,1,0,0,0,0|1,0,1]=4 4472 B10R1.30 COc1cc(ccc1O)N 271570a_203496583355_100000765947 [1,1,0,0,0,0|1,0,1]=4 4473 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100000694246 [1,1,0,0,0,0|1,0,1]=4 4474 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100011827694 [1,1,0,0,0,0|1,0,1]=4 4475 B10R1.30 CSc1cc(ccc1O)Br 62a_100012355227_200000210301 [1,1,0,0,0,0|1,0,1]=4 4476 B10R1.30 CSc1cc(ccc1O)Br 62a_200000210301_100012355227 [1,1,0,0,0,0|1,0,1]=4 4477 B10R1.30 CSc1cc(ccc1O)C 271570a_203496583355_200010709736 [1,1,0,0,0,0|1,0,1]=4 4478 B10R1.30 CSc1cc(ccc1O)C 62a_100000765521_200000210301 [1,1,0,0,0,0|1,0,1]=4 4479 B10R1.30 CSc1cc(ccc1O)C 62a_200000210301_100000765521 [1,1,0,0,0,0|1,0,1]=4 4480 B10R1.30 CSc1cc(ccc1O)Cl 62a_100011356953_200000210301 [1,1,0,0,0,0|1,0,1]=4 4481 B10R1.30 CSc1cc(ccc1O)Cl 62a_200000210301_100011356953 [1,1,0,0,0,0|1,0,1]=4 4482 B10R1.30 CSc1cc(ccc1O)F 62a_100000211999_200000210301 [1,1,0,0,0,0|1,0,1]=4 4483 B10R1.30 CSc1cc(ccc1O)F 62a_200000210301_100000211999 [1,1,0,0,0,0|1,0,1]=4 4484 B10R1.30 CSc1cc(ccc1O)N 62a_100011534360_200000210301 [1,1,0,0,0,0|1,0,1]=4 4485 B10R1.30 CSc1cc(ccc1O)N 62a_200000210301_100011534360 [1,1,0,0,0,0|1,0,1]=4 4486 B10R1.30 CSc1cc(ccc1O)O 62a_200000210301_100009813629 [1,1,0,0,0,0|1,0,1]=4 4487 B10R1.30 Cc1cc(c(cn1)O)CO 271570a_203496583355_100015579599 [1,1,0,0,0,0|2,0,0]=4 4488 B10R1.30 Cc1ccc(c(c1)C#N)O 271570a_203496583355_100011935190 [1,1,0,0,0,0|1,0,1]=4 4489 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [1,1,0,0,0,0|1,0,0]=3 4490 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [1,1,0,0,0,0|1,0,0]=3 4491 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [1,1,0,0,0,0|1,0,1]=4 4492 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_100000765521_200025704644 [1,1,0,0,0,0|1,0,1]=4 4493 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000765521 [1,1,0,0,0,0|1,0,1]=4 4494 B10R1.30 Cc1ccc(c(n1)C=O)O 271570a_203496583355_100010173661 [1,1,0,0,0,0|2,0,0]=4 4495 B10R1.30 Cc1ccc(c(n1)CO)O 271570a_203496583355_100010074375 [1,1,0,0,0,0|2,0,0]=4 4496 B10R1.30 Cc1ccc(cc1C=O)O 271570a_203496583355_100011361606 [1,1,0,0,0,0|2,0,0]=4 4497 B10R1.30 Cc1ccc(cc1CO)O 271570a_203496583355_100000700630 [1,1,0,0,0,0|2,0,0]=4 4498 B10R1.30 Cc1cnc(c(c1)C=O)O 271570a_203496583355_100000050350 [1,1,0,0,0,0|2,0,0]=4 4499 B10R1.30 Cc1cnc(c(c1)CO)O 271570a_203496583355_100000118064 [1,1,0,0,0,0|2,0,0]=4 4500 B10R1.30 N#Cc1cc(ccc1O)Br 271570a_203496583355_100011219714 [1,1,0,0,0,0|1,0,1]=4 4501 B10R1.30 N#Cc1cc(ccc1O)Cl 271570a_203496583355_200011356825 [1,1,0,0,0,0|1,0,1]=4 4502 B10R1.30 N#Cc1cc(ccc1O)F 271570a_203496583355_100000747550 [1,1,0,0,0,0|1,0,1]=4 4503 B10R1.30 N#Cc1cc(ccc1O)N 271570a_203496583355_100011934039 [1,1,0,0,0,0|1,0,1]=4 4504 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100000687585 [1,1,0,0,0,0|1,0,1]=4 4505 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100009818209 [1,1,0,0,0,0|1,0,1]=4 4506 B10R1.30 NCc1cc(ccc1F)O 271570a_203496583355_100009815772 [1,1,0,0,0,0|2,0,0]=4 4507 B10R1.30 NCc1cc(ccc1N)O 271570a_203496583355_100012349119 [1,1,0,0,0,0|2,0,0]=4 4508 B10R1.30 NCc1cc(ccc1O)F 271570a_203496583355_100000742738 [1,1,0,0,0,0|1,0,0]=3 4509 B10R1.30 NCc1cc(ccc1O)O 271570a_203496583355_100000730032 [1,1,0,0,0,0|1,0,0]=3 4510 B10R1.30 NCc1cc(cnc1O)F 271570a_203496583355_100010760786 [1,1,0,0,0,0|2,0,0]=4 4511 B10R1.30 NNc1cc(ccc1O)F 271570a_203496583355_100012362518 [1,1,0,0,0,0|2,0,0]=4 4512 B10R1.30 Nc1ccc(c(c1)CO)O 271570a_203496583355_100012347228 [1,1,0,0,0,0|1,0,0]=3 4513 B10R1.30 Nc1ccc(cc1C=O)O 271570a_203496583355_100011935258 [1,1,0,0,0,0|2,0,0]=4 4514 B10R1.30 Nc1ccc(cc1CO)O 271570a_203496583355_100012353972 [1,1,0,0,0,0|2,0,0]=4 4515 B10R1.30 O=Cc1cc(ccc1Br)O 271570a_203496583355_100010185652 [1,1,0,0,0,0|2,0,0]=4 4516 B10R1.30 O=Cc1cc(ccc1Cl)O 271570a_203496583355_100010254384 [1,1,0,0,0,0|2,0,0]=4 4517 B10R1.30 O=Cc1cc(ccc1F)O 271570a_203496583355_100000211465 [1,1,0,0,0,0|2,0,0]=4 4518 B10R1.30 O=Cc1cc(ccc1O)Br 271570a_203496583355_100010185651 [1,1,0,0,0,0|1,0,0]=3 4519 B10R1.30 O=Cc1cc(ccc1O)Cl 271570a_203496583355_100010254386 [1,1,0,0,0,0|1,0,0]=3 4520 B10R1.30 O=Cc1cc(ccc1O)F 271570a_203496583355_100011218309 [1,1,0,0,0,0|1,0,0]=3 4521 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000186750 [1,1,0,0,0,0|1,0,0]=3 4522 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000690577 [1,1,0,0,0,0|1,0,0]=3 4523 B10R1.30 O=Cc1cc(cnc1O)F 271570a_203496583355_100000079965 [1,1,0,0,0,0|2,0,0]=4 4524 B10R1.30 OCc1cc(ccc1Br)O 271570a_203496583355_100012359683 [1,1,0,0,0,0|2,0,0]=4 4525 B10R1.30 OCc1cc(ccc1Cl)O 271570a_203496583355_100010128486 [1,1,0,0,0,0|2,0,0]=4 4526 B10R1.30 OCc1cc(ccc1F)O 271570a_203496583355_100000049604 [1,1,0,0,0,0|2,0,0]=4 4527 B10R1.30 OCc1cc(ccc1O)Br 271570a_203496583355_100011356890 [1,1,0,0,0,0|1,0,0]=3 4528 B10R1.30 OCc1cc(ccc1O)F 271570a_203496583355_100011217561 [1,1,0,0,0,0|1,0,0]=3 4529 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100000184703 [1,1,0,0,0,0|1,0,0]=3 4530 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100012351483 [1,1,0,0,0,0|1,0,0]=3 4531 B10R1.30 OCc1cc(cnc1O)F 271570a_203496583355_100000079972 [1,1,0,0,0,0|2,0,0]=4 4532 B10R1.30 OCc1cc(cnc1O)O 271570a_203496583355_100010065268 [1,1,0,0,0,0|2,0,0]=4 4533 B10R1.30 OCc1nc(ccc1O)F 271570a_203496583355_100000701195 [1,1,0,0,0,0|2,0,0]=4 4534 B10R1.30 [13CH3]Nc1cc(ccc1O)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|1,0,1]=4 4535 B10R1.30 [13CH3]Nc1cc(ccc1O)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|1,0,1]=4 4536 B10R1.30 [13CH3]Nc1cc(ccc1O)F 34a_100000759472_200025704644 [1,1,0,0,0,0|1,0,1]=4 4537 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_100012355227_200025704644 [1,1,0,0,0,0|1,0,1]=4 4538 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_200025704644_100012355227 [1,1,0,0,0,0|1,0,1]=4 4539 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_100011356953_200025704644 [1,1,0,0,0,0|1,0,1]=4 4540 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_200025704644_100011356953 [1,1,0,0,0,0|1,0,1]=4 4541 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_100000211999_200025704644 [1,1,0,0,0,0|1,0,1]=4 4542 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_200025704644_100000211999 [1,1,0,0,0,0|1,0,1]=4 4543 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_100011534360_200025704644 [1,1,0,0,0,0|1,0,1]=4 4544 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_200025704644_100011534360 [1,1,0,0,0,0|1,0,1]=4 4545 B10R1.30 [13CH3]Sc1cc(ccc1O)O 62a_200025704644_100009813629 [1,1,0,0,0,0|1,0,1]=4 4546 B10R1.61 C=C(C)c1c[nH]ccc1=O 271570a_100000694244_100009998708 [1,1,0,0,0,0|1,0,1]=4 4547 B10R1.61 C=C(C)c1c[nH]ccc1=S 271570a_100000694244_200012280681 [1,1,0,0,0,0|1,1,0]=4 4548 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [1,1,0,0,0,0|1,0,1]=4 4549 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [1,1,0,0,0,0|2,0,0]=4 4550 B10R1.61 C=C(C)c1cccc[n+]1[O-] 271570a_100000694244_200000042595 [1,1,0,0,0,0|1,0,1]=4 4551 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|1,0,0]=3 4552 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|1,0,0]=3 4553 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|1,0,0]=3 4554 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|1,0,0]=3 4555 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|1,0,0]=3 4556 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|0,0,0]=2 4557 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [1,1,0,0,0,0|2,0,0]=4 4558 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [1,1,0,0,0,0|2,0,0]=4 4559 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [1,1,0,0,0,0|2,0,0]=4 4560 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [1,1,0,0,0,0|2,0,0]=4 4561 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,1,0,0,0,0|2,0,0]=4 4562 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [1,1,0,0,0,0|2,0,0]=4 4563 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [1,1,0,0,0,0|2,0,0]=4 4564 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [1,1,0,0,0,0|2,0,0]=4 4565 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [1,1,0,0,0,0|2,0,0]=4 4566 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [1,1,0,0,0,0|2,0,0]=4 4567 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,1,0,0,0,0|1,0,0]=3 4568 B10R1.61 C=C(C)c1cnccc1Br 271570a_100000694244_100010138639 [1,1,0,0,0,0|2,0,0]=4 4569 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [1,1,0,0,0,0|2,0,0]=4 4570 B10R1.61 C=C(C)c1cnccc1Cl 271570a_100000694244_100009995489 [1,1,0,0,0,0|2,0,0]=4 4571 B10R1.61 C=C(C)c1cnccc1F 271570a_100000694244_100009820683 [1,1,0,0,0,0|2,0,0]=4 4572 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [1,1,0,0,0,0|2,0,0]=4 4573 B10R1.61 C=C(C)c1cncnc1O 271570a_100000694244_100000751107 [1,1,0,0,0,0|2,0,0]=4 4574 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,1,0,0,0,0|2,0,0]=4 4575 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,1,0,0,0,0|2,0,0]=4 4576 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,1,0,0,0,0|2,0,0]=4 4577 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,1,0,0,0,0|2,0,0]=4 4578 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,1,0,0,0,0|2,0,0]=4 4579 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,1,0,0,0,0|1,0,0]=3 4580 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|1,0,1]=4 4581 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|1,0,1]=4 4582 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|1,0,1]=4 4583 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|1,0,1]=4 4584 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|1,0,1]=4 4585 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|0,0,1]=3 4586 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|0,0,1]=3 4587 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|0,0,2]=4 4588 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,1,0,0,0,0|1,0,1]=4 4589 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,1,0,0,0,0|1,0,1]=4 4590 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,1,0,0,0,0|1,0,1]=4 4591 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,1,0,0,0,0|1,0,1]=4 4592 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|0,0,1]=3 4593 B10R1.61 CC(C)c1cccnc1O 271570a_203496583355_200010382935 [1,1,0,0,0,0|1,0,1]=4 4594 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|0,0,1]=3 4595 B10R1.61 CC(N)c1ncccc1O 271570a_203496583355_100159271932 [1,1,0,0,0,0|1,0,1]=4 4596 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|0,0,1]=3 4597 B10R1.61 CC(O)c1cccnc1O 271570a_203496583355_100009865335 [1,1,0,0,0,0|1,0,1]=4 4598 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|1,0,1]=4 4599 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|1,0,1]=4 4600 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|1,0,1]=4 4601 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|1,0,1]=4 4602 B10R1.61 C[C@H](O)c1ncccc1O 271570a_203496583355_100013325542 [1,1,0,0,0,0|1,0,1]=4 4603 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|1,0,1]=4 4604 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,1,0,0,0,0|1,0,0]=3 4605 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,1,0,0,0,0|2,0,0]=4 4606 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,1,0,0,0,0|2,0,0]=4 4607 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,1,0,0,0,0|2,0,0]=4 4608 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,1,0,0,0,0|2,0,0]=4 4609 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [1,1,0,0,0,0|2,0,0]=4 4610 B10R1.61 Oc1ccccc1C(F)F 271570a_203496583355_100010169824 [1,1,0,0,0,0|1,0,0]=3 4611 B10R1.61 Oc1cccnc1C(F)F 271570a_203496583355_100010079810 [1,1,0,0,0,0|2,0,0]=4 4612 B10R1.61 Oc1ncccc1C(F)F 271570a_203496583355_100010136063 [1,1,0,0,0,0|2,0,0]=4 4613 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|1,0,1]=4 4614 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|1,0,1]=4 4615 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|1,0,1]=4 4616 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|1,0,1]=4 4617 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|0,0,1]=3 4618 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|0,0,2]=4 4619 B10R1.245 C=Cc1c(ccc[n+]1[O-])C 271570a_100011290941_100116209805 [1,1,0,0,0,0|1,0,1]=4 4620 B10R1.245 C=Cc1c(cccc1Br)Br 271570a_100011290941_100009994525 [1,1,0,0,0,0|1,0,0]=3 4621 B10R1.245 C=Cc1c(cccc1Br)Cl 271570a_100011290941_100010214488 [1,1,0,0,0,0|1,0,0]=3 4622 B10R1.245 C=Cc1c(cccc1Br)F 271570a_100011290941_100011219512 [1,1,0,0,0,0|1,0,0]=3 4623 B10R1.245 C=Cc1c(cccc1Br)N 271570a_100011290941_100020590159 [1,1,0,0,0,0|1,0,0]=3 4624 B10R1.245 C=Cc1c(cccc1Br)O 271570a_100011290941_100010187912 [1,1,0,0,0,0|0,0,0]=2 4625 B10R1.245 C=Cc1c(cccc1C)C 271570a_100011290941_100000033847 [1,1,0,0,0,0|1,0,0]=3 4626 B10R1.245 C=Cc1c(cccc1Cl)C 271570a_100011290941_100000043165 [1,1,0,0,0,0|1,0,0]=3 4627 B10R1.245 C=Cc1c(cccc1Cl)Cl 271570a_100011290941_100000034237 [1,1,0,0,0,0|1,0,0]=3 4628 B10R1.245 C=Cc1c(cccc1Cl)F 271570a_100011290941_100000050007 [1,1,0,0,0,0|1,0,0]=3 4629 B10R1.245 C=Cc1c(cccc1Cl)N 271570a_100011290941_100000049713 [1,1,0,0,0,0|1,0,0]=3 4630 B10R1.245 C=Cc1c(cccc1Cl)O 271570a_100011290941_100000050174 [1,1,0,0,0,0|0,0,0]=2 4631 B10R1.245 C=Cc1c(cccc1F)C 271570a_100011290941_100012349962 [1,1,0,0,0,0|1,0,0]=3 4632 B10R1.245 C=Cc1c(cccc1F)F 271570a_100011290941_100000693133 [1,1,0,0,0,0|1,0,0]=3 4633 B10R1.245 C=Cc1c(cccc1F)N 271570a_100011290941_100011934729 [1,1,0,0,0,0|1,0,0]=3 4634 B10R1.245 C=Cc1c(cccc1F)O 271570a_100011290941_100009820682 [1,1,0,0,0,0|0,0,0]=2 4635 B10R1.245 C=Cc1c(cccc1N)C 271570a_100011290941_100000684715 [1,1,0,0,0,0|1,0,0]=3 4636 B10R1.245 C=Cc1c(cccc1O)C 271570a_100011290941_100000686692 [1,1,0,0,0,0|0,0,0]=2 4637 B10R1.245 C=Cc1c(cccc1O)N 271570a_100011290941_100012183704 [1,1,0,0,0,0|0,0,0]=2 4638 B10R1.245 C=Cc1c(cccc1O)O 271570a_100011290941_100010205330 [1,1,0,0,0,0|0,0,0]=2 4639 B10R1.245 C=Cc1c(ccnc1C)C 271570a_100011290941_100012000501 [1,1,0,0,0,0|2,0,0]=4 4640 B10R1.245 C=Cc1c(ccnc1C)N 271570a_100011290941_100010243816 [1,1,0,0,0,0|2,0,0]=4 4641 B10R1.245 C=Cc1c(ccnc1F)C 271570a_100011290941_100009818256 [1,1,0,0,0,0|2,0,0]=4 4642 B10R1.245 C=Cc1c(ccnc1F)F 271570a_100011290941_100009874084 [1,1,0,0,0,0|2,0,0]=4 4643 B10R1.245 C=Cc1c(ccnc1F)N 271570a_100011290941_100010381272 [1,1,0,0,0,0|2,0,0]=4 4644 B10R1.245 C=Cc1c(ccnc1N)C 271570a_100011290941_100011998619 [1,1,0,0,0,0|2,0,0]=4 4645 B10R1.245 C=Cc1c(ccnc1N)Cl 271570a_100011290941_100010199028 [1,1,0,0,0,0|2,0,0]=4 4646 B10R1.245 C=Cc1c(ccnc1O)C 271570a_100011290941_100012000493 [1,1,0,0,0,0|1,0,0]=3 4647 B10R1.245 C=Cc1c(ccnc1O)O 271570a_100011290941_200009817435 [1,1,0,0,0,0|1,0,0]=3 4648 B10R1.245 C=Cc1c(cn[nH]c1=O)O 271570a_100011290941_100000116976 [1,1,0,0,0,0|2,0,0]=4 4649 B10R1.245 C=Cc1c(cncc1Br)Br 271570a_100011290941_100010172828 [1,1,0,0,0,0|2,0,0]=4 4650 B10R1.245 C=Cc1c(cncc1C)C 271570a_100011290941_100009817138 [1,1,0,0,0,0|2,0,0]=4 4651 B10R1.245 C=Cc1c(cncc1Cl)Cl 271570a_100011290941_100000036193 [1,1,0,0,0,0|2,0,0]=4 4652 B10R1.245 C=Cc1c(cncc1F)F 271570a_100011290941_100000760538 [1,1,0,0,0,0|2,0,0]=4 4653 B10R1.245 CNc1c(cccc1Br)O 34a_100011934926_200000210301 [1,1,0,0,0,0|1,0,1]=4 4654 B10R1.245 CNc1c(cccc1Cl)O 34a_100012022510_200000210301 [1,1,0,0,0,0|1,0,1]=4 4655 B10R1.245 CNc1c(cccc1F)O 34a_100020591140_200000210301 [1,1,0,0,0,0|1,0,1]=4 4656 B10R1.245 CNc1c(cccc1O)C 34a_100000743429_200000210301 [1,1,0,0,0,0|1,0,1]=4 4657 B10R1.245 CNc1c(cccc1O)N 271570a_203496583355_100010510394 [1,1,0,0,0,0|1,0,1]=4 4658 B10R1.245 COc1c(cccc1Br)O 271570a_203496583355_100010146560 [1,1,0,0,0,0|1,0,1]=4 4659 B10R1.245 COc1c(cccc1Cl)O 271570a_203496583355_100010147678 [1,1,0,0,0,0|1,0,1]=4 4660 B10R1.245 COc1c(cccc1F)O 271570a_203496583355_100009816759 [1,1,0,0,0,0|1,0,1]=4 4661 B10R1.245 COc1c(cccc1O)C 271570a_203496583355_100010141385 [1,1,0,0,0,0|1,0,1]=4 4662 B10R1.245 COc1c(cccc1O)N 271570a_203496583355_100011935253 [1,1,0,0,0,0|1,0,1]=4 4663 B10R1.245 COc1c(cccc1O)O 271570a_203496583355_100010234590 [1,1,0,0,0,0|1,0,1]=4 4664 B10R1.245 CSc1c(cccc1Br)O 62a_100010187912_200000210301 [1,1,0,0,0,0|1,0,1]=4 4665 B10R1.245 CSc1c(cccc1Br)O 62a_200000210301_100010187912 [1,1,0,0,0,0|1,0,1]=4 4666 B10R1.245 CSc1c(cccc1Cl)O 62a_200000210301_100000050174 [1,1,0,0,0,0|1,0,1]=4 4667 B10R1.245 CSc1c(cccc1F)O 271570a_203496583355_200010709249 [1,1,0,0,0,0|1,0,1]=4 4668 B10R1.245 CSc1c(cccc1F)O 62a_100009820682_200000210301 [1,1,0,0,0,0|1,0,1]=4 4669 B10R1.245 CSc1c(cccc1F)O 62a_200000210301_100009820682 [1,1,0,0,0,0|1,0,1]=4 4670 B10R1.245 CSc1c(cccc1O)C 62a_100000686692_200000210301 [1,1,0,0,0,0|1,0,1]=4 4671 B10R1.245 CSc1c(cccc1O)C 62a_200000210301_100000686692 [1,1,0,0,0,0|1,0,1]=4 4672 B10R1.245 CSc1c(cccc1O)N 62a_100012183704_200000210301 [1,1,0,0,0,0|1,0,1]=4 4673 B10R1.245 CSc1c(cccc1O)N 62a_200000210301_100012183704 [1,1,0,0,0,0|1,0,1]=4 4674 B10R1.245 CSc1c(cccc1O)O 62a_200000210301_100010205330 [1,1,0,0,0,0|1,0,1]=4 4675 B10R1.245 Cc1cccc(c1C#N)O 271570a_203496583355_100009819585 [1,1,0,0,0,0|1,0,1]=4 4676 B10R1.245 Cc1cccc(c1C=O)O 271570a_203496583355_100000041122 [1,1,0,0,0,0|1,0,0]=3 4677 B10R1.245 Cc1cccc(c1N[13CH3])O 34a_100000743429_200025704644 [1,1,0,0,0,0|1,0,1]=4 4678 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_100000686692_200025704644 [1,1,0,0,0,0|1,0,1]=4 4679 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_200025704644_100000686692 [1,1,0,0,0,0|1,0,1]=4 4680 B10R1.245 N#Cc1c(cccc1Br)O 271570a_203496583355_100010071968 [1,1,0,0,0,0|1,0,1]=4 4681 B10R1.245 N#Cc1c(cccc1Cl)O 271570a_203496583355_200000049503 [1,1,0,0,0,0|1,0,1]=4 4682 B10R1.245 N#Cc1c(cccc1F)O 271570a_203496583355_100000699744 [1,1,0,0,0,0|1,0,1]=4 4683 B10R1.245 N#Cc1c(cccc1O)N 271570a_203496583355_100011935054 [1,1,0,0,0,0|1,0,1]=4 4684 B10R1.245 N#Cc1c(cccc1O)O 271570a_203496583355_100012180507 [1,1,0,0,0,0|1,0,1]=4 4685 B10R1.245 NCc1c(cccc1F)O 271570a_203496583355_100012349121 [1,1,0,0,0,0|1,0,0]=3 4686 B10R1.245 NNc1c(cccc1F)O 271570a_203496583355_100016994982 [1,1,0,0,0,0|2,0,0]=4 4687 B10R1.245 Nc1cccc(c1C=O)O 271570a_203496583355_100010232536 [1,1,0,0,0,0|1,0,0]=3 4688 B10R1.245 Nc1cccc(c1CO)O 271570a_203496583355_100000747656 [1,1,0,0,0,0|1,0,0]=3 4689 B10R1.245 Nc1nccc(c1C=O)O 271570a_203496583355_100009843235 [1,1,0,0,0,0|2,0,0]=4 4690 B10R1.245 O=Cc1c(cccc1Cl)O 271570a_203496583355_100010147682 [1,1,0,0,0,0|1,0,0]=3 4691 B10R1.245 O=Cc1c(cccc1F)O 271570a_203496583355_100000210083 [1,1,0,0,0,0|1,0,0]=3 4692 B10R1.245 O=Cc1c(cccc1O)O 271570a_203496583355_100009814793 [1,1,0,0,0,0|1,0,0]=3 4693 B10R1.245 O=Cc1c(ccnc1Cl)O 271570a_203496583355_100000047006 [1,1,0,0,0,0|2,0,0]=4 4694 B10R1.245 O=Cc1c(ccnc1F)O 271570a_203496583355_100009828249 [1,1,0,0,0,0|2,0,0]=4 4695 B10R1.245 O=Cc1c(ccnc1O)O 271570a_203496583355_200010729673 [1,1,0,0,0,0|2,0,0]=4 4696 B10R1.245 O=Cc1c(cncc1F)O 271570a_203496583355_100010064882 [1,1,0,0,0,0|2,0,0]=4 4697 B10R1.245 OCc1c(cccc1F)O 271570a_203496583355_100012355691 [1,1,0,0,0,0|1,0,0]=3 4698 B10R1.245 OCc1c(ccnc1Cl)O 271570a_203496583355_100000047008 [1,1,0,0,0,0|2,0,0]=4 4699 B10R1.245 OCc1c(ccnc1F)O 271570a_203496583355_100000050056 [1,1,0,0,0,0|2,0,0]=4 4700 B10R1.245 [13CH3]Nc1c(cccc1Br)O 34a_100011934926_200025704644 [1,1,0,0,0,0|1,0,1]=4 4701 B10R1.245 [13CH3]Nc1c(cccc1Cl)O 34a_100012022510_200025704644 [1,1,0,0,0,0|1,0,1]=4 4702 B10R1.245 [13CH3]Nc1c(cccc1F)O 34a_100020591140_200025704644 [1,1,0,0,0,0|1,0,1]=4 4703 B10R1.245 [13CH3]Sc1c(cccc1Br)O 62a_100010187912_200025704644 [1,1,0,0,0,0|1,0,1]=4 4704 B10R1.245 [13CH3]Sc1c(cccc1Br)O 62a_200025704644_100010187912 [1,1,0,0,0,0|1,0,1]=4 4705 B10R1.245 [13CH3]Sc1c(cccc1Cl)O 62a_200025704644_100000050174 [1,1,0,0,0,0|1,0,1]=4 4706 B10R1.245 [13CH3]Sc1c(cccc1F)O 62a_100009820682_200025704644 [1,1,0,0,0,0|1,0,1]=4 4707 B10R1.245 [13CH3]Sc1c(cccc1F)O 62a_200025704644_100009820682 [1,1,0,0,0,0|1,0,1]=4 4708 B10R1.245 [13CH3]Sc1c(cccc1O)N 62a_100012183704_200025704644 [1,1,0,0,0,0|1,0,1]=4 4709 B10R1.245 [13CH3]Sc1c(cccc1O)N 62a_200025704644_100012183704 [1,1,0,0,0,0|1,0,1]=4 4710 B10R1.245 [13CH3]Sc1c(cccc1O)O 62a_200025704644_100010205330 [1,1,0,0,0,0|1,0,1]=4 4711 B10R1.29 C=CCSc1ccsc1C 62a_100000210623_100000684487 [0,1,0,0,1,0|2,0,0]=4 4712 B10R1.29 C=CCSc1ccsc1C 62a_100000684487_100000210623 [0,1,0,0,1,0|2,0,0]=4 4713 B10R1.29 C=CCSc1cscc1Br 62a_100000210623_100010143727 [0,1,0,0,1,0|2,0,0]=4 4714 B10R1.29 C=CCSc1cscc1Br 62a_100010143727_100000210623 [0,1,0,0,1,0|2,0,0]=4 4715 B10R1.29 C=CCSc1cscc1C 62a_100000210623_100000759966 [0,1,0,0,1,0|2,0,0]=4 4716 B10R1.29 C=CCSc1cscc1C 62a_100000759966_100000210623 [0,1,0,0,1,0|2,0,0]=4 4717 B10R1.29 C=CCSc1sccc1Br 62a_100000210623_100012361411 [0,1,0,0,1,0|2,0,0]=4 4718 B10R1.29 C=CCSc1sccc1Br 62a_100012361411_100000210623 [0,1,0,0,1,0|2,0,0]=4 4719 B10R1.29 C=CCSc1sccc1C 62a_100000210623_100010247149 [0,1,0,0,1,0|2,0,0]=4 4720 B10R1.29 C=CCSc1sccc1C 62a_100010247149_100000210623 [0,1,0,0,1,0|2,0,0]=4 4721 B12R1.18 C=CCOc1cccccc1=O 34a_100000036025_100015514636 [0,1,0,0,0,1|0,0,1]=3 4722 B12R1.18 C=CCOc1cccccc1=O 7a_100000036025_100015514636 [0,1,0,0,0,1|0,0,1]=3 4723 B12R1.18 O=CCOc1cccccc1=O 34a_100000036025_200009817547 [0,1,0,0,0,1|1,0,1]=4 4724 B12R1.18 O=CCOc1cccccc1=O 7a_100000036025_200015260668 [0,1,0,0,0,1|1,0,1]=4 4725 B12R1.24 CNC(C)c1cccc(c1O)Br 269862a_106832991636_100009815558 [0,2,0,0,0,0|1,0,1]=4 4726 B12R1.24 CNC(C)c1cccc(c1O)C 269862a_106832991636_100009847209 [0,2,0,0,0,0|1,0,1]=4 4727 B12R1.24 CNC(C)c1cccc(c1O)Cl 269862a_106832991636_100000043392 [0,2,0,0,0,0|1,0,1]=4 4728 B12R1.24 CNC(C)c1cccc(c1O)F 269862a_106832991636_100011246037 [0,2,0,0,0,0|1,0,1]=4 4729 B12R1.25 C#CCNc1cccc(c1O)Br 34a_100011934915_100000184674 [0,2,0,0,0,0|0,0,2]=4 4730 B12R1.25 C#CCNc1cccc(c1O)C 34a_100000756359_100000184674 [0,2,0,0,0,0|0,0,2]=4 4731 B12R1.25 C#CCNc1cccc(c1O)Cl 34a_100000754742_100000184674 [0,2,0,0,0,0|0,0,2]=4 4732 B12R1.25 C#CCNc1cccc(c1O)F 34a_100011934987_100000184674 [0,2,0,0,0,0|0,0,2]=4 4733 B12R1.25 C#CCSc1cccc(c1O)Br 62a_100000038162_100010084509 [0,2,0,0,0,0|0,0,2]=4 4734 B12R1.25 C#CCSc1cccc(c1O)C 62a_100000038162_100009817157 [0,2,0,0,0,0|0,0,2]=4 4735 B12R1.25 C#CCSc1cccc(c1O)Cl 62a_100000038162_100010202889 [0,2,0,0,0,0|0,0,2]=4 4736 B12R1.25 C#CCSc1cccc(c1O)F 62a_100000038162_100009813666 [0,2,0,0,0,0|0,0,2]=4 4737 B12R1.25 C#CCSc1cccc(c1O)N 62a_100000038162_100010084371 [0,2,0,0,0,0|0,0,2]=4 4738 B12R1.25 C#CCSc1cccc(c1O)O 62a_100000038162_100009815950 [0,2,0,0,0,0|0,0,2]=4 4739 B12R1.25 C=CCNc1cccc(c1Br)C 34a_100000684715_100015514636 [0,2,0,0,0,0|1,0,0]=3 4740 B12R1.25 C=CCNc1cccc(c1Br)Cl 34a_100000687072_100015514636 [0,2,0,0,0,0|1,0,0]=3 4741 B12R1.25 C=CCNc1cccc(c1Br)F 34a_100011934729_100015514636 [0,2,0,0,0,0|1,0,0]=3 4742 B12R1.25 C=CCNc1cccc(c1Br)O 34a_100012183704_100015514636 [0,2,0,0,0,0|1,0,0]=3 4743 B12R1.25 C=CCNc1cccc(c1Br)O 7a_100012183704_100015514636 [0,2,0,0,0,0|1,0,0]=3 4744 B12R1.25 C=CCNc1cccc(c1C)Br 34a_100000750434_100015514636 [0,2,0,0,0,0|1,0,0]=3 4745 B12R1.25 C=CCNc1cccc(c1C)C 2230a_100000210026_100000210623 [0,2,0,0,0,0|1,0,0]=3 4746 B12R1.25 C=CCNc1cccc(c1C)C 34a_100000210026_100015514636 [0,2,0,0,0,0|1,0,0]=3 4747 B12R1.25 C=CCNc1cccc(c1C)C 7a_100000210026_100015514636 [0,2,0,0,0,0|1,0,0]=3 4748 B12R1.25 C=CCNc1cccc(c1C)Cl 2230a_100000210441_100000210623 [0,2,0,0,0,0|1,0,0]=3 4749 B12R1.25 C=CCNc1cccc(c1C)Cl 34a_100000210441_100015514636 [0,2,0,0,0,0|1,0,0]=3 4750 B12R1.25 C=CCNc1cccc(c1C)Cl 7a_100000210441_100015514636 [0,2,0,0,0,0|1,0,0]=3 4751 B12R1.25 C=CCNc1cccc(c1C)F 34a_100000745574_100015514636 [0,2,0,0,0,0|1,0,0]=3 4752 B12R1.25 C=CCNc1cccc(c1C)F 7a_100000745574_100015514636 [0,2,0,0,0,0|1,0,0]=3 4753 B12R1.25 C=CCNc1cccc(c1C)I 34a_100000761887_100015514636 [0,2,0,0,0,0|1,0,0]=3 4754 B12R1.25 C=CCNc1cccc(c1C)O 34a_100011216573_100015514636 [0,2,0,0,0,0|1,0,0]=3 4755 B12R1.25 C=CCNc1cccc(c1C)O 7a_100011216573_100015514636 [0,2,0,0,0,0|1,0,0]=3 4756 B12R1.25 C=CCNc1cccc(c1Cl)Br 34a_100000687075_100015514636 [0,2,0,0,0,0|1,0,0]=3 4757 B12R1.25 C=CCNc1cccc(c1Cl)C 34a_100000765562_100015514636 [0,2,0,0,0,0|1,0,0]=3 4758 B12R1.25 C=CCNc1cccc(c1Cl)C 7a_100000765562_100015514636 [0,2,0,0,0,0|1,0,0]=3 4759 B12R1.25 C=CCNc1cccc(c1Cl)Cl 34a_100000185733_100015514636 [0,2,0,0,0,0|1,0,0]=3 4760 B12R1.25 C=CCNc1cccc(c1Cl)F 34a_100000692321_100015514636 [0,2,0,0,0,0|1,0,0]=3 4761 B12R1.25 C=CCNc1cccc(c1Cl)O 34a_100012002038_100015514636 [0,2,0,0,0,0|1,0,0]=3 4762 B12R1.25 C=CCNc1cccc(c1Cl)O 7a_100012002038_100015514636 [0,2,0,0,0,0|1,0,0]=3 4763 B12R1.25 C=CCNc1cccc(c1F)Br 2230a_100011935091_100000210623 [0,2,0,0,0,0|1,0,0]=3 4764 B12R1.25 C=CCNc1cccc(c1F)Br 34a_100011935091_100015514636 [0,2,0,0,0,0|1,0,0]=3 4765 B12R1.25 C=CCNc1cccc(c1F)C 2230a_100000697159_100000210623 [0,2,0,0,0,0|1,0,0]=3 4766 B12R1.25 C=CCNc1cccc(c1F)C 34a_100000697159_100015514636 [0,2,0,0,0,0|1,0,0]=3 4767 B12R1.25 C=CCNc1cccc(c1F)C 7a_100000697159_100015514636 [0,2,0,0,0,0|1,0,0]=3 4768 B12R1.25 C=CCNc1cccc(c1F)Cl 2230a_100000199060_100000210623 [0,2,0,0,0,0|1,0,0]=3 4769 B12R1.25 C=CCNc1cccc(c1F)Cl 34a_100000199060_100015514636 [0,2,0,0,0,0|1,0,0]=3 4770 B12R1.25 C=CCNc1cccc(c1F)F 34a_100000743855_100015514636 [0,2,0,0,0,0|1,0,0]=3 4771 B12R1.25 C=CCNc1cccc(c1I)Br 34a_100020590159_100015514636 [0,2,0,0,0,0|1,0,0]=3 4772 B12R1.25 C=CCNc1cccc(c1I)C 34a_100000761888_100015514636 [0,2,0,0,0,0|1,0,0]=3 4773 B12R1.25 C=CCNc1cccc(c1I)Cl 34a_100000049713_100015514636 [0,2,0,0,0,0|1,0,0]=3 4774 B12R1.25 C=CCNc1cccc(c1I)F 34a_100000690935_100015514636 [0,2,0,0,0,0|1,0,0]=3 4775 B12R1.25 C=CCNc1cccc(c1O)Br 34a_100011934915_100015514636 [0,2,0,0,0,0|0,0,0]=2 4776 B12R1.25 C=CCNc1cccc(c1O)C 34a_100000756359_100015514636 [0,2,0,0,0,0|0,0,0]=2 4777 B12R1.25 C=CCNc1cccc(c1O)Cl 34a_100000754742_100015514636 [0,2,0,0,0,0|0,0,0]=2 4778 B12R1.25 C=CCNc1cccc(c1O)F 34a_100011934987_100015514636 [0,2,0,0,0,0|0,0,0]=2 4779 B12R1.25 C=CCNc1ccnc(c1Br)F 27a_100020586998_100010006599 [0,2,0,0,0,0|2,0,0]=4 4780 B12R1.25 C=CCNc1ccnc(c1C)F 27a_100020586998_100010006593 [0,2,0,0,0,0|2,0,0]=4 4781 B12R1.25 C=CCNc1ccnc(c1Cl)C 27a_100020586998_100000698670 [0,2,0,0,0,0|2,0,0]=4 4782 B12R1.25 C=CCNc1ccnc(c1Cl)F 27a_100020586998_100010067886 [0,2,0,0,0,0|2,0,0]=4 4783 B12R1.25 C=CCNc1ccnc(c1F)C 27a_100020586998_100009849794 [0,2,0,0,0,0|2,0,0]=4 4784 B12R1.25 C=CCNc1ccnc(c1F)F 27a_100020586998_100010214882 [0,2,0,0,0,0|2,0,0]=4 4785 B12R1.25 C=CCNc1nccc(c1C)F 27a_100020586998_100009846374 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.25 C=CCOc1cccc(c1Br)Br 34a_100010187966_100015514636 [0,2,0,0,0,0|1,0,0]=3 4787 B12R1.25 C=CCOc1cccc(c1Br)Br 7a_100010187966_100015514636 [0,2,0,0,0,0|1,0,0]=3 4788 B12R1.25 C=CCOc1cccc(c1Br)C 34a_100000686692_100015514636 [0,2,0,0,0,0|1,0,0]=3 4789 B12R1.25 C=CCOc1cccc(c1Br)C 7a_100000686692_100015514636 [0,2,0,0,0,0|1,0,0]=3 4790 B12R1.25 C=CCOc1cccc(c1Br)Cl 34a_100012348804_100015514636 [0,2,0,0,0,0|1,0,0]=3 4791 B12R1.25 C=CCOc1cccc(c1Br)Cl 7a_100012348804_100015514636 [0,2,0,0,0,0|1,0,0]=3 4792 B12R1.25 C=CCOc1cccc(c1Br)F 34a_100009820682_100015514636 [0,2,0,0,0,0|1,0,0]=3 4793 B12R1.25 C=CCOc1cccc(c1Br)F 7a_100009820682_100015514636 [0,2,0,0,0,0|1,0,0]=3 4794 B12R1.25 C=CCOc1cccc(c1Br)I 34a_100010187914_100015514636 [0,2,0,0,0,0|1,0,0]=3 4795 B12R1.25 C=CCOc1cccc(c1Br)I 7a_100010187914_100015514636 [0,2,0,0,0,0|1,0,0]=3 4796 B12R1.25 C=CCOc1cccc(c1Br)N 34a_100012183704_100015514636 [0,2,0,0,0,0|1,0,0]=3 4797 B12R1.25 C=CCOc1cccc(c1Br)N 7a_100012183704_100015514636 [0,2,0,0,0,0|1,0,0]=3 4798 B12R1.25 C=CCOc1cccc(c1C)Br 34a_100012002258_100015514636 [0,2,0,0,0,0|1,0,0]=3 4799 B12R1.25 C=CCOc1cccc(c1C)Br 7a_100012002258_100015514636 [0,2,0,0,0,0|1,0,0]=3 4800 B12R1.25 C=CCOc1cccc(c1C)C 34a_100000185855_100015514636 [0,2,0,0,0,0|1,0,0]=3 4801 B12R1.25 C=CCOc1cccc(c1C)C 7a_100000185855_100015514636 [0,2,0,0,0,0|1,0,0]=3 4802 B12R1.25 C=CCOc1cccc(c1C)Cl 34a_100011265684_100015514636 [0,2,0,0,0,0|1,0,0]=3 4803 B12R1.25 C=CCOc1cccc(c1C)Cl 7a_100011265684_100015514636 [0,2,0,0,0,0|1,0,0]=3 4804 B12R1.25 C=CCOc1cccc(c1C)F 34a_100011217231_100015514636 [0,2,0,0,0,0|1,0,0]=3 4805 B12R1.25 C=CCOc1cccc(c1C)F 7a_100011217231_100015514636 [0,2,0,0,0,0|1,0,0]=3 4806 B12R1.25 C=CCOc1cccc(c1C)N 34a_100011216573_100015514636 [0,2,0,0,0,0|1,0,0]=3 4807 B12R1.25 C=CCOc1cccc(c1C)N 7a_100011216573_100015514636 [0,2,0,0,0,0|1,0,0]=3 4808 B12R1.25 C=CCOc1cccc(c1Cl)Br 34a_100010187913_100015514636 [0,2,0,0,0,0|1,0,0]=3 4809 B12R1.25 C=CCOc1cccc(c1Cl)Br 7a_100010187913_100015514636 [0,2,0,0,0,0|1,0,0]=3 4810 B12R1.25 C=CCOc1cccc(c1Cl)C 34a_100000695629_100015514636 [0,2,0,0,0,0|1,0,0]=3 4811 B12R1.25 C=CCOc1cccc(c1Cl)C 7a_100000695629_100015514636 [0,2,0,0,0,0|1,0,0]=3 4812 B12R1.25 C=CCOc1cccc(c1Cl)Cl 34a_100000211076_100015514636 [0,2,0,0,0,0|1,0,0]=3 4813 B12R1.25 C=CCOc1cccc(c1Cl)Cl 7a_100000211076_100015514636 [0,2,0,0,0,0|1,0,0]=3 4814 B12R1.25 C=CCOc1cccc(c1Cl)F 34a_100000087408_100015514636 [0,2,0,0,0,0|1,0,0]=3 4815 B12R1.25 C=CCOc1cccc(c1Cl)F 7a_100000087408_100015514636 [0,2,0,0,0,0|1,0,0]=3 4816 B12R1.25 C=CCOc1cccc(c1Cl)I 34a_100000049636_100015514636 [0,2,0,0,0,0|1,0,0]=3 4817 B12R1.25 C=CCOc1cccc(c1Cl)I 7a_100000049636_100015514636 [0,2,0,0,0,0|1,0,0]=3 4818 B12R1.25 C=CCOc1cccc(c1Cl)N 34a_100012002038_100015514636 [0,2,0,0,0,0|1,0,0]=3 4819 B12R1.25 C=CCOc1cccc(c1Cl)N 7a_100012002038_100015514636 [0,2,0,0,0,0|1,0,0]=3 4820 B12R1.25 C=CCOc1cccc(c1F)Br 34a_100009817021_100015514636 [0,2,0,0,0,0|1,0,0]=3 4821 B12R1.25 C=CCOc1cccc(c1F)Br 7a_100009817021_100015514636 [0,2,0,0,0,0|1,0,0]=3 4822 B12R1.25 C=CCOc1cccc(c1F)C 34a_100000751311_100015514636 [0,2,0,0,0,0|1,0,0]=3 4823 B12R1.25 C=CCOc1cccc(c1F)C 7a_100000751311_100015514636 [0,2,0,0,0,0|1,0,0]=3 4824 B12R1.25 C=CCOc1cccc(c1F)Cl 34a_100000687438_100015514636 [0,2,0,0,0,0|1,0,0]=3 4825 B12R1.25 C=CCOc1cccc(c1F)Cl 7a_100000687438_100015514636 [0,2,0,0,0,0|1,0,0]=3 4826 B12R1.25 C=CCOc1cccc(c1F)F 34a_100000751161_100015514636 [0,2,0,0,0,0|1,0,0]=3 4827 B12R1.25 C=CCOc1cccc(c1F)F 7a_100000751161_100015514636 [0,2,0,0,0,0|1,0,0]=3 4828 B12R1.25 C=CCOc1cccc(c1I)Br 34a_100010187912_100015514636 [0,2,0,0,0,0|1,0,0]=3 4829 B12R1.25 C=CCOc1cccc(c1I)Br 7a_100010187912_100015514636 [0,2,0,0,0,0|1,0,0]=3 4830 B12R1.25 C=CCOc1cccc(c1I)C 34a_100010083724_100015514636 [0,2,0,0,0,0|1,0,0]=3 4831 B12R1.25 C=CCOc1cccc(c1I)C 7a_100010083724_100015514636 [0,2,0,0,0,0|1,0,0]=3 4832 B12R1.25 C=CCOc1cccc(c1I)Cl 34a_100000050174_100015514636 [0,2,0,0,0,0|1,0,0]=3 4833 B12R1.25 C=CCOc1cccc(c1I)Cl 7a_100000050174_100015514636 [0,2,0,0,0,0|1,0,0]=3 4834 B12R1.25 C=CCOc1cccc(c1I)F 34a_100000690913_100015514636 [0,2,0,0,0,0|1,0,0]=3 4835 B12R1.25 C=CCOc1cccc(c1I)F 7a_100000690913_100015514636 [0,2,0,0,0,0|1,0,0]=3 4836 B12R1.25 C=CCOc1cccc(c1N)Br 34a_100011934926_100015514636 [0,2,0,0,0,0|1,0,0]=3 4837 B12R1.25 C=CCOc1cccc(c1N)Br 7a_100011934926_100015514636 [0,2,0,0,0,0|1,0,0]=3 4838 B12R1.25 C=CCOc1cccc(c1N)C 34a_100000743429_100015514636 [0,2,0,0,0,0|1,0,0]=3 4839 B12R1.25 C=CCOc1cccc(c1N)C 7a_100000743429_100015514636 [0,2,0,0,0,0|1,0,0]=3 4840 B12R1.25 C=CCOc1cccc(c1N)Cl 34a_100012022510_100015514636 [0,2,0,0,0,0|1,0,0]=3 4841 B12R1.25 C=CCOc1cccc(c1N)Cl 7a_100012022510_100015514636 [0,2,0,0,0,0|1,0,0]=3 4842 B12R1.25 C=CCOc1cccc(c1N)F 34a_100020591140_100015514636 [0,2,0,0,0,0|1,0,0]=3 4843 B12R1.25 C=CCOc1cccc(c1N)F 7a_100020591140_100015514636 [0,2,0,0,0,0|1,0,0]=3 4844 B12R1.25 C=CCOc1cccc(c1N)I 34a_200000049512_100015514636 [0,2,0,0,0,0|1,0,0]=3 4845 B12R1.25 C=CCOc1cccc(c1N)I 7a_200000049512_100015514636 [0,2,0,0,0,0|1,0,0]=3 4846 B12R1.25 C=CCOc1cccc(c1N)N 34a_100000033209_100015514636 [0,2,0,0,0,0|1,0,0]=3 4847 B12R1.25 C=CCOc1cccn(c1=O)C 34a_100000117616_100015514636 [0,2,0,0,0,0|1,0,1]=4 4848 B12R1.25 C=CCOc1cccn(c1=O)C 7a_100000117616_100015514636 [0,2,0,0,0,0|1,0,1]=4 4849 B12R1.25 C=CCOc1ccnc(c1Br)Cl 34a_100010136240_100015514636 [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.25 C=CCOc1ccnc(c1Cl)Cl 34a_100009860235_100015514636 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.25 C=CCOc1ccnc(c1F)Br 34a_100009876375_100015514636 [0,2,0,0,0,0|2,0,0]=4 4852 B12R1.25 C=CCOc1ccnc(c1F)Cl 34a_100009856406_100015514636 [0,2,0,0,0,0|2,0,0]=4 4853 B12R1.25 C=CCOc1ccnc(c1N)Cl 34a_100000128729_100015514636 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.25 C=CCOc1nccc(c1Br)C 34a_100012000493_100015514636 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.25 C=CCOc1nccc(c1C)Br 34a_100009858498_100015514636 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.25 C=CCOc1nccc(c1Cl)N 34a_200000093555_100015514636 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.25 C=CCSc1cccc(=O)n1C 62a_100000210623_100000726605 [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.25 C=CCSc1cccc(=O)n1C 62a_100000726605_100000210623 [0,2,0,0,0,0|2,0,0]=4 4859 B12R1.25 C=CCSc1cccc(c1Br)Br 62a_100000210623_100010175083 [0,2,0,0,0,0|1,0,0]=3 4860 B12R1.25 C=CCSc1cccc(c1Br)Br 62a_100010175083_100000210623 [0,2,0,0,0,0|1,0,0]=3 4861 B12R1.25 C=CCSc1cccc(c1Br)C 62a_100000210623_100012362457 [0,2,0,0,0,0|1,0,0]=3 4862 B12R1.25 C=CCSc1cccc(c1Br)C 62a_100012362457_100000210623 [0,2,0,0,0,0|1,0,0]=3 4863 B12R1.25 C=CCSc1cccc(c1Br)Cl 62a_100000210623_100014021842 [0,2,0,0,0,0|1,0,0]=3 4864 B12R1.25 C=CCSc1cccc(c1Br)Cl 62a_100014021842_100000210623 [0,2,0,0,0,0|1,0,0]=3 4865 B12R1.25 C=CCSc1cccc(c1Br)F 62a_100000210623_100010202630 [0,2,0,0,0,0|1,0,0]=3 4866 B12R1.25 C=CCSc1cccc(c1Br)F 62a_100010202630_100000210623 [0,2,0,0,0,0|1,0,0]=3 4867 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100000210623_100010187914 [0,2,0,0,0,0|1,0,0]=3 4868 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100010187914_100000210623 [0,2,0,0,0,0|1,0,0]=3 4869 B12R1.25 C=CCSc1cccc(c1C)Br 62a_100000210623_100012353703 [0,2,0,0,0,0|1,0,0]=3 4870 B12R1.25 C=CCSc1cccc(c1C)Br 62a_100012353703_100000210623 [0,2,0,0,0,0|1,0,0]=3 4871 B12R1.25 C=CCSc1cccc(c1C)C 62a_100000210623_100011214922 [0,2,0,0,0,0|1,0,0]=3 4872 B12R1.25 C=CCSc1cccc(c1C)C 62a_100011214922_100000210623 [0,2,0,0,0,0|1,0,0]=3 4873 B12R1.25 C=CCSc1cccc(c1C)Cl 62a_100000210623_100000726075 [0,2,0,0,0,0|1,0,0]=3 4874 B12R1.25 C=CCSc1cccc(c1C)Cl 62a_100000726075_100000210623 [0,2,0,0,0,0|1,0,0]=3 4875 B12R1.25 C=CCSc1cccc(c1C)F 62a_100000210623_100011216893 [0,2,0,0,0,0|1,0,0]=3 4876 B12R1.25 C=CCSc1cccc(c1C)F 62a_100011216893_100000210623 [0,2,0,0,0,0|1,0,0]=3 4877 B12R1.25 C=CCSc1cccc(c1C)N 62a_100000210623_100000761887 [0,2,0,0,0,0|1,0,0]=3 4878 B12R1.25 C=CCSc1cccc(c1C)N 62a_100000761887_100000210623 [0,2,0,0,0,0|1,0,0]=3 4879 B12R1.25 C=CCSc1cccc(c1C)O 62a_100000210623_100012002258 [0,2,0,0,0,0|1,0,0]=3 4880 B12R1.25 C=CCSc1cccc(c1C)O 62a_100012002258_100000210623 [0,2,0,0,0,0|1,0,0]=3 4881 B12R1.25 C=CCSc1cccc(c1Cl)Br 62a_100000210623_100010142854 [0,2,0,0,0,0|1,0,0]=3 4882 B12R1.25 C=CCSc1cccc(c1Cl)Br 62a_100010142854_100000210623 [0,2,0,0,0,0|1,0,0]=3 4883 B12R1.25 C=CCSc1cccc(c1Cl)C 62a_100000210623_200012352035 [0,2,0,0,0,0|1,0,0]=3 4884 B12R1.25 C=CCSc1cccc(c1Cl)C 62a_200012352035_100000210623 [0,2,0,0,0,0|1,0,0]=3 4885 B12R1.25 C=CCSc1cccc(c1Cl)Cl 62a_100000210623_100011215384 [0,2,0,0,0,0|1,0,0]=3 4886 B12R1.25 C=CCSc1cccc(c1Cl)Cl 62a_100011215384_100000210623 [0,2,0,0,0,0|1,0,0]=3 4887 B12R1.25 C=CCSc1cccc(c1Cl)F 62a_100000210623_200010234923 [0,2,0,0,0,0|1,0,0]=3 4888 B12R1.25 C=CCSc1cccc(c1Cl)F 62a_200010234923_100000210623 [0,2,0,0,0,0|1,0,0]=3 4889 B12R1.25 C=CCSc1cccc(c1Cl)O 62a_100000210623_100000049636 [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.25 C=CCSc1cccc(c1F)Br 62a_100000210623_100000702267 [0,2,0,0,0,0|1,0,0]=3 4891 B12R1.25 C=CCSc1cccc(c1F)Br 62a_100000702267_100000210623 [0,2,0,0,0,0|1,0,0]=3 4892 B12R1.25 C=CCSc1cccc(c1F)C 62a_100000210623_100000717567 [0,2,0,0,0,0|1,0,0]=3 4893 B12R1.25 C=CCSc1cccc(c1F)C 62a_100000717567_100000210623 [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.25 C=CCSc1cccc(c1F)Cl 62a_100000210623_100011217346 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.25 C=CCSc1cccc(c1F)Cl 62a_100011217346_100000210623 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.25 C=CCSc1cccc(c1F)F 62a_100000210623_100000694657 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.25 C=CCSc1cccc(c1F)F 62a_100000694657_100000210623 [0,2,0,0,0,0|1,0,0]=3 4898 B12R1.25 C=CCSc1cccc(c1F)N 62a_100000210623_100011935091 [0,2,0,0,0,0|1,0,0]=3 4899 B12R1.25 C=CCSc1cccc(c1F)N 62a_100011935091_100000210623 [0,2,0,0,0,0|1,0,0]=3 4900 B12R1.25 C=CCSc1cccc(c1F)O 62a_100000210623_100009817021 [0,2,0,0,0,0|1,0,0]=3 4901 B12R1.25 C=CCSc1cccc(c1F)O 62a_100009817021_100000210623 [0,2,0,0,0,0|1,0,0]=3 4902 B12R1.25 C=CCSc1cccc(c1N)Br 62a_100000210623_100010146558 [0,2,0,0,0,0|1,0,0]=3 4903 B12R1.25 C=CCSc1cccc(c1N)Br 62a_100010146558_100000210623 [0,2,0,0,0,0|1,0,0]=3 4904 B12R1.25 C=CCSc1cccc(c1N)C 62a_100000210623_100011834072 [0,2,0,0,0,0|1,0,0]=3 4905 B12R1.25 C=CCSc1cccc(c1N)C 62a_100011834072_100000210623 [0,2,0,0,0,0|1,0,0]=3 4906 B12R1.25 C=CCSc1cccc(c1N)Cl 62a_100000210623_100010190421 [0,2,0,0,0,0|1,0,0]=3 4907 B12R1.25 C=CCSc1cccc(c1N)Cl 62a_100010190421_100000210623 [0,2,0,0,0,0|1,0,0]=3 4908 B12R1.25 C=CCSc1cccc(c1N)F 62a_100000042321_100000210623 [0,2,0,0,0,0|1,0,0]=3 4909 B12R1.25 C=CCSc1cccc(c1N)F 62a_100000210623_100000042321 [0,2,0,0,0,0|1,0,0]=3 4910 B12R1.25 C=CCSc1cccc(c1N)N 62a_100015191791_100000210623 [0,2,0,0,0,0|1,0,0]=3 4911 B12R1.25 C=CCSc1cccc(c1N)O 62a_100000210623_100011934926 [0,2,0,0,0,0|1,0,0]=3 4912 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100000210623_100010084509 [0,2,0,0,0,0|0,0,0]=2 4913 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100010084509_100000210623 [0,2,0,0,0,0|0,0,0]=2 4914 B12R1.25 C=CCSc1cccc(c1O)C 62a_100000210623_100009817157 [0,2,0,0,0,0|0,0,0]=2 4915 B12R1.25 C=CCSc1cccc(c1O)C 62a_100009817157_100000210623 [0,2,0,0,0,0|0,0,0]=2 4916 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100000210623_100010202889 [0,2,0,0,0,0|0,0,0]=2 4917 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100010202889_100000210623 [0,2,0,0,0,0|0,0,0]=2 4918 B12R1.25 C=CCSc1cccc(c1O)F 62a_100000210623_100009813666 [0,2,0,0,0,0|0,0,0]=2 4919 B12R1.25 C=CCSc1cccc(c1O)F 62a_100009813666_100000210623 [0,2,0,0,0,0|0,0,0]=2 4920 B12R1.25 C=CCSc1cccc(c1O)N 62a_100000210623_100010084371 [0,2,0,0,0,0|0,0,0]=2 4921 B12R1.25 C=CCSc1cccc(c1O)N 62a_100011934915_100000210623 [0,2,0,0,0,0|0,0,0]=2 4922 B12R1.25 C=CCSc1cccc(c1O)O 62a_100000210623_100009815950 [0,2,0,0,0,0|0,0,0]=2 4923 B12R1.25 C=CCSc1cccn(c1=O)C 62a_100000210623_100000687173 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.25 C=CCSc1cccn(c1=O)C 62a_100000687173_100000210623 [0,2,0,0,0,0|1,0,1]=4 4925 B12R1.25 C=CCSc1ccnc(c1Br)F 62a_100000210623_100010006599 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.25 C=CCSc1ccnc(c1Br)F 62a_100010006599_100000210623 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.25 C=CCSc1ccnc(c1C)C 62a_100000210623_100009846815 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.25 C=CCSc1ccnc(c1C)C 62a_100009846815_100000210623 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.25 C=CCSc1ccnc(c1C)Cl 62a_100000047055_100000210623 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.25 C=CCSc1ccnc(c1C)Cl 62a_100000210623_100000047055 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.25 C=CCSc1ccnc(c1C)F 62a_100000210623_100010006593 [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.25 C=CCSc1ccnc(c1C)F 62a_100010006593_100000210623 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.25 C=CCSc1ccnc(c1C)N 62a_100000210623_100009865460 [0,2,0,0,0,0|2,0,0]=4 4934 B12R1.25 C=CCSc1ccnc(c1C)N 62a_100009865460_100000210623 [0,2,0,0,0,0|2,0,0]=4 4935 B12R1.25 C=CCSc1ccnc(c1C)O 62a_100000210623_100009858498 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.25 C=CCSc1ccnc(c1C)O 62a_100009858498_100000210623 [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.25 C=CCSc1ccnc(c1Cl)C 62a_100000210623_100000698670 [0,2,0,0,0,0|2,0,0]=4 4938 B12R1.25 C=CCSc1ccnc(c1Cl)C 62a_100000698670_100000210623 [0,2,0,0,0,0|2,0,0]=4 4939 B12R1.25 C=CCSc1ccnc(c1Cl)Cl 62a_100000210623_100010246212 [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.25 C=CCSc1ccnc(c1Cl)Cl 62a_100010246212_100000210623 [0,2,0,0,0,0|2,0,0]=4 4941 B12R1.25 C=CCSc1ccnc(c1Cl)F 62a_100000210623_100010067886 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.25 C=CCSc1ccnc(c1Cl)F 62a_100010067886_100000210623 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.25 C=CCSc1ccnc(c1Cl)N 62a_100000210623_100010735111 [0,2,0,0,0,0|2,0,0]=4 4944 B12R1.25 C=CCSc1ccnc(c1Cl)N 62a_100010735111_100000210623 [0,2,0,0,0,0|2,0,0]=4 4945 B12R1.25 C=CCSc1ccnc(c1F)Br 62a_100000210623_200015269031 [0,2,0,0,0,0|2,0,0]=4 4946 B12R1.25 C=CCSc1ccnc(c1F)Br 62a_200015269031_100000210623 [0,2,0,0,0,0|2,0,0]=4 4947 B12R1.25 C=CCSc1ccnc(c1F)C 62a_100000210623_100009849794 [0,2,0,0,0,0|2,0,0]=4 4948 B12R1.25 C=CCSc1ccnc(c1F)C 62a_100009849794_100000210623 [0,2,0,0,0,0|2,0,0]=4 4949 B12R1.25 C=CCSc1ccnc(c1F)Cl 62a_100000210623_100010150473 [0,2,0,0,0,0|2,0,0]=4 4950 B12R1.25 C=CCSc1ccnc(c1F)Cl 62a_100010150473_100000210623 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.25 C=CCSc1ccnc(c1F)F 62a_100000210623_100010214882 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.25 C=CCSc1ccnc(c1F)F 62a_100010214882_100000210623 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.25 C=CCSc1ccnc(c1F)N 62a_100000210623_100010077785 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.25 C=CCSc1ccnc(c1F)N 62a_100010077785_100000210623 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.25 C=CCSc1ccnc(c1N)C 62a_100000210623_100009885578 [0,2,0,0,0,0|2,0,0]=4 4956 B12R1.25 C=CCSc1ccnc(c1N)C 62a_100009885578_100000210623 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.25 C=CCSc1ccnc(c1N)N 62a_100000124095_100000210623 [0,2,0,0,0,0|2,0,0]=4 4958 B12R1.25 C=CCSc1ccnc(c1O)Cl 62a_100000210623_100010067911 [0,2,0,0,0,0|1,0,0]=3 4959 B12R1.25 C=CCSc1cncc(c1C)Br 62a_100000210623_100010109657 [0,2,0,0,0,0|2,0,0]=4 4960 B12R1.25 C=CCSc1cncc(c1C)Br 62a_100010109657_100000210623 [0,2,0,0,0,0|2,0,0]=4 4961 B12R1.25 C=CCSc1cncc(c1C)C 62a_100000210623_100009864703 [0,2,0,0,0,0|2,0,0]=4 4962 B12R1.25 C=CCSc1cncc(c1C)C 62a_100009864703_100000210623 [0,2,0,0,0,0|2,0,0]=4 4963 B12R1.25 C=CCSc1cncc(c1C)F 62a_100000210623_100009881546 [0,2,0,0,0,0|2,0,0]=4 4964 B12R1.25 C=CCSc1cncc(c1C)F 62a_100009881546_100000210623 [0,2,0,0,0,0|2,0,0]=4 4965 B12R1.25 C=CCSc1cncc(c1C)N 62a_100000210623_100011998293 [0,2,0,0,0,0|2,0,0]=4 4966 B12R1.25 C=CCSc1cncc(c1C)N 62a_100011998293_100000210623 [0,2,0,0,0,0|2,0,0]=4 4967 B12R1.25 C=CCSc1cncc(c1N)Br 62a_100000210623_100011290786 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.25 C=CCSc1cncc(c1N)Br 62a_100011290786_100000210623 [0,2,0,0,0,0|2,0,0]=4 4969 B12R1.25 C=CCSc1cncc(c1N)C 62a_100000210623_100009818025 [0,2,0,0,0,0|2,0,0]=4 4970 B12R1.25 C=CCSc1cncc(c1N)C 62a_100009818025_100000210623 [0,2,0,0,0,0|2,0,0]=4 4971 B12R1.25 C=CCSc1cncc(c1N)Cl 62a_100000210623_100000684942 [0,2,0,0,0,0|2,0,0]=4 4972 B12R1.25 C=CCSc1cncc(c1N)Cl 62a_100000684942_100000210623 [0,2,0,0,0,0|2,0,0]=4 4973 B12R1.25 C=CCSc1cncc(c1N)F 62a_100000210623_100009880649 [0,2,0,0,0,0|2,0,0]=4 4974 B12R1.25 C=CCSc1cncc(c1N)F 62a_100009880649_100000210623 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.25 C=CCSc1cncc(c1N)N 62a_100000210623_100000694774 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.25 C=CCSc1cncc(c1N)N 62a_100000694774_100000210623 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.25 C=CCSc1cncc(c1O)N 62a_100000210623_100000694263 [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.25 C=CCSc1cncc(c1O)N 62a_100000694263_100000210623 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.25 C=CCSc1nccc(c1C)C 62a_100000210623_100009847204 [0,2,0,0,0,0|2,0,0]=4 4980 B12R1.25 C=CCSc1nccc(c1C)C 62a_100009847204_100000210623 [0,2,0,0,0,0|2,0,0]=4 4981 B12R1.25 C=CCSc1nccc(c1C)F 62a_100000210623_100009846374 [0,2,0,0,0,0|2,0,0]=4 4982 B12R1.25 C=CCSc1nccc(c1C)F 62a_100009846374_100000210623 [0,2,0,0,0,0|2,0,0]=4 4983 B12R1.25 C=CCSc1nccc(c1C)N 62a_100000210623_100000690622 [0,2,0,0,0,0|2,0,0]=4 4984 B12R1.25 C=CCSc1nccc(c1C)N 62a_100000690622_100000210623 [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.25 C=CCSc1nccc(c1F)C 62a_100000210623_100009817629 [0,2,0,0,0,0|2,0,0]=4 4986 B12R1.25 C=CCSc1nccc(c1F)C 62a_100009817629_100000210623 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.25 C=CCSc1nccc(c1F)N 62a_100000210623_100015205195 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.25 C=CCSc1nccc(c1F)N 62a_100015205195_100000210623 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.25 C=CCSc1nccc(c1F)O 62a_100000210623_100009876375 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.25 C=CCSc1nccc(c1F)O 62a_100009876375_100000210623 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.25 C=CCSc1nccc(c1N)C 62a_100000210623_100000763560 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.25 C=CCSc1nccc(c1N)C 62a_100000763560_100000210623 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.25 C=CCSc1nccc(c1N)N 62a_100000085203_100000210623 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.25 C=CCSc1nccc(c1N)N 62a_100000210623_100000085203 [0,2,0,0,0,0|2,0,0]=4 4995 B12R1.25 C=CCSc1nccc(c1O)C 62a_100000210623_100000696282 [0,2,0,0,0,0|1,0,0]=3 4996 B12R1.25 C=CCSc1nccc(c1O)F 62a_100000210623_100009867227 [0,2,0,0,0,0|1,0,0]=3 4997 B12R1.25 C=CCSc1nccc(c1O)N 62a_100000210623_100009844647 [0,2,0,0,0,0|1,0,0]=3 4998 B12R1.25 C=CCSc1ncnc(c1O)N 62a_100000210623_100000124137 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.25 CCCCc1cccc(c1O)Br 271570a_100020621405_100010084509 [0,2,0,0,0,0|0,0,2]=4 5000 B12R1.25 CCCCc1cccc(c1O)C 271570a_100020621405_100009817157 [0,2,0,0,0,0|0,0,2]=4 5001 B12R1.25 CCCCc1cccc(c1O)Cl 271570a_100020621405_100010202889 [0,2,0,0,0,0|0,0,2]=4 5002 B12R1.25 CCCCc1cccc(c1O)F 271570a_100020621405_100009813666 [0,2,0,0,0,0|0,0,2]=4 5003 B12R1.25 CCCCc1cccc(c1O)N 271570a_100020621405_100011934915 [0,2,0,0,0,0|0,0,2]=4 5004 B12R1.25 CCCCc1cccc(c1O)O 271570a_100020621405_100009815950 [0,2,0,0,0,0|0,0,2]=4 5005 B12R1.25 CCCNc1cccc(c1O)Br 34a_100011934915_100000210303 [0,2,0,0,0,0|0,0,2]=4 5006 B12R1.25 CCCNc1cccc(c1O)C 34a_100000756359_100000210303 [0,2,0,0,0,0|0,0,2]=4 5007 B12R1.25 CCCNc1cccc(c1O)Cl 34a_100000754742_100000210303 [0,2,0,0,0,0|0,0,2]=4 5008 B12R1.25 CCCNc1cccc(c1O)F 34a_100011934987_100000210303 [0,2,0,0,0,0|0,0,2]=4 5009 B12R1.25 CCCSc1cccc(c1O)Br 62a_100000210303_100010084509 [0,2,0,0,0,0|0,0,2]=4 5010 B12R1.25 CCCSc1cccc(c1O)Br 62a_100010084509_100000210303 [0,2,0,0,0,0|0,0,2]=4 5011 B12R1.25 CCCSc1cccc(c1O)C 62a_100000210303_100009817157 [0,2,0,0,0,0|0,0,2]=4 5012 B12R1.25 CCCSc1cccc(c1O)C 62a_100009817157_100000210303 [0,2,0,0,0,0|0,0,2]=4 5013 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100000210303_100010202889 [0,2,0,0,0,0|0,0,2]=4 5014 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100010202889_100000210303 [0,2,0,0,0,0|0,0,2]=4 5015 B12R1.25 CCCSc1cccc(c1O)F 62a_100000210303_100009813666 [0,2,0,0,0,0|0,0,2]=4 5016 B12R1.25 CCCSc1cccc(c1O)F 62a_100009813666_100000210303 [0,2,0,0,0,0|0,0,2]=4 5017 B12R1.25 CCCSc1cccc(c1O)N 62a_100000210303_100010084371 [0,2,0,0,0,0|0,0,2]=4 5018 B12R1.25 CCCSc1cccc(c1O)N 62a_100011934915_100000210303 [0,2,0,0,0,0|0,0,2]=4 5019 B12R1.25 CCCSc1cccc(c1O)O 62a_100000210303_100009815950 [0,2,0,0,0,0|0,0,2]=4 5020 B12R1.25 CCNCc1cccc(c1O)C 34a_100020639391_100000210202 [0,2,0,0,0,0|0,0,2]=4 5021 B12R1.25 COCSc1cccc(c1O)Br 62a_100000766300_100010084509 [0,2,0,0,0,0|1,0,1]=4 5022 B12R1.25 COCSc1cccc(c1O)Br 62a_100010084509_100000766300 [0,2,0,0,0,0|1,0,1]=4 5023 B12R1.25 COCSc1cccc(c1O)C 62a_100000766300_100009817157 [0,2,0,0,0,0|1,0,1]=4 5024 B12R1.25 COCSc1cccc(c1O)C 62a_100009817157_100000766300 [0,2,0,0,0,0|1,0,1]=4 5025 B12R1.25 COCSc1cccc(c1O)Cl 62a_100000766300_100010202889 [0,2,0,0,0,0|1,0,1]=4 5026 B12R1.25 COCSc1cccc(c1O)Cl 62a_100010202889_100000766300 [0,2,0,0,0,0|1,0,1]=4 5027 B12R1.25 COCSc1cccc(c1O)F 62a_100000766300_100009813666 [0,2,0,0,0,0|1,0,1]=4 5028 B12R1.25 COCSc1cccc(c1O)F 62a_100009813666_100000766300 [0,2,0,0,0,0|1,0,1]=4 5029 B12R1.25 COCSc1cccc(c1O)N 62a_100000766300_100010084371 [0,2,0,0,0,0|1,0,1]=4 5030 B12R1.25 COCSc1cccc(c1O)N 62a_100011934915_100000766300 [0,2,0,0,0,0|1,0,1]=4 5031 B12R1.25 COCSc1cccc(c1O)O 62a_100000766300_100009815950 [0,2,0,0,0,0|1,0,1]=4 5032 B12R1.25 CSCNc1cccc(c1O)Br 34a_100011934915_100011218213 [0,2,0,0,0,0|1,0,1]=4 5033 B12R1.25 CSCNc1cccc(c1O)C 34a_100000756359_100011218213 [0,2,0,0,0,0|1,0,1]=4 5034 B12R1.25 CSCNc1cccc(c1O)Cl 34a_100000754742_100011218213 [0,2,0,0,0,0|1,0,1]=4 5035 B12R1.25 CSCNc1cccc(c1O)F 34a_100011934987_100011218213 [0,2,0,0,0,0|1,0,1]=4 5036 B12R1.25 CSCSc1cccc(c1O)Br 62a_100010084509_100011218213 [0,2,0,0,0,0|1,0,1]=4 5037 B12R1.25 CSCSc1cccc(c1O)Br 62a_100011218213_100010084509 [0,2,0,0,0,0|1,0,1]=4 5038 B12R1.25 CSCSc1cccc(c1O)C 62a_100009817157_100011218213 [0,2,0,0,0,0|1,0,1]=4 5039 B12R1.25 CSCSc1cccc(c1O)C 62a_100011218213_100009817157 [0,2,0,0,0,0|1,0,1]=4 5040 B12R1.25 CSCSc1cccc(c1O)Cl 62a_100010202889_100011218213 [0,2,0,0,0,0|1,0,1]=4 5041 B12R1.25 CSCSc1cccc(c1O)Cl 62a_100011218213_100010202889 [0,2,0,0,0,0|1,0,1]=4 5042 B12R1.25 CSCSc1cccc(c1O)F 62a_100009813666_100011218213 [0,2,0,0,0,0|1,0,1]=4 5043 B12R1.25 CSCSc1cccc(c1O)F 62a_100011218213_100009813666 [0,2,0,0,0,0|1,0,1]=4 5044 B12R1.25 CSCSc1cccc(c1O)N 62a_100011218213_100010084371 [0,2,0,0,0,0|1,0,1]=4 5045 B12R1.25 CSCSc1cccc(c1O)N 62a_100011934915_100011218213 [0,2,0,0,0,0|1,0,1]=4 5046 B12R1.25 CSCSc1cccc(c1O)O 62a_100011218213_100009815950 [0,2,0,0,0,0|1,0,1]=4 5047 B12R1.25 Cc1c(cccc1NCC=O)Br 34a_100000750434_200009817547 [0,2,0,0,0,0|2,0,0]=4 5048 B12R1.25 Cc1c(cccc1NCC=O)Cl 2230a_100000210441_200015260668 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.25 Cc1c(cccc1NCC=O)Cl 34a_100000210441_200009817547 [0,2,0,0,0,0|2,0,0]=4 5050 B12R1.25 Cc1c(cccc1NCC=O)Cl 7a_100000210441_200015260668 [0,2,0,0,0,0|2,0,0]=4 5051 B12R1.25 Cc1c(cccc1NCC=O)F 34a_100000745574_200009817547 [0,2,0,0,0,0|2,0,0]=4 5052 B12R1.25 Cc1c(cccc1NCC=O)F 7a_100000745574_200015260668 [0,2,0,0,0,0|2,0,0]=4 5053 B12R1.25 Cc1c(cccc1NCC=O)I 34a_100000761887_200009817547 [0,2,0,0,0,0|2,0,0]=4 5054 B12R1.25 Cc1c(cccc1NCC=O)O 34a_100011216573_200009817547 [0,2,0,0,0,0|2,0,0]=4 5055 B12R1.25 Cc1c(cccc1NCC=O)O 7a_100011216573_200015260668 [0,2,0,0,0,0|2,0,0]=4 5056 B12R1.25 Cc1c(cccc1OCC=O)Br 34a_100012002258_200009817547 [0,2,0,0,0,0|2,0,0]=4 5057 B12R1.25 Cc1c(cccc1OCC=O)Br 7a_100012002258_200015260668 [0,2,0,0,0,0|2,0,0]=4 5058 B12R1.25 Cc1c(cccc1OCC=O)Cl 34a_100011265684_200009817547 [0,2,0,0,0,0|2,0,0]=4 5059 B12R1.25 Cc1c(cccc1OCC=O)Cl 7a_100011265684_200015260668 [0,2,0,0,0,0|2,0,0]=4 5060 B12R1.25 Cc1c(cccc1OCC=O)F 34a_100011217231_200009817547 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.25 Cc1c(cccc1OCC=O)F 7a_100011217231_200015260668 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.25 Cc1c(cccc1OCC=O)N 34a_100011216573_200009817547 [0,2,0,0,0,0|2,0,0]=4 5063 B12R1.25 Cc1c(cccc1OCC=O)N 7a_100011216573_200015260668 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.25 Cc1c(cccc1SCC=O)Br 62a_100012353703_200015260668 [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.25 Cc1c(cccc1SCC=O)Br 62a_200015260668_100012353703 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.25 Cc1c(cccc1SCC=O)Cl 62a_100000726075_200015260668 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.25 Cc1c(cccc1SCC=O)Cl 62a_200015260668_100000726075 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.25 Cc1c(cccc1SCC=O)F 62a_100011216893_200015260668 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.25 Cc1c(cccc1SCC=O)F 62a_200015260668_100011216893 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.25 Cc1c(cccc1SCC=O)N 62a_100000761887_200015260668 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.25 Cc1c(cccc1SCC=O)N 62a_200015260668_100000761887 [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.25 Cc1c(cccc1SCC=O)O 62a_100012002258_200015260668 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.25 Cc1c(cccc1SCC=O)O 62a_200015260668_100012002258 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.25 Cc1cccc(c1Br)NCC=O 34a_100000684715_200009817547 [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.25 Cc1cccc(c1Br)OCC=O 34a_100000686692_200009817547 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.25 Cc1cccc(c1Br)OCC=O 7a_100000686692_200015260668 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.25 Cc1cccc(c1Br)SCC=O 62a_100012362457_200015260668 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.25 Cc1cccc(c1Br)SCC=O 62a_200015260668_100012362457 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.25 Cc1cccc(c1C)NCC=O 2230a_100000210026_200015260668 [0,2,0,0,0,0|2,0,0]=4 5080 B12R1.25 Cc1cccc(c1C)NCC=O 34a_100000210026_200009817547 [0,2,0,0,0,0|2,0,0]=4 5081 B12R1.25 Cc1cccc(c1C)NCC=O 7a_100000210026_200015260668 [0,2,0,0,0,0|2,0,0]=4 5082 B12R1.25 Cc1cccc(c1C)OCC=O 34a_100000185855_200009817547 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.25 Cc1cccc(c1C)OCC=O 7a_100000185855_200015260668 [0,2,0,0,0,0|2,0,0]=4 5084 B12R1.25 Cc1cccc(c1C)SCC=O 62a_100011214922_200015260668 [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.25 Cc1cccc(c1C)SCC=O 62a_200015260668_100011214922 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.25 Cc1cccc(c1Cl)NCC=O 34a_100000765562_200009817547 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.25 Cc1cccc(c1Cl)NCC=O 7a_100000765562_200015260668 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.25 Cc1cccc(c1Cl)OCC=O 34a_100000695629_200009817547 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.25 Cc1cccc(c1Cl)OCC=O 7a_100000695629_200015260668 [0,2,0,0,0,0|2,0,0]=4 5090 B12R1.25 Cc1cccc(c1Cl)SCC=O 62a_200012352035_200015260668 [0,2,0,0,0,0|2,0,0]=4 5091 B12R1.25 Cc1cccc(c1Cl)SCC=O 62a_200015260668_200012352035 [0,2,0,0,0,0|2,0,0]=4 5092 B12R1.25 Cc1cccc(c1F)NCC=O 2230a_100000697159_200015260668 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.25 Cc1cccc(c1F)NCC=O 34a_100000697159_200009817547 [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.25 Cc1cccc(c1F)NCC=O 7a_100000697159_200015260668 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.25 Cc1cccc(c1F)OCC=O 34a_100000751311_200009817547 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.25 Cc1cccc(c1F)OCC=O 7a_100000751311_200015260668 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.25 Cc1cccc(c1F)SCC=O 62a_100000717567_200015260668 [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.25 Cc1cccc(c1F)SCC=O 62a_200015260668_100000717567 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.25 Cc1cccc(c1I)NCC=O 34a_100000761888_200009817547 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.25 Cc1cccc(c1I)OCC=O 34a_100010083724_200009817547 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.25 Cc1cccc(c1I)OCC=O 7a_100010083724_200015260668 [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.25 Cc1cccc(c1N)OCC=O 34a_100000743429_200009817547 [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.25 Cc1cccc(c1N)OCC=O 7a_100000743429_200015260668 [0,2,0,0,0,0|2,0,0]=4 5104 B12R1.25 Cc1cccc(c1N)SCC=O 62a_100011834072_200015260668 [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.25 Cc1cccc(c1N)SCC=O 62a_200015260668_100011834072 [0,2,0,0,0,0|2,0,0]=4 5106 B12R1.25 Cc1cccc(c1O)CNCF 34a_100020639391_100015361967 [0,2,0,0,0,0|1,0,1]=4 5107 B12R1.25 Cc1cccc(c1O)NCC=O 34a_100000756359_200009817547 [0,2,0,0,0,0|1,0,0]=3 5108 B12R1.25 Cc1cccc(c1O)NCCF 34a_100000756359_100011217306 [0,2,0,0,0,0|1,0,1]=4 5109 B12R1.25 Cc1cccc(c1O)NCCO 34a_100000756359_100000211926 [0,2,0,0,0,0|1,0,1]=4 5110 B12R1.25 Cc1cccc(c1O)SCC#N 62a_100009817157_100011215382 [0,2,0,0,0,0|1,0,1]=4 5111 B12R1.25 Cc1cccc(c1O)SCC#N 62a_100011215382_100009817157 [0,2,0,0,0,0|1,0,1]=4 5112 B12R1.25 Cc1cccc(c1O)SCC=O 62a_100009817157_200015260668 [0,2,0,0,0,0|1,0,0]=3 5113 B12R1.25 Cc1cccc(c1O)SCC=O 62a_200015260668_100009817157 [0,2,0,0,0,0|1,0,0]=3 5114 B12R1.25 Cc1cccc(c1O)SCCF 62a_100009817157_100011217306 [0,2,0,0,0,0|1,0,1]=4 5115 B12R1.25 Cc1cccc(c1O)SCCF 62a_100011217306_100009817157 [0,2,0,0,0,0|1,0,1]=4 5116 B12R1.25 Cc1cccc(c1O)SCCO 62a_100000211926_100009817157 [0,2,0,0,0,0|1,0,1]=4 5117 B12R1.25 Cc1cccc(c1O)SCCO 62a_100009817157_100000211926 [0,2,0,0,0,0|1,0,1]=4 5118 B12R1.25 Cc1ccnc(c1O)SCC=O 62a_200015260668_100000696282 [0,2,0,0,0,0|2,0,0]=4 5119 B12R1.25 N#CCSc1cccc(c1O)Br 62a_100010084509_100011215382 [0,2,0,0,0,0|1,0,1]=4 5120 B12R1.25 N#CCSc1cccc(c1O)Br 62a_100011215382_100010084509 [0,2,0,0,0,0|1,0,1]=4 5121 B12R1.25 N#CCSc1cccc(c1O)Cl 62a_100010202889_100011215382 [0,2,0,0,0,0|1,0,1]=4 5122 B12R1.25 N#CCSc1cccc(c1O)Cl 62a_100011215382_100010202889 [0,2,0,0,0,0|1,0,1]=4 5123 B12R1.25 N#CCSc1cccc(c1O)F 62a_100009813666_100011215382 [0,2,0,0,0,0|1,0,1]=4 5124 B12R1.25 N#CCSc1cccc(c1O)F 62a_100011215382_100009813666 [0,2,0,0,0,0|1,0,1]=4 5125 B12R1.25 N#CCSc1cccc(c1O)N 62a_100011215382_100010084371 [0,2,0,0,0,0|1,0,1]=4 5126 B12R1.25 N#CCSc1cccc(c1O)N 62a_100011934915_100011215382 [0,2,0,0,0,0|1,0,1]=4 5127 B12R1.25 N#CCSc1cccc(c1O)O 62a_100011215382_100009815950 [0,2,0,0,0,0|1,0,1]=4 5128 B12R1.25 Nc1c(cccc1OCC=O)Br 34a_100011934926_200009817547 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.25 Nc1c(cccc1OCC=O)Br 7a_100011934926_200015260668 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.25 Nc1c(cccc1OCC=O)Cl 34a_100012022510_200009817547 [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.25 Nc1c(cccc1OCC=O)Cl 7a_100012022510_200015260668 [0,2,0,0,0,0|2,0,0]=4 5132 B12R1.25 Nc1c(cccc1OCC=O)F 34a_100020591140_200009817547 [0,2,0,0,0,0|2,0,0]=4 5133 B12R1.25 Nc1c(cccc1OCC=O)F 7a_100020591140_200015260668 [0,2,0,0,0,0|2,0,0]=4 5134 B12R1.25 Nc1c(cccc1OCC=O)I 34a_200000049512_200009817547 [0,2,0,0,0,0|2,0,0]=4 5135 B12R1.25 Nc1c(cccc1OCC=O)I 7a_200000049512_200015260668 [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.25 Nc1c(cccc1SCC=O)Br 62a_100010146558_200015260668 [0,2,0,0,0,0|2,0,0]=4 5137 B12R1.25 Nc1c(cccc1SCC=O)Br 62a_200015260668_100010146558 [0,2,0,0,0,0|2,0,0]=4 5138 B12R1.25 Nc1c(cccc1SCC=O)Cl 62a_100010190421_200015260668 [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.25 Nc1c(cccc1SCC=O)Cl 62a_200015260668_100010190421 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.25 Nc1c(cccc1SCC=O)F 62a_100000042321_200015260668 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.25 Nc1c(cccc1SCC=O)F 62a_200015260668_100000042321 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.25 Nc1c(cccc1SCC=O)O 62a_200015260668_100011934926 [0,2,0,0,0,0|2,0,0]=4 5143 B12R1.25 Nc1cccc(c1Br)OCC=O 34a_100012183704_200009817547 [0,2,0,0,0,0|2,0,0]=4 5144 B12R1.25 Nc1cccc(c1Br)OCC=O 7a_100012183704_200015260668 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.25 Nc1cccc(c1Cl)OCC=O 34a_100012002038_200009817547 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.25 Nc1cccc(c1Cl)OCC=O 7a_100012002038_200015260668 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.25 Nc1cccc(c1F)SCC=O 62a_100011935091_200015260668 [0,2,0,0,0,0|2,0,0]=4 5148 B12R1.25 Nc1cccc(c1F)SCC=O 62a_200015260668_100011935091 [0,2,0,0,0,0|2,0,0]=4 5149 B12R1.25 Nc1cccc(c1N)OCC=O 34a_100000033209_200009817547 [0,2,0,0,0,0|2,0,0]=4 5150 B12R1.25 Nc1cccc(c1N)SCC=O 62a_100015191791_200015260668 [0,2,0,0,0,0|2,0,0]=4 5151 B12R1.25 Nc1cccc(c1O)SCC=O 62a_100011934915_200015260668 [0,2,0,0,0,0|1,0,0]=3 5152 B12R1.25 Nc1cccc(c1O)SCC=O 62a_200015260668_100010084371 [0,2,0,0,0,0|1,0,0]=3 5153 B12R1.25 Nc1cccc(c1O)SCCF 62a_100011217306_100010084371 [0,2,0,0,0,0|1,0,1]=4 5154 B12R1.25 Nc1cccc(c1O)SCCF 62a_100011934915_100011217306 [0,2,0,0,0,0|1,0,1]=4 5155 B12R1.25 Nc1cccc(c1O)SCCO 62a_100000211926_100010084371 [0,2,0,0,0,0|1,0,1]=4 5156 B12R1.25 Nc1cccc(c1O)SCCO 62a_100011934915_100000211926 [0,2,0,0,0,0|1,0,1]=4 5157 B12R1.25 Nc1ccnc(c1O)SCC=O 62a_200015260668_100009844647 [0,2,0,0,0,0|2,0,0]=4 5158 B12R1.25 Nc1cncc(c1O)SCC=O 62a_100000694263_200015260668 [0,2,0,0,0,0|2,0,0]=4 5159 B12R1.25 Nc1cncc(c1O)SCC=O 62a_200015260668_100000694263 [0,2,0,0,0,0|2,0,0]=4 5160 B12R1.25 O=CCNc1cccc(c1Br)Cl 34a_100000687072_200009817547 [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.25 O=CCNc1cccc(c1Br)F 34a_100011934729_200009817547 [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.25 O=CCNc1cccc(c1Br)O 34a_100012183704_200009817547 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.25 O=CCNc1cccc(c1Br)O 7a_100012183704_200015260668 [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.25 O=CCNc1cccc(c1Cl)Br 34a_100000687075_200009817547 [0,2,0,0,0,0|2,0,0]=4 5165 B12R1.25 O=CCNc1cccc(c1Cl)Cl 34a_100000185733_200009817547 [0,2,0,0,0,0|2,0,0]=4 5166 B12R1.25 O=CCNc1cccc(c1Cl)F 34a_100000692321_200009817547 [0,2,0,0,0,0|2,0,0]=4 5167 B12R1.25 O=CCNc1cccc(c1Cl)O 34a_100012002038_200009817547 [0,2,0,0,0,0|2,0,0]=4 5168 B12R1.25 O=CCNc1cccc(c1Cl)O 7a_100012002038_200015260668 [0,2,0,0,0,0|2,0,0]=4 5169 B12R1.25 O=CCNc1cccc(c1F)Br 2230a_100011935091_200015260668 [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.25 O=CCNc1cccc(c1F)Br 34a_100011935091_200009817547 [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.25 O=CCNc1cccc(c1F)Cl 2230a_100000199060_200015260668 [0,2,0,0,0,0|2,0,0]=4 5172 B12R1.25 O=CCNc1cccc(c1F)Cl 34a_100000199060_200009817547 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.25 O=CCNc1cccc(c1F)F 34a_100000743855_200009817547 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.25 O=CCNc1cccc(c1I)Br 34a_100020590159_200009817547 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.25 O=CCNc1cccc(c1I)Cl 34a_100000049713_200009817547 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.25 O=CCNc1cccc(c1I)F 34a_100000690935_200009817547 [0,2,0,0,0,0|2,0,0]=4 5177 B12R1.25 O=CCNc1cccc(c1O)Br 34a_100011934915_200009817547 [0,2,0,0,0,0|1,0,0]=3 5178 B12R1.25 O=CCNc1cccc(c1O)Cl 34a_100000754742_200009817547 [0,2,0,0,0,0|1,0,0]=3 5179 B12R1.25 O=CCNc1cccc(c1O)F 34a_100011934987_200009817547 [0,2,0,0,0,0|1,0,0]=3 5180 B12R1.25 O=CCOc1cccc(c1Br)Br 34a_100010187966_200009817547 [0,2,0,0,0,0|2,0,0]=4 5181 B12R1.25 O=CCOc1cccc(c1Br)Br 7a_100010187966_200015260668 [0,2,0,0,0,0|2,0,0]=4 5182 B12R1.25 O=CCOc1cccc(c1Br)Cl 34a_100012348804_200009817547 [0,2,0,0,0,0|2,0,0]=4 5183 B12R1.25 O=CCOc1cccc(c1Br)Cl 7a_100012348804_200015260668 [0,2,0,0,0,0|2,0,0]=4 5184 B12R1.25 O=CCOc1cccc(c1Br)F 34a_100009820682_200009817547 [0,2,0,0,0,0|2,0,0]=4 5185 B12R1.25 O=CCOc1cccc(c1Br)F 7a_100009820682_200015260668 [0,2,0,0,0,0|2,0,0]=4 5186 B12R1.25 O=CCOc1cccc(c1Br)I 34a_100010187914_200009817547 [0,2,0,0,0,0|2,0,0]=4 5187 B12R1.25 O=CCOc1cccc(c1Br)I 7a_100010187914_200015260668 [0,2,0,0,0,0|2,0,0]=4 5188 B12R1.25 O=CCOc1cccc(c1Cl)Br 34a_100010187913_200009817547 [0,2,0,0,0,0|2,0,0]=4 5189 B12R1.25 O=CCOc1cccc(c1Cl)Br 7a_100010187913_200015260668 [0,2,0,0,0,0|2,0,0]=4 5190 B12R1.25 O=CCOc1cccc(c1Cl)Cl 34a_100000211076_200009817547 [0,2,0,0,0,0|2,0,0]=4 5191 B12R1.25 O=CCOc1cccc(c1Cl)Cl 7a_100000211076_200015260668 [0,2,0,0,0,0|2,0,0]=4 5192 B12R1.25 O=CCOc1cccc(c1Cl)F 34a_100000087408_200009817547 [0,2,0,0,0,0|2,0,0]=4 5193 B12R1.25 O=CCOc1cccc(c1Cl)F 7a_100000087408_200015260668 [0,2,0,0,0,0|2,0,0]=4 5194 B12R1.25 O=CCOc1cccc(c1Cl)I 34a_100000049636_200009817547 [0,2,0,0,0,0|2,0,0]=4 5195 B12R1.25 O=CCOc1cccc(c1Cl)I 7a_100000049636_200015260668 [0,2,0,0,0,0|2,0,0]=4 5196 B12R1.25 O=CCOc1cccc(c1F)Br 34a_100009817021_200009817547 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.25 O=CCOc1cccc(c1F)Br 7a_100009817021_200015260668 [0,2,0,0,0,0|2,0,0]=4 5198 B12R1.25 O=CCOc1cccc(c1F)Cl 34a_100000687438_200009817547 [0,2,0,0,0,0|2,0,0]=4 5199 B12R1.25 O=CCOc1cccc(c1F)Cl 7a_100000687438_200015260668 [0,2,0,0,0,0|2,0,0]=4 5200 B12R1.25 O=CCOc1cccc(c1F)F 34a_100000751161_200009817547 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.25 O=CCOc1cccc(c1F)F 7a_100000751161_200015260668 [0,2,0,0,0,0|2,0,0]=4 5202 B12R1.25 O=CCOc1cccc(c1I)Br 34a_100010187912_200009817547 [0,2,0,0,0,0|2,0,0]=4 5203 B12R1.25 O=CCOc1cccc(c1I)Br 7a_100010187912_200015260668 [0,2,0,0,0,0|2,0,0]=4 5204 B12R1.25 O=CCOc1cccc(c1I)Cl 34a_100000050174_200009817547 [0,2,0,0,0,0|2,0,0]=4 5205 B12R1.25 O=CCOc1cccc(c1I)Cl 7a_100000050174_200015260668 [0,2,0,0,0,0|2,0,0]=4 5206 B12R1.25 O=CCOc1cccc(c1I)F 34a_100000690913_200009817547 [0,2,0,0,0,0|2,0,0]=4 5207 B12R1.25 O=CCOc1cccc(c1I)F 7a_100000690913_200015260668 [0,2,0,0,0,0|2,0,0]=4 5208 B12R1.25 O=CCSc1cccc(c1Br)Br 62a_100010175083_200015260668 [0,2,0,0,0,0|2,0,0]=4 5209 B12R1.25 O=CCSc1cccc(c1Br)Br 62a_200015260668_100010175083 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.25 O=CCSc1cccc(c1Br)Cl 62a_100014021842_200015260668 [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.25 O=CCSc1cccc(c1Br)Cl 62a_200015260668_100014021842 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.25 O=CCSc1cccc(c1Br)F 62a_100010202630_200015260668 [0,2,0,0,0,0|2,0,0]=4 5213 B12R1.25 O=CCSc1cccc(c1Br)F 62a_200015260668_100010202630 [0,2,0,0,0,0|2,0,0]=4 5214 B12R1.25 O=CCSc1cccc(c1Br)O 62a_100010187914_200015260668 [0,2,0,0,0,0|2,0,0]=4 5215 B12R1.25 O=CCSc1cccc(c1Br)O 62a_200015260668_100010187914 [0,2,0,0,0,0|2,0,0]=4 5216 B12R1.25 O=CCSc1cccc(c1Cl)Br 62a_100010142854_200015260668 [0,2,0,0,0,0|2,0,0]=4 5217 B12R1.25 O=CCSc1cccc(c1Cl)Br 62a_200015260668_100010142854 [0,2,0,0,0,0|2,0,0]=4 5218 B12R1.25 O=CCSc1cccc(c1Cl)Cl 62a_100011215384_200015260668 [0,2,0,0,0,0|2,0,0]=4 5219 B12R1.25 O=CCSc1cccc(c1Cl)Cl 62a_200015260668_100011215384 [0,2,0,0,0,0|2,0,0]=4 5220 B12R1.25 O=CCSc1cccc(c1Cl)F 62a_200010234923_200015260668 [0,2,0,0,0,0|2,0,0]=4 5221 B12R1.25 O=CCSc1cccc(c1Cl)F 62a_200015260668_200010234923 [0,2,0,0,0,0|2,0,0]=4 5222 B12R1.25 O=CCSc1cccc(c1Cl)O 62a_200015260668_100000049636 [0,2,0,0,0,0|2,0,0]=4 5223 B12R1.25 O=CCSc1cccc(c1F)Br 62a_100000702267_200015260668 [0,2,0,0,0,0|2,0,0]=4 5224 B12R1.25 O=CCSc1cccc(c1F)Br 62a_200015260668_100000702267 [0,2,0,0,0,0|2,0,0]=4 5225 B12R1.25 O=CCSc1cccc(c1F)Cl 62a_100011217346_200015260668 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.25 O=CCSc1cccc(c1F)Cl 62a_200015260668_100011217346 [0,2,0,0,0,0|2,0,0]=4 5227 B12R1.25 O=CCSc1cccc(c1F)F 62a_100000694657_200015260668 [0,2,0,0,0,0|2,0,0]=4 5228 B12R1.25 O=CCSc1cccc(c1F)F 62a_200015260668_100000694657 [0,2,0,0,0,0|2,0,0]=4 5229 B12R1.25 O=CCSc1cccc(c1F)O 62a_100009817021_200015260668 [0,2,0,0,0,0|2,0,0]=4 5230 B12R1.25 O=CCSc1cccc(c1F)O 62a_200015260668_100009817021 [0,2,0,0,0,0|2,0,0]=4 5231 B12R1.25 O=CCSc1cccc(c1O)Br 62a_100010084509_200015260668 [0,2,0,0,0,0|1,0,0]=3 5232 B12R1.25 O=CCSc1cccc(c1O)Br 62a_200015260668_100010084509 [0,2,0,0,0,0|1,0,0]=3 5233 B12R1.25 O=CCSc1cccc(c1O)Cl 62a_100010202889_200015260668 [0,2,0,0,0,0|1,0,0]=3 5234 B12R1.25 O=CCSc1cccc(c1O)Cl 62a_200015260668_100010202889 [0,2,0,0,0,0|1,0,0]=3 5235 B12R1.25 O=CCSc1cccc(c1O)F 62a_100009813666_200015260668 [0,2,0,0,0,0|1,0,0]=3 5236 B12R1.25 O=CCSc1cccc(c1O)F 62a_200015260668_100009813666 [0,2,0,0,0,0|1,0,0]=3 5237 B12R1.25 O=CCSc1cccc(c1O)O 62a_200015260668_100009815950 [0,2,0,0,0,0|1,0,0]=3 5238 B12R1.25 O=CCSc1ccnc(c1O)Cl 62a_200015260668_100010067911 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.25 O=CCSc1nccc(c1O)F 62a_200015260668_100009867227 [0,2,0,0,0,0|2,0,0]=4 5240 B12R1.25 OCCNc1cccc(c1O)Br 34a_100011934915_100000211926 [0,2,0,0,0,0|1,0,1]=4 5241 B12R1.25 OCCNc1cccc(c1O)Cl 34a_100000754742_100000211926 [0,2,0,0,0,0|1,0,1]=4 5242 B12R1.25 OCCNc1cccc(c1O)F 34a_100011934987_100000211926 [0,2,0,0,0,0|1,0,1]=4 5243 B12R1.25 OCCSc1cccc(c1O)Br 62a_100000211926_100010084509 [0,2,0,0,0,0|1,0,1]=4 5244 B12R1.25 OCCSc1cccc(c1O)Br 62a_100010084509_100000211926 [0,2,0,0,0,0|1,0,1]=4 5245 B12R1.25 OCCSc1cccc(c1O)Cl 62a_100000211926_100010202889 [0,2,0,0,0,0|1,0,1]=4 5246 B12R1.25 OCCSc1cccc(c1O)Cl 62a_100010202889_100000211926 [0,2,0,0,0,0|1,0,1]=4 5247 B12R1.25 OCCSc1cccc(c1O)F 62a_100000211926_100009813666 [0,2,0,0,0,0|1,0,1]=4 5248 B12R1.25 OCCSc1cccc(c1O)F 62a_100009813666_100000211926 [0,2,0,0,0,0|1,0,1]=4 5249 B12R1.25 OCCSc1cccc(c1O)O 62a_100000211926_100009815950 [0,2,0,0,0,0|1,0,1]=4 5250 B12R1.25 Oc1c(cccc1NCCF)Br 34a_100011934915_100011217306 [0,2,0,0,0,0|1,0,1]=4 5251 B12R1.25 Oc1c(cccc1NCCF)Cl 34a_100000754742_100011217306 [0,2,0,0,0,0|1,0,1]=4 5252 B12R1.25 Oc1c(cccc1NCCF)F 34a_100011934987_100011217306 [0,2,0,0,0,0|1,0,1]=4 5253 B12R1.25 Oc1c(cccc1SCCF)Br 62a_100010084509_100011217306 [0,2,0,0,0,0|1,0,1]=4 5254 B12R1.25 Oc1c(cccc1SCCF)Br 62a_100011217306_100010084509 [0,2,0,0,0,0|1,0,1]=4 5255 B12R1.25 Oc1c(cccc1SCCF)Cl 62a_100010202889_100011217306 [0,2,0,0,0,0|1,0,1]=4 5256 B12R1.25 Oc1c(cccc1SCCF)Cl 62a_100011217306_100010202889 [0,2,0,0,0,0|1,0,1]=4 5257 B12R1.25 Oc1c(cccc1SCCF)F 62a_100009813666_100011217306 [0,2,0,0,0,0|1,0,1]=4 5258 B12R1.25 Oc1c(cccc1SCCF)F 62a_100011217306_100009813666 [0,2,0,0,0,0|1,0,1]=4 5259 B12R1.25 Oc1cccc(c1O)SCCF 62a_100011217306_100009815950 [0,2,0,0,0,0|1,0,1]=4 5260 B12R1.40 C=C=Cc1cc(cc(c1O)Br)F 271570a_100015277604_200013085147 [0,2,0,0,0,0|0,0,2]=4 5261 B12R1.40 C=C=Cc1cc(cc(c1O)C)C 271570a_100015277604_100011934984 [0,2,0,0,0,0|0,0,2]=4 5262 B12R1.40 C=C=Cc1cc(cc(c1O)C)Cl 271570a_100015277604_100012343667 [0,2,0,0,0,0|0,0,2]=4 5263 B12R1.40 C=C=Cc1cc(cc(c1O)C)N 271570a_100015277604_100010064301 [0,2,0,0,0,0|0,0,2]=4 5264 B12R1.40 C=C=Cc1cc(cc(c1O)Cl)Cl 271570a_100015277604_200012339341 [0,2,0,0,0,0|0,0,2]=4 5265 B12R1.40 C=C=Cc1cc(cc(c1O)F)Br 271570a_100015277604_100013354677 [0,2,0,0,0,0|0,0,2]=4 5266 B12R1.40 C=C=Cc1cc(cc(c1O)F)C 271570a_100015277604_200135191068 [0,2,0,0,0,0|0,0,2]=4 5267 B12R1.40 C=C=Cc1cc(cc(c1O)F)F 271570a_100015277604_100000688693 [0,2,0,0,0,0|0,0,2]=4 5268 B12R1.40 C=C=Cc1cc(cc(c1O)N)F 271570a_100015277604_200011217456 [0,2,0,0,0,0|0,0,2]=4 5269 B12R1.40 CC=Cc1cc(cc(c1O)Br)F 271570a_100016259895_200013085147 [0,2,0,0,0,0|0,0,2]=4 5270 B12R1.40 CC=Cc1cc(cc(c1O)C)C 271570a_100016259895_100011934984 [0,2,0,0,0,0|0,0,2]=4 5271 B12R1.40 CC=Cc1cc(cc(c1O)C)Cl 271570a_100016259895_100012343667 [0,2,0,0,0,0|0,0,2]=4 5272 B12R1.40 CC=Cc1cc(cc(c1O)C)N 271570a_100016259895_100010064301 [0,2,0,0,0,0|0,0,2]=4 5273 B12R1.40 CC=Cc1cc(cc(c1O)Cl)Cl 271570a_100016259895_200012339341 [0,2,0,0,0,0|0,0,2]=4 5274 B12R1.40 CC=Cc1cc(cc(c1O)F)Br 271570a_100016259895_100013354677 [0,2,0,0,0,0|0,0,2]=4 5275 B12R1.40 CC=Cc1cc(cc(c1O)F)C 271570a_100016259895_200135191068 [0,2,0,0,0,0|0,0,2]=4 5276 B12R1.40 CC=Cc1cc(cc(c1O)F)F 271570a_100016259895_100000688693 [0,2,0,0,0,0|0,0,2]=4 5277 B12R1.40 CC=Cc1cc(cc(c1O)N)F 271570a_100016259895_200011217456 [0,2,0,0,0,0|0,0,2]=4 5278 B12R1.40 CNCc1cc(cc(c1O)Br)Br 2230a_106832991635_200009814416 [0,2,0,0,0,0|1,0,1]=4 5279 B12R1.40 CNCc1cc(cc(c1O)Br)Br 34a_100102657272_200009814416 [0,2,0,0,0,0|1,0,1]=4 5280 B12R1.40 CNCc1cc(cc(c1O)Br)Br 7a_106832991635_200009814416 [0,2,0,0,0,0|1,0,1]=4 5281 B12R1.40 CNCc1cc(cc(c1O)Cl)Cl 270004a_106832991635_100000212163 [0,2,0,0,0,0|1,0,1]=4 5282 B12R1.40 COCc1cc(cc(c1O)Br)Br 34a_100138415774_200009814416 [0,2,0,0,0,0|1,0,1]=4 5283 B12R1.40 CSCc1cc(cc(c1O)Br)Br 62a_200000210301_200009814416 [0,2,0,0,0,0|1,0,1]=4 5284 B12R1.40 CSCc1cc(cc(c1O)Br)Br 62a_200009814416_200000210301 [0,2,0,0,0,0|1,0,1]=4 5285 B12R1.40 [13CH3]SCc1cc(cc(c1O)Br)Br 62a_200009814416_200025704644 [0,2,0,0,0,0|1,0,1]=4 5286 B12R1.40 [13CH3]SCc1cc(cc(c1O)Br)Br 62a_200025704644_200009814416 [0,2,0,0,0,0|1,0,1]=4 5287 B12R1.224 CC(=Cc1cccc(c1O)Br)C 271570a_100102525489_100010084509 [0,2,0,0,0,0|0,0,2]=4 5288 B12R1.224 CC(=Cc1cccc(c1O)C)C 271570a_100102525489_100009817157 [0,2,0,0,0,0|0,0,2]=4 5289 B12R1.224 CC(=Cc1cccc(c1O)Cl)C 271570a_100102525489_100010202889 [0,2,0,0,0,0|0,0,2]=4 5290 B12R1.224 CC(=Cc1cccc(c1O)F)C 271570a_100102525489_100009813666 [0,2,0,0,0,0|0,0,2]=4 5291 B12R1.224 CC(=Cc1cccc(c1O)N)C 271570a_100102525489_100011934915 [0,2,0,0,0,0|0,0,2]=4 5292 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,2,0,0,0,0|0,0,2]=4 5293 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,2,0,0,0,0|1,0,1]=4 5294 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,2,0,0,0,0|1,0,1]=4 5295 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,2,0,0,0,0|1,0,1]=4 5296 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,2,0,0,0,0|1,0,1]=4 5297 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,2,0,0,0,0|1,0,1]=4 5298 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,2,0,0,0,0|1,0,1]=4 5299 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,2,0,0,0,0|1,0,1]=4 5300 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,2,0,0,0,0|1,0,1]=4 5301 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,2,0,0,0,0|1,0,1]=4 5302 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,2,0,0,0,0|1,0,1]=4 5303 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,2,0,0,0,0|1,0,1]=4 5304 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,2,0,0,0,0|1,0,1]=4 5305 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,2,0,0,0,0|1,0,1]=4 5306 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,2,0,0,0,0|1,0,1]=4 5307 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,2,0,0,0,0|1,0,1]=4 5308 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,2,0,0,0,0|1,0,1]=4 5309 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,2,0,0,0,0|1,0,1]=4 5310 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,2,0,0,0,0|1,0,1]=4 5311 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,2,0,0,0,0|1,0,1]=4 5312 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,2,0,0,0,0|1,0,1]=4 5313 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,2,0,0,0,0|1,0,1]=4 5314 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,2,0,0,0,0|1,0,1]=4 5315 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,2,0,0,0,0|1,0,1]=4 5316 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,2,0,0,0,0|1,0,1]=4 5317 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,2,0,0,0,0|1,0,1]=4 5318 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,2,0,0,0,0|1,0,1]=4 5319 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,2,0,0,0,0|1,0,1]=4 5320 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,2,0,0,0,0|1,0,1]=4 5321 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,2,0,0,0,0|1,0,1]=4 5322 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,2,0,0,0,0|1,0,1]=4 5323 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,2,0,0,0,0|1,0,1]=4 5324 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,2,0,0,0,0|1,0,1]=4 5325 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,2,0,0,0,0|1,0,1]=4 5326 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,2,0,0,0,0|1,0,1]=4 5327 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,2,0,0,0,0|1,0,1]=4 5328 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,2,0,0,0,0|1,0,1]=4 5329 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,2,0,0,0,0|1,0,1]=4 5330 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,2,0,0,0,0|1,0,1]=4 5331 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,2,0,0,0,0|1,0,1]=4 5332 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,2,0,0,0,0|1,0,1]=4 5333 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,2,0,0,0,0|1,0,1]=4 5334 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,2,0,0,0,0|1,0,1]=4 5335 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,2,0,0,0,0|1,0,1]=4 5336 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,2,0,0,0,0|1,0,1]=4 5337 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,2,0,0,0,0|1,0,1]=4 5338 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,2,0,0,0,0|1,0,1]=4 5340 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,2,0,0,0,0|1,0,1]=4 5341 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,2,0,0,0,0|1,0,1]=4 5342 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,2,0,0,0,0|1,0,1]=4 5343 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,2,0,0,0,0|1,0,1]=4 5344 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,2,0,0,0,0|1,0,1]=4 5345 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,2,0,0,0,0|1,0,1]=4 5346 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,2,0,0,0,0|1,0,1]=4 5347 B12R1.280 C=C=Cc1cccc(c1O)C#N 271570a_100015277604_100009817103 [0,2,0,0,0,0|0,0,2]=4 5348 B12R1.280 C=C=Cc1cccc(c1O)C=O 271570a_100015277604_100000737635 [0,2,0,0,0,0|0,0,2]=4 5349 B12R1.280 C=C=Cc1cccc(c1O)CC 271570a_100015277604_200010001580 [0,2,0,0,0,0|0,0,2]=4 5350 B12R1.280 C=C=Cc1cccc(c1O)OC 271570a_100015277604_100000686866 [0,2,0,0,0,0|0,0,2]=4 5351 B12R1.280 CC=Cc1cccc(c1O)C#N 271570a_100016259895_100009817103 [0,2,0,0,0,0|0,0,2]=4 5352 B12R1.280 CC=Cc1cccc(c1O)C=O 271570a_100016259895_100000737635 [0,2,0,0,0,0|0,0,2]=4 5353 B12R1.280 CC=Cc1cccc(c1O)CC 271570a_100016259895_200010001580 [0,2,0,0,0,0|0,0,2]=4 5354 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [0,2,0,0,0,0|0,0,2]=4 5355 B12R1.497 C=C=Cc1c(ccc(c1O)F)C 271570a_100015277604_200010223207 [0,2,0,0,0,0|0,0,2]=4 5356 B12R1.497 C=C=Cc1c(ccc(c1O)F)F 271570a_100015277604_100010170822 [0,2,0,0,0,0|0,0,2]=4 5357 B12R1.497 CC=Cc1c(ccc(c1O)F)C 271570a_100016259895_200010223207 [0,2,0,0,0,0|0,0,2]=4 5358 B12R1.497 CC=Cc1c(ccc(c1O)F)F 271570a_100016259895_100010170822 [0,2,0,0,0,0|0,0,2]=4 5359 B12R1.497 N#CCc1c(ccc(c1F)F)O 271570a_203496583355_100010945798 [0,2,0,0,0,0|1,0,1]=4 5360 B12R1.542 C=C=Cc1cccc(c1CO)F 271570a_100015277604_100012355691 [0,2,0,0,0,0|0,0,2]=4 5361 B12R1.542 C=C=Cc1cccc(c1CO)N 271570a_100015277604_100000747656 [0,2,0,0,0,0|0,0,2]=4 5362 B12R1.542 C=C=Cc1cccc(c1OC)Br 271570a_100015277604_100010146560 [0,2,0,0,0,0|0,0,2]=4 5363 B12R1.542 C=C=Cc1cccc(c1OC)C 271570a_100015277604_100010141385 [0,2,0,0,0,0|0,0,2]=4 5364 B12R1.542 C=C=Cc1cccc(c1OC)Cl 271570a_100015277604_100010147678 [0,2,0,0,0,0|0,0,2]=4 5365 B12R1.542 C=C=Cc1cccc(c1OC)F 271570a_100015277604_100009816759 [0,2,0,0,0,0|0,0,2]=4 5366 B12R1.542 C=C=Cc1cccc(c1OC)N 271570a_100015277604_100011935253 [0,2,0,0,0,0|0,0,2]=4 5367 B12R1.542 C=C=Cc1cccc(c1OC)O 271570a_100015277604_100010234590 [0,2,0,0,0,0|0,0,2]=4 5368 B12R1.542 C=CCc1cccc(c1OC)C 34a_200011218211_200000210301 [0,2,0,0,0,0|0,0,0]=2 5369 B12R1.542 C=CCc1cccc(c1OC)C 7a_200011218211_200000210301 [0,2,0,0,0,0|0,0,0]=2 5370 B12R1.542 C=CCc1cccc(c1O[13CH3])C 34a_200011218211_200025704644 [0,2,0,0,0,0|0,0,0]=2 5371 B12R1.542 C=CCc1cccc(c1O[13CH3])C 7a_200011218211_200025704644 [0,2,0,0,0,0|0,0,0]=2 5372 B12R1.542 CC=Cc1cccc(c1CO)F 271570a_100016259895_100012355691 [0,2,0,0,0,0|0,0,2]=4 5373 B12R1.542 CC=Cc1cccc(c1CO)N 271570a_100016259895_100000747656 [0,2,0,0,0,0|0,0,2]=4 5374 B12R1.542 CC=Cc1cccc(c1OC)Br 271570a_100016259895_100010146560 [0,2,0,0,0,0|0,0,2]=4 5375 B12R1.542 CC=Cc1cccc(c1OC)C 271570a_100016259895_100010141385 [0,2,0,0,0,0|0,0,2]=4 5376 B12R1.542 CC=Cc1cccc(c1OC)Cl 271570a_100016259895_100010147678 [0,2,0,0,0,0|0,0,2]=4 5377 B12R1.542 CC=Cc1cccc(c1OC)F 271570a_100016259895_100009816759 [0,2,0,0,0,0|0,0,2]=4 5378 B12R1.542 CC=Cc1cccc(c1OC)N 271570a_100016259895_100011935253 [0,2,0,0,0,0|0,0,2]=4 5379 B12R1.542 CC=Cc1cccc(c1OC)O 271570a_100016259895_100010234590 [0,2,0,0,0,0|0,0,2]=4 5380 B12R1.542 CNCc1cccc(c1OC)Br 207a_100102657272_100000692592 [0,2,0,0,0,0|1,0,1]=4 5381 B12R1.542 CNCc1cccc(c1OC)Br 2230a_106832991635_100011470457 [0,2,0,0,0,0|1,0,1]=4 5382 B12R1.542 CNCc1cccc(c1OC)Br 26a_100102657272_100010234590 [0,2,0,0,0,0|1,0,1]=4 5383 B12R1.542 CNCc1cccc(c1OC)Br 270004a_106832991635_100000692592 [0,2,0,0,0,0|1,0,1]=4 5384 B12R1.542 CNCc1cccc(c1OC)Br 34a_100102657272_100011470457 [0,2,0,0,0,0|1,0,1]=4 5385 B12R1.542 CNCc1cccc(c1OC)Br 7a_106832991635_100011470457 [0,2,0,0,0,0|1,0,1]=4 5386 B12R1.542 CNCc1cccc(c1OC)C 207a_100102657272_100011361485 [0,2,0,0,0,0|1,0,1]=4 5387 B12R1.542 CNCc1cccc(c1OC)C 2230a_106832991635_100012349798 [0,2,0,0,0,0|1,0,1]=4 5388 B12R1.542 CNCc1cccc(c1OC)C 270004a_106832991635_100011361485 [0,2,0,0,0,0|1,0,1]=4 5389 B12R1.542 CNCc1cccc(c1OC)C 34a_100102657272_100012349798 [0,2,0,0,0,0|1,0,1]=4 5390 B12R1.542 CNCc1cccc(c1OC)C 7a_106832991635_100012349798 [0,2,0,0,0,0|1,0,1]=4 5391 B12R1.542 CNCc1cccc(c1OC)Cl 207a_100102657272_100011466644 [0,2,0,0,0,0|1,0,1]=4 5392 B12R1.542 CNCc1cccc(c1OC)Cl 26a_100102657272_200009886253 [0,2,0,0,0,0|1,0,1]=4 5393 B12R1.542 CNCc1cccc(c1OC)Cl 270004a_106832991635_100011466644 [0,2,0,0,0,0|1,0,1]=4 5394 B12R1.542 CNCc1cccc(c1OC)F 207a_100102657272_100011830294 [0,2,0,0,0,0|1,0,1]=4 5395 B12R1.542 CNCc1cccc(c1OC)F 270004a_106832991635_100011830294 [0,2,0,0,0,0|1,0,1]=4 5396 B12R1.542 CNCc1cccc(c1OC)F 34a_100137345168_200000210301 [0,2,0,0,0,0|1,0,1]=4 5397 B12R1.542 COCc1cccc(c1OC)Br 34a_100000704359_200000210301 [0,2,0,0,0,0|1,0,1]=4 5398 B12R1.542 COCc1cccc(c1OC)Br 34a_100138415774_100011470457 [0,2,0,0,0,0|1,0,1]=4 5399 B12R1.542 COCc1cccc(c1OC)Br 7a_100000704359_200000210301 [0,2,0,0,0,0|1,0,1]=4 5400 B12R1.542 COCc1cccc(c1OC)C 34a_100012184769_200000210301 [0,2,0,0,0,0|1,0,1]=4 5401 B12R1.542 COCc1cccc(c1OC)C 34a_100138415774_100012349798 [0,2,0,0,0,0|1,0,1]=4 5402 B12R1.542 COCc1cccc(c1OC)C 7a_100012184769_200000210301 [0,2,0,0,0,0|1,0,1]=4 5403 B12R1.542 COCc1cccc(c1OC)F 34a_100011830279_200000210301 [0,2,0,0,0,0|1,0,1]=4 5404 B12R1.542 COCc1cccc(c1OC)F 7a_100011830279_200000210301 [0,2,0,0,0,0|1,0,1]=4 5405 B12R1.542 COc1c(cccc1CC#N)O 271570a_203496583355_100010146820 [0,2,0,0,0,0|1,0,1]=4 5406 B12R1.542 COc1c(cccc1CN[13CH3])F 34a_100137345168_200025704644 [0,2,0,0,0,0|1,0,1]=4 5407 B12R1.542 COc1c(cccc1CO[13CH3])Br 34a_100000704359_200025704644 [0,2,0,0,0,0|1,0,1]=4 5408 B12R1.542 COc1c(cccc1CO[13CH3])Br 7a_100000704359_200025704644 [0,2,0,0,0,0|1,0,1]=4 5409 B12R1.542 COc1c(cccc1CO[13CH3])C 34a_100012184769_200025704644 [0,2,0,0,0,0|1,0,1]=4 5410 B12R1.542 COc1c(cccc1CO[13CH3])C 7a_100012184769_200025704644 [0,2,0,0,0,0|1,0,1]=4 5411 B12R1.542 COc1c(cccc1CO[13CH3])F 34a_100011830279_200025704644 [0,2,0,0,0,0|1,0,1]=4 5412 B12R1.542 COc1c(cccc1CO[13CH3])F 7a_100011830279_200025704644 [0,2,0,0,0,0|1,0,1]=4 5413 B12R1.542 COc1c(cccc1CSC)Br 62a_100011470457_200000210301 [0,2,0,0,0,0|1,0,1]=4 5414 B12R1.542 COc1c(cccc1CSC)Br 62a_200000210301_100011470457 [0,2,0,0,0,0|1,0,1]=4 5415 B12R1.542 COc1c(cccc1CSC)C 62a_100012349798_200000210301 [0,2,0,0,0,0|1,0,1]=4 5416 B12R1.542 COc1c(cccc1CSC)C 62a_200000210301_100012349798 [0,2,0,0,0,0|1,0,1]=4 5417 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_100011470457_200025704644 [0,2,0,0,0,0|1,0,1]=4 5418 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_200025704644_100011470457 [0,2,0,0,0,0|1,0,1]=4 5419 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_100012349798_200025704644 [0,2,0,0,0,0|1,0,1]=4 5420 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_200025704644_100012349798 [0,2,0,0,0,0|1,0,1]=4 5421 B12R1.544 C=C=Cc1ccc(c(c1O)C)F 271570a_100015277604_200010391124 [0,2,0,0,0,0|0,0,2]=4 5422 B12R1.544 C=C=Cc1ccc(c(c1O)F)C 271570a_100015277604_100000722096 [0,2,0,0,0,0|0,0,2]=4 5423 B12R1.544 C=C=Cc1ccc(c(c1O)F)F 271570a_100015277604_100010243909 [0,2,0,0,0,0|0,0,2]=4 5424 B12R1.544 CC=Cc1ccc(c(c1O)C)F 271570a_100016259895_200010391124 [0,2,0,0,0,0|0,0,2]=4 5425 B12R1.544 CC=Cc1ccc(c(c1O)F)C 271570a_100016259895_100000722096 [0,2,0,0,0,0|0,0,2]=4 5426 B12R1.544 CC=Cc1ccc(c(c1O)F)F 271570a_100016259895_100010243909 [0,2,0,0,0,0|0,0,2]=4 5427 B12R1.69 C#CCNc1ccc(cc1O)Br 34a_100000739049_100000184674 [0,2,0,0,0,0|0,0,2]=4 5428 B12R1.69 C#CCNc1ccc(cc1O)C 34a_100000211527_100000184674 [0,2,0,0,0,0|0,0,2]=4 5429 B12R1.69 C#CCNc1ccc(cc1O)Cl 34a_100000185728_100000184674 [0,2,0,0,0,0|0,0,2]=4 5430 B12R1.69 C#CCNc1ccc(cc1O)F 34a_100000753323_100000184674 [0,2,0,0,0,0|0,0,2]=4 5431 B12R1.69 C#CCNc1ccc(cc1O)O 34a_100000106777_100000184674 [0,2,0,0,0,0|0,0,2]=4 5432 B12R1.69 C#CCSc1ccc(cc1O)Br 62a_100000038162_100012344904 [0,2,0,0,0,0|0,0,2]=4 5433 B12R1.69 C#CCSc1ccc(cc1O)C 62a_100000038162_100012002257 [0,2,0,0,0,0|0,0,2]=4 5434 B12R1.69 C#CCSc1ccc(cc1O)Cl 62a_100000038162_100000050036 [0,2,0,0,0,0|0,0,2]=4 5435 B12R1.69 C#CCSc1ccc(cc1O)F 62a_100000038162_100000690578 [0,2,0,0,0,0|0,0,2]=4 5436 B12R1.69 C#CCSc1ccc(cc1O)O 62a_100000038162_100009813921 [0,2,0,0,0,0|0,0,2]=4 5437 B12R1.69 C=CCNc1ccc(cc1Br)Br 34a_100000211012_100015514636 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.69 C=CCNc1ccc(cc1Br)C 34a_100000210942_100015514636 [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.69 C=CCNc1ccc(cc1Br)Cl 34a_100000752454_100015514636 [0,2,0,0,0,0|1,0,0]=3 5440 B12R1.69 C=CCNc1ccc(cc1Br)F 34a_100000738039_100015514636 [0,2,0,0,0,0|1,0,0]=3 5441 B12R1.69 C=CCNc1ccc(cc1Br)O 34a_100012001276_100015514636 [0,2,0,0,0,0|1,0,0]=3 5442 B12R1.69 C=CCNc1ccc(cc1C)Br 34a_100000211769_100015514636 [0,2,0,0,0,0|1,0,0]=3 5443 B12R1.69 C=CCNc1ccc(cc1C)Br 7a_100000211769_100015514636 [0,2,0,0,0,0|1,0,0]=3 5444 B12R1.69 C=CCNc1ccc(cc1C)C 34a_100000736561_100015514636 [0,2,0,0,0,0|1,0,0]=3 5445 B12R1.69 C=CCNc1ccc(cc1C)C 7a_100000736561_100015514636 [0,2,0,0,0,0|1,0,0]=3 5446 B12R1.69 C=CCNc1ccc(cc1C)Cl 34a_100000210418_100015514636 [0,2,0,0,0,0|1,0,0]=3 5447 B12R1.69 C=CCNc1ccc(cc1C)Cl 7a_100000210418_100015514636 [0,2,0,0,0,0|1,0,0]=3 5448 B12R1.69 C=CCNc1ccc(cc1C)F 34a_100000211637_100015514636 [0,2,0,0,0,0|1,0,0]=3 5449 B12R1.69 C=CCNc1ccc(cc1C)F 7a_100000211637_100015514636 [0,2,0,0,0,0|1,0,0]=3 5450 B12R1.69 C=CCNc1ccc(cc1C)I 34a_100000184554_100015514636 [0,2,0,0,0,0|1,0,0]=3 5451 B12R1.69 C=CCNc1ccc(cc1C)I 7a_100000184554_100015514636 [0,2,0,0,0,0|1,0,0]=3 5452 B12R1.69 C=CCNc1ccc(cc1C)O 34a_100000756630_100015514636 [0,2,0,0,0,0|1,0,0]=3 5453 B12R1.69 C=CCNc1ccc(cc1Cl)Br 34a_100000211467_100015514636 [0,2,0,0,0,0|1,0,0]=3 5454 B12R1.69 C=CCNc1ccc(cc1Cl)C 34a_100000210522_100015514636 [0,2,0,0,0,0|1,0,0]=3 5455 B12R1.69 C=CCNc1ccc(cc1Cl)Cl 34a_100000185861_100015514636 [0,2,0,0,0,0|1,0,0]=3 5456 B12R1.69 C=CCNc1ccc(cc1Cl)F 34a_100000212003_100015514636 [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.69 C=CCNc1ccc(cc1Cl)I 34a_100011218065_100015514636 [0,2,0,0,0,0|1,0,0]=3 5458 B12R1.69 C=CCNc1ccc(cc1Cl)O 34a_100011215599_100015514636 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.69 C=CCNc1ccc(cc1F)Br 34a_100000210722_100015514636 [0,2,0,0,0,0|1,0,0]=3 5460 B12R1.69 C=CCNc1ccc(cc1F)C 34a_100000211023_100015514636 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.69 C=CCNc1ccc(cc1F)Cl 34a_100000211020_100015514636 [0,2,0,0,0,0|1,0,0]=3 5462 B12R1.69 C=CCNc1ccc(cc1F)F 34a_100000210720_100015514636 [0,2,0,0,0,0|1,0,0]=3 5463 B12R1.69 C=CCNc1ccc(cc1F)I 34a_100011215594_100015514636 [0,2,0,0,0,0|1,0,0]=3 5464 B12R1.69 C=CCNc1ccc(cc1F)O 34a_100000759473_100015514636 [0,2,0,0,0,0|1,0,0]=3 5465 B12R1.69 C=CCNc1ccc(cc1I)Br 34a_100000187925_100015514636 [0,2,0,0,0,0|1,0,0]=3 5466 B12R1.69 C=CCNc1ccc(cc1I)C 34a_100011356834_100015514636 [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.69 C=CCNc1ccc(cc1I)Cl 34a_100000761889_100015514636 [0,2,0,0,0,0|1,0,0]=3 5468 B12R1.69 C=CCNc1ccc(cc1I)F 34a_100000760547_100015514636 [0,2,0,0,0,0|1,0,0]=3 5469 B12R1.69 C=CCNc1ccc(cc1I)O 34a_100010084370_100015514636 [0,2,0,0,0,0|1,0,0]=3 5470 B12R1.69 C=CCNc1ccc(cc1O)Br 34a_100000739049_100015514636 [0,2,0,0,0,0|0,0,0]=2 5471 B12R1.69 C=CCNc1ccc(cc1O)C 34a_100000211527_100015514636 [0,2,0,0,0,0|0,0,0]=2 5472 B12R1.69 C=CCNc1ccc(cc1O)Cl 34a_100000185728_100015514636 [0,2,0,0,0,0|0,0,0]=2 5473 B12R1.69 C=CCNc1ccc(cc1O)F 34a_100000753323_100015514636 [0,2,0,0,0,0|0,0,0]=2 5474 B12R1.69 C=CCNc1ccc(cc1O)O 34a_100000106777_100015514636 [0,2,0,0,0,0|0,0,0]=2 5475 B12R1.69 C=CCOc1ccc(cc1Br)Br 34a_100000188717_100015514636 [0,2,0,0,0,0|1,0,0]=3 5476 B12R1.69 C=CCOc1ccc(cc1Br)Br 7a_100000188717_100015514636 [0,2,0,0,0,0|1,0,0]=3 5477 B12R1.69 C=CCOc1ccc(cc1Br)C 34a_100000210800_100015514636 [0,2,0,0,0,0|1,0,0]=3 5478 B12R1.69 C=CCOc1ccc(cc1Br)C 7a_100000210800_100015514636 [0,2,0,0,0,0|1,0,0]=3 5479 B12R1.69 C=CCOc1ccc(cc1Br)Cl 34a_100000211998_100015514636 [0,2,0,0,0,0|1,0,0]=3 5480 B12R1.69 C=CCOc1ccc(cc1Br)Cl 7a_100000211998_100015514636 [0,2,0,0,0,0|1,0,0]=3 5481 B12R1.69 C=CCOc1ccc(cc1Br)F 34a_100000211999_100015514636 [0,2,0,0,0,0|1,0,0]=3 5482 B12R1.69 C=CCOc1ccc(cc1Br)F 7a_100000211999_100015514636 [0,2,0,0,0,0|1,0,0]=3 5483 B12R1.69 C=CCOc1ccc(cc1Br)I 34a_100012361655_100015514636 [0,2,0,0,0,0|1,0,0]=3 5484 B12R1.69 C=CCOc1ccc(cc1Br)I 7a_100012361655_100015514636 [0,2,0,0,0,0|1,0,0]=3 5485 B12R1.69 C=CCOc1ccc(cc1Br)N 34a_100011534360_100015514636 [0,2,0,0,0,0|1,0,0]=3 5486 B12R1.69 C=CCOc1ccc(cc1Br)N 7a_100011534360_100015514636 [0,2,0,0,0,0|1,0,0]=3 5487 B12R1.69 C=CCOc1ccc(cc1C)Br 34a_100000186361_100015514636 [0,2,0,0,0,0|1,0,0]=3 5488 B12R1.69 C=CCOc1ccc(cc1C)Br 7a_100000186361_100015514636 [0,2,0,0,0,0|1,0,0]=3 5489 B12R1.69 C=CCOc1ccc(cc1C)C 34a_100000211776_100015514636 [0,2,0,0,0,0|1,0,0]=3 5490 B12R1.69 C=CCOc1ccc(cc1C)C 7a_100000211776_100015514636 [0,2,0,0,0,0|1,0,0]=3 5491 B12R1.69 C=CCOc1ccc(cc1C)Cl 34a_100000211091_100015514636 [0,2,0,0,0,0|1,0,0]=3 5492 B12R1.69 C=CCOc1ccc(cc1C)Cl 7a_100000211091_100015514636 [0,2,0,0,0,0|1,0,0]=3 5493 B12R1.69 C=CCOc1ccc(cc1C)F 34a_100000764316_100015514636 [0,2,0,0,0,0|1,0,0]=3 5494 B12R1.69 C=CCOc1ccc(cc1C)F 7a_100000764316_100015514636 [0,2,0,0,0,0|1,0,0]=3 5495 B12R1.69 C=CCOc1ccc(cc1C)I 34a_100011218673_100015514636 [0,2,0,0,0,0|1,0,0]=3 5496 B12R1.69 C=CCOc1ccc(cc1C)I 7a_100011218673_100015514636 [0,2,0,0,0,0|1,0,0]=3 5497 B12R1.69 C=CCOc1ccc(cc1C)N 34a_100011218179_100015514636 [0,2,0,0,0,0|1,0,0]=3 5498 B12R1.69 C=CCOc1ccc(cc1C)N 7a_100011218179_100015514636 [0,2,0,0,0,0|1,0,0]=3 5499 B12R1.69 C=CCOc1ccc(cc1Cl)Br 34a_100000186472_100015514636 [0,2,0,0,0,0|1,0,0]=3 5500 B12R1.69 C=CCOc1ccc(cc1Cl)Br 7a_100000186472_100015514636 [0,2,0,0,0,0|1,0,0]=3 5501 B12R1.69 C=CCOc1ccc(cc1Cl)C 34a_100000749699_100015514636 [0,2,0,0,0,0|1,0,0]=3 5502 B12R1.69 C=CCOc1ccc(cc1Cl)C 7a_100000749699_100015514636 [0,2,0,0,0,0|1,0,0]=3 5503 B12R1.69 C=CCOc1ccc(cc1Cl)Cl 34a_100015191787_100015514636 [0,2,0,0,0,0|1,0,0]=3 5504 B12R1.69 C=CCOc1ccc(cc1Cl)Cl 7a_100015191787_100015514636 [0,2,0,0,0,0|1,0,0]=3 5505 B12R1.69 C=CCOc1ccc(cc1Cl)F 34a_100000212004_100015514636 [0,2,0,0,0,0|1,0,0]=3 5506 B12R1.69 C=CCOc1ccc(cc1Cl)F 7a_100000212004_100015514636 [0,2,0,0,0,0|1,0,0]=3 5507 B12R1.69 C=CCOc1ccc(cc1Cl)I 34a_100012360047_100015514636 [0,2,0,0,0,0|1,0,0]=3 5508 B12R1.69 C=CCOc1ccc(cc1Cl)I 7a_100012360047_100015514636 [0,2,0,0,0,0|1,0,0]=3 5509 B12R1.69 C=CCOc1ccc(cc1Cl)N 34a_100000744943_100015514636 [0,2,0,0,0,0|1,0,0]=3 5510 B12R1.69 C=CCOc1ccc(cc1Cl)N 7a_100000744943_100015514636 [0,2,0,0,0,0|1,0,0]=3 5511 B12R1.69 C=CCOc1ccc(cc1F)Br 34a_100000185481_100015514636 [0,2,0,0,0,0|1,0,0]=3 5512 B12R1.69 C=CCOc1ccc(cc1F)Br 7a_100000185481_100015514636 [0,2,0,0,0,0|1,0,0]=3 5513 B12R1.69 C=CCOc1ccc(cc1F)C 34a_100011216688_100015514636 [0,2,0,0,0,0|1,0,0]=3 5514 B12R1.69 C=CCOc1ccc(cc1F)C 7a_100011216688_100015514636 [0,2,0,0,0,0|1,0,0]=3 5515 B12R1.69 C=CCOc1ccc(cc1F)Cl 34a_100000230166_100015514636 [0,2,0,0,0,0|1,0,0]=3 5516 B12R1.69 C=CCOc1ccc(cc1F)Cl 7a_100000230166_100015514636 [0,2,0,0,0,0|1,0,0]=3 5517 B12R1.69 C=CCOc1ccc(cc1F)F 34a_100000230127_100015514636 [0,2,0,0,0,0|1,0,0]=3 5518 B12R1.69 C=CCOc1ccc(cc1F)F 7a_100000230127_100015514636 [0,2,0,0,0,0|1,0,0]=3 5519 B12R1.69 C=CCOc1ccc(cc1F)I 34a_100011356965_100015514636 [0,2,0,0,0,0|1,0,0]=3 5520 B12R1.69 C=CCOc1ccc(cc1F)I 7a_100011356965_100015514636 [0,2,0,0,0,0|1,0,0]=3 5521 B12R1.69 C=CCOc1ccc(cc1F)N 34a_100011220035_100015514636 [0,2,0,0,0,0|1,0,0]=3 5522 B12R1.69 C=CCOc1ccc(cc1F)N 7a_100011220035_100015514636 [0,2,0,0,0,0|1,0,0]=3 5523 B12R1.69 C=CCOc1ccc(cc1I)Br 34a_100012355227_100015514636 [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.69 C=CCOc1ccc(cc1I)Br 7a_100012355227_100015514636 [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.69 C=CCOc1ccc(cc1I)C 34a_100000765521_100015514636 [0,2,0,0,0,0|1,0,0]=3 5526 B12R1.69 C=CCOc1ccc(cc1I)C 7a_100000765521_100015514636 [0,2,0,0,0,0|1,0,0]=3 5527 B12R1.69 C=CCOc1ccc(cc1I)Cl 34a_100011356953_100015514636 [0,2,0,0,0,0|1,0,0]=3 5528 B12R1.69 C=CCOc1ccc(cc1I)Cl 7a_100011356953_100015514636 [0,2,0,0,0,0|1,0,0]=3 5529 B12R1.69 C=CCOc1ccc(cc1I)F 34a_100012355409_100015514636 [0,2,0,0,0,0|1,0,0]=3 5530 B12R1.69 C=CCOc1ccc(cc1I)F 7a_100012355409_100015514636 [0,2,0,0,0,0|1,0,0]=3 5531 B12R1.69 C=CCOc1ccc(cc1I)I 7a_100010001573_100015514636 [0,2,0,0,0,0|1,0,0]=3 5532 B12R1.69 C=CCOc1ccc(cc1N)Br 34a_100000752626_100015514636 [0,2,0,0,0,0|1,0,0]=3 5533 B12R1.69 C=CCOc1ccc(cc1N)Br 7a_100000752626_100015514636 [0,2,0,0,0,0|1,0,0]=3 5534 B12R1.69 C=CCOc1ccc(cc1N)C 34a_100011215204_100015514636 [0,2,0,0,0,0|1,0,0]=3 5535 B12R1.69 C=CCOc1ccc(cc1N)C 7a_100011215204_100015514636 [0,2,0,0,0,0|1,0,0]=3 5536 B12R1.69 C=CCOc1ccc(cc1N)Cl 34a_100000210500_100015514636 [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.69 C=CCOc1ccc(cc1N)Cl 7a_100000210500_100015514636 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.69 C=CCOc1ccc(cc1N)F 34a_100000759472_100015514636 [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.69 C=CCOc1ccc(cc1N)F 7a_100000759472_100015514636 [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.69 C=CCOc1ccc(cc1N)I 34a_100000753495_100015514636 [0,2,0,0,0,0|1,0,0]=3 5541 B12R1.69 C=CCOc1ccc(cc1N)I 7a_100000753495_100015514636 [0,2,0,0,0,0|1,0,0]=3 5542 B12R1.69 C=CCOc1ccc(cc1N)N 34a_100000725306_100015514636 [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.69 C=CCOc1ccc(nc1Br)Br 34a_100009999766_100015514636 [0,2,0,0,0,0|2,0,0]=4 5544 B12R1.69 C=CCOc1ccc(nc1Br)Br 7a_100009999766_100015514636 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.69 C=CCOc1ccc(nc1Br)C 34a_100000702858_100015514636 [0,2,0,0,0,0|2,0,0]=4 5546 B12R1.69 C=CCOc1ccc(nc1Br)C 7a_100000702858_100015514636 [0,2,0,0,0,0|2,0,0]=4 5547 B12R1.69 C=CCOc1ccc(nc1Br)Cl 34a_100010219353_100015514636 [0,2,0,0,0,0|2,0,0]=4 5548 B12R1.69 C=CCOc1ccc(nc1Br)Cl 7a_100010219353_100015514636 [0,2,0,0,0,0|2,0,0]=4 5549 B12R1.69 C=CCOc1ccc(nc1Br)F 34a_100009887730_100015514636 [0,2,0,0,0,0|2,0,0]=4 5550 B12R1.69 C=CCOc1ccc(nc1Br)F 7a_100009887730_100015514636 [0,2,0,0,0,0|2,0,0]=4 5551 B12R1.69 C=CCOc1ccc(nc1Br)I 34a_100000725334_100015514636 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.69 C=CCOc1ccc(nc1Br)I 7a_100000725334_100015514636 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.69 C=CCOc1ccc(nc1C)Br 34a_100012002022_100015514636 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.69 C=CCOc1ccc(nc1C)Br 7a_100012002022_100015514636 [0,2,0,0,0,0|2,0,0]=4 5555 B12R1.69 C=CCOc1ccc(nc1C)C 34a_100011218912_100015514636 [0,2,0,0,0,0|2,0,0]=4 5556 B12R1.69 C=CCOc1ccc(nc1C)C 7a_100011218912_100015514636 [0,2,0,0,0,0|2,0,0]=4 5557 B12R1.69 C=CCOc1ccc(nc1C)Cl 34a_100012184626_100015514636 [0,2,0,0,0,0|2,0,0]=4 5558 B12R1.69 C=CCOc1ccc(nc1C)Cl 7a_100012184626_100015514636 [0,2,0,0,0,0|2,0,0]=4 5559 B12R1.69 C=CCOc1ccc(nc1C)F 34a_100009881036_100015514636 [0,2,0,0,0,0|2,0,0]=4 5560 B12R1.69 C=CCOc1ccc(nc1C)F 7a_100009881036_100015514636 [0,2,0,0,0,0|2,0,0]=4 5561 B12R1.69 C=CCOc1ccc(nc1C)I 34a_100010233687_100015514636 [0,2,0,0,0,0|2,0,0]=4 5562 B12R1.69 C=CCOc1ccc(nc1C)I 7a_100010233687_100015514636 [0,2,0,0,0,0|2,0,0]=4 5563 B12R1.69 C=CCOc1ccc(nc1Cl)Br 34a_100010246206_100015514636 [0,2,0,0,0,0|2,0,0]=4 5564 B12R1.69 C=CCOc1ccc(nc1Cl)Br 7a_100010246206_100015514636 [0,2,0,0,0,0|2,0,0]=4 5565 B12R1.69 C=CCOc1ccc(nc1Cl)C 34a_100000086286_100015514636 [0,2,0,0,0,0|2,0,0]=4 5566 B12R1.69 C=CCOc1ccc(nc1Cl)C 7a_100000086286_100015514636 [0,2,0,0,0,0|2,0,0]=4 5567 B12R1.69 C=CCOc1ccc(nc1Cl)Cl 34a_100000101165_100015514636 [0,2,0,0,0,0|2,0,0]=4 5568 B12R1.69 C=CCOc1ccc(nc1Cl)Cl 7a_100000101165_100015514636 [0,2,0,0,0,0|2,0,0]=4 5569 B12R1.69 C=CCOc1ccc(nc1Cl)I 34a_100000721234_100015514636 [0,2,0,0,0,0|2,0,0]=4 5570 B12R1.69 C=CCOc1ccc(nc1Cl)I 7a_100000721234_100015514636 [0,2,0,0,0,0|2,0,0]=4 5571 B12R1.69 C=CCOc1ccc(nc1F)Br 34a_100009819667_100015514636 [0,2,0,0,0,0|2,0,0]=4 5572 B12R1.69 C=CCOc1ccc(nc1F)Br 7a_100009819667_100015514636 [0,2,0,0,0,0|2,0,0]=4 5573 B12R1.69 C=CCOc1ccc(nc1F)C 34a_100000079963_100015514636 [0,2,0,0,0,0|2,0,0]=4 5574 B12R1.69 C=CCOc1ccc(nc1F)C 7a_100000079963_100015514636 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.69 C=CCOc1ccc(nc1F)Cl 34a_100009880201_100015514636 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.69 C=CCOc1ccc(nc1F)Cl 7a_100009880201_100015514636 [0,2,0,0,0,0|2,0,0]=4 5577 B12R1.69 C=CCOc1ccc(nc1F)F 34a_100000101184_100015514636 [0,2,0,0,0,0|2,0,0]=4 5578 B12R1.69 C=CCOc1ccc(nc1F)F 7a_100000101184_100015514636 [0,2,0,0,0,0|2,0,0]=4 5579 B12R1.69 C=CCOc1ccc(nc1I)Br 34a_100010253912_100015514636 [0,2,0,0,0,0|2,0,0]=4 5580 B12R1.69 C=CCOc1ccc(nc1I)Br 7a_100010253912_100015514636 [0,2,0,0,0,0|2,0,0]=4 5581 B12R1.69 C=CCOc1ccc(nc1I)C 34a_100000023897_100015514636 [0,2,0,0,0,0|2,0,0]=4 5582 B12R1.69 C=CCOc1ccc(nc1I)C 7a_100000023897_100015514636 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.69 C=CCOc1ccc(nc1I)Cl 34a_100000696390_100015514636 [0,2,0,0,0,0|2,0,0]=4 5584 B12R1.69 C=CCOc1ccc(nc1I)Cl 7a_100000696390_100015514636 [0,2,0,0,0,0|2,0,0]=4 5585 B12R1.69 C=CCOc1ccc(nc1I)F 34a_100010382442_100015514636 [0,2,0,0,0,0|2,0,0]=4 5586 B12R1.69 C=CCOc1ccc(nc1I)F 7a_100010382442_100015514636 [0,2,0,0,0,0|2,0,0]=4 5587 B12R1.69 C=CCOc1ccc(nc1N)Br 34a_100000685527_100015514636 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.69 C=CCOc1ccc(nc1N)Br 7a_100000685527_100015514636 [0,2,0,0,0,0|2,0,0]=4 5589 B12R1.69 C=CCOc1ccc(nc1N)C 34a_100000694039_100015514636 [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.69 C=CCOc1ccc(nc1N)C 7a_100000694039_100015514636 [0,2,0,0,0,0|2,0,0]=4 5591 B12R1.69 C=CCOc1ccc(nc1N)Cl 34a_100000717809_100015514636 [0,2,0,0,0,0|2,0,0]=4 5592 B12R1.69 C=CCOc1ccc(nc1N)Cl 7a_100000717809_100015514636 [0,2,0,0,0,0|2,0,0]=4 5593 B12R1.69 C=CCOc1cnc(cc1Br)C 34a_100009843476_100015514636 [0,2,0,0,0,0|2,0,0]=4 5594 B12R1.69 C=CCOc1cnc(cc1Br)C 7a_100009843476_100015514636 [0,2,0,0,0,0|2,0,0]=4 5595 B12R1.69 C=CCOc1cnc(cc1C)C 34a_200000068632_100015514636 [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.69 C=CCOc1cnc(cc1C)C 7a_200000068632_100015514636 [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.69 C=CCOc1cnc(cc1C)Cl 34a_100000692680_100015514636 [0,2,0,0,0,0|2,0,0]=4 5598 B12R1.69 C=CCOc1cnc(cc1C)Cl 7a_100000692680_100015514636 [0,2,0,0,0,0|2,0,0]=4 5599 B12R1.69 C=CCOc1cnc(cc1C)F 34a_100009856773_100015514636 [0,2,0,0,0,0|2,0,0]=4 5600 B12R1.69 C=CCOc1cnc(cc1C)F 7a_100009856773_100015514636 [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.69 C=CCOc1cnc(cc1Cl)Cl 34a_100009868576_100015514636 [0,2,0,0,0,0|2,0,0]=4 5602 B12R1.69 C=CCOc1cnc(cc1Cl)Cl 7a_100009868576_100015514636 [0,2,0,0,0,0|2,0,0]=4 5603 B12R1.69 C=CCOc1cnc(cc1F)F 34a_100009885687_100015514636 [0,2,0,0,0,0|2,0,0]=4 5604 B12R1.69 C=CCOc1cnc(cc1F)F 7a_100009885687_100015514636 [0,2,0,0,0,0|2,0,0]=4 5605 B12R1.69 C=CCOc1cnc(cc1I)Cl 34a_100000698892_100015514636 [0,2,0,0,0,0|2,0,0]=4 5606 B12R1.69 C=CCOc1cnc(cc1I)Cl 7a_100000698892_100015514636 [0,2,0,0,0,0|2,0,0]=4 5607 B12R1.69 C=CCOc1cnc(cc1N)Br 34a_100009819941_100015514636 [0,2,0,0,0,0|2,0,0]=4 5608 B12R1.69 C=CCOc1cnc(cc1N)Br 7a_100009819941_100015514636 [0,2,0,0,0,0|2,0,0]=4 5609 B12R1.69 C=CCOc1coc(cc1=O)C 34a_100000081520_100015514636 [0,2,0,0,0,0|1,0,1]=4 5610 B12R1.69 C=CCOc1ncc(cc1Br)Br 34a_100000701035_100015514636 [0,2,0,0,0,0|2,0,0]=4 5611 B12R1.69 C=CCOc1ncc(cc1Br)C 34a_100000719714_100015514636 [0,2,0,0,0,0|2,0,0]=4 5612 B12R1.69 C=CCOc1ncc(cc1C)Br 34a_100000685391_100015514636 [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.69 C=CCOc1ncc(cc1Cl)Br 34a_100012339560_100015514636 [0,2,0,0,0,0|2,0,0]=4 5614 B12R1.69 C=CCOc1ncc(cc1Cl)F 34a_100009847679_100015514636 [0,2,0,0,0,0|2,0,0]=4 5615 B12R1.69 C=CCOc1ncc(cc1F)Cl 34a_100011998252_100015514636 [0,2,0,0,0,0|2,0,0]=4 5616 B12R1.69 C=CCOc1ncc(cc1F)F 34a_100012025737_100015514636 [0,2,0,0,0,0|2,0,0]=4 5617 B12R1.69 C=CCOc1ncc(cc1N)Br 34a_100000743729_100015514636 [0,2,0,0,0,0|2,0,0]=4 5618 B12R1.69 C=CCOc1ncc(cc1N)C 34a_100012000488_100015514636 [0,2,0,0,0,0|2,0,0]=4 5619 B12R1.69 C=CCOc1ncc(cc1N)Cl 34a_100011998249_100015514636 [0,2,0,0,0,0|2,0,0]=4 5620 B12R1.69 C=CCSc1c[nH]c(=O)cc1F 62a_100000210623_100015631685 [0,2,0,0,0,0|2,0,0]=4 5621 B12R1.69 C=CCSc1c[nH]c(=O)cc1F 62a_100015631685_100000210623 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.69 C=CCSc1cc[n+](cc1C)[O-] 62a_100000210623_100000074940 [0,2,0,0,0,0|2,0,0]=4 5623 B12R1.69 C=CCSc1ccc(=O)[nH]c1N 62a_100009884077_100000210623 [0,2,0,0,0,0|2,0,0]=4 5624 B12R1.69 C=CCSc1ccc(c[n+]1[O-])C 62a_100000210623_100009819918 [0,2,0,0,0,0|1,0,1]=4 5625 B12R1.69 C=CCSc1ccc(c[n+]1[O-])F 62a_100000210623_100009817261 [0,2,0,0,0,0|1,0,1]=4 5626 B12R1.69 C=CCSc1ccc(c[n+]1[O-])F 62a_100009817261_100000210623 [0,2,0,0,0,0|1,0,1]=4 5627 B12R1.69 C=CCSc1ccc(cc1Br)Br 62a_100000210623_100011484698 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.69 C=CCSc1ccc(cc1Br)Br 62a_100011484698_100000210623 [0,2,0,0,0,0|1,0,0]=3 5629 B12R1.69 C=CCSc1ccc(cc1Br)C 62a_100000210623_100009813563 [0,2,0,0,0,0|1,0,0]=3 5630 B12R1.69 C=CCSc1ccc(cc1Br)C 62a_100009813563_100000210623 [0,2,0,0,0,0|1,0,0]=3 5631 B12R1.69 C=CCSc1ccc(cc1Br)Cl 62a_100000210623_100011219703 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.69 C=CCSc1ccc(cc1Br)Cl 62a_100011219703_100000210623 [0,2,0,0,0,0|1,0,0]=3 5633 B12R1.69 C=CCSc1ccc(cc1Br)F 62a_100000210623_100011217111 [0,2,0,0,0,0|1,0,0]=3 5634 B12R1.69 C=CCSc1ccc(cc1Br)F 62a_100011217111_100000210623 [0,2,0,0,0,0|1,0,0]=3 5635 B12R1.69 C=CCSc1ccc(cc1Br)N 62a_100000210623_100000750458 [0,2,0,0,0,0|1,0,0]=3 5636 B12R1.69 C=CCSc1ccc(cc1Br)N 62a_100000750458_100000210623 [0,2,0,0,0,0|1,0,0]=3 5637 B12R1.69 C=CCSc1ccc(cc1Br)O 62a_100000210623_100000701344 [0,2,0,0,0,0|1,0,0]=3 5638 B12R1.69 C=CCSc1ccc(cc1Br)O 62a_100000701344_100000210623 [0,2,0,0,0,0|1,0,0]=3 5639 B12R1.69 C=CCSc1ccc(cc1C)Br 62a_100000210623_100000701812 [0,2,0,0,0,0|1,0,0]=3 5640 B12R1.69 C=CCSc1ccc(cc1C)Br 62a_100000701812_100000210623 [0,2,0,0,0,0|1,0,0]=3 5641 B12R1.69 C=CCSc1ccc(cc1C)C 62a_100000210623_100011217332 [0,2,0,0,0,0|1,0,0]=3 5642 B12R1.69 C=CCSc1ccc(cc1C)C 62a_100011217332_100000210623 [0,2,0,0,0,0|1,0,0]=3 5643 B12R1.69 C=CCSc1ccc(cc1C)Cl 62a_100000210623_100011219607 [0,2,0,0,0,0|1,0,0]=3 5644 B12R1.69 C=CCSc1ccc(cc1C)Cl 62a_100011219607_100000210623 [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.69 C=CCSc1ccc(cc1C)F 62a_100000210623_100011205405 [0,2,0,0,0,0|1,0,0]=3 5646 B12R1.69 C=CCSc1ccc(cc1C)F 62a_100011205405_100000210623 [0,2,0,0,0,0|1,0,0]=3 5647 B12R1.69 C=CCSc1ccc(cc1C)N 62a_100000210623_100000210723 [0,2,0,0,0,0|1,0,0]=3 5648 B12R1.69 C=CCSc1ccc(cc1C)N 62a_100000210723_100000210623 [0,2,0,0,0,0|1,0,0]=3 5649 B12R1.69 C=CCSc1ccc(cc1C)O 62a_100000210623_100000690111 [0,2,0,0,0,0|1,0,0]=3 5650 B12R1.69 C=CCSc1ccc(cc1Cl)Br 62a_100000210623_100011216062 [0,2,0,0,0,0|1,0,0]=3 5651 B12R1.69 C=CCSc1ccc(cc1Cl)Br 62a_100011216062_100000210623 [0,2,0,0,0,0|1,0,0]=3 5652 B12R1.69 C=CCSc1ccc(cc1Cl)C 62a_100000210623_100011263221 [0,2,0,0,0,0|1,0,0]=3 5653 B12R1.69 C=CCSc1ccc(cc1Cl)C 62a_100011263221_100000210623 [0,2,0,0,0,0|1,0,0]=3 5654 B12R1.69 C=CCSc1ccc(cc1Cl)Cl 62a_100000210623_100000699841 [0,2,0,0,0,0|1,0,0]=3 5655 B12R1.69 C=CCSc1ccc(cc1Cl)Cl 62a_100000699841_100000210623 [0,2,0,0,0,0|1,0,0]=3 5656 B12R1.69 C=CCSc1ccc(cc1Cl)F 62a_100000210623_100000733362 [0,2,0,0,0,0|1,0,0]=3 5657 B12R1.69 C=CCSc1ccc(cc1Cl)F 62a_100000733362_100000210623 [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.69 C=CCSc1ccc(cc1Cl)N 62a_100000210623_100000761885 [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.69 C=CCSc1ccc(cc1Cl)N 62a_100000761885_100000210623 [0,2,0,0,0,0|1,0,0]=3 5660 B12R1.69 C=CCSc1ccc(cc1Cl)O 62a_100000047559_100000210623 [0,2,0,0,0,0|1,0,0]=3 5661 B12R1.69 C=CCSc1ccc(cc1Cl)O 62a_100000210623_100000047559 [0,2,0,0,0,0|1,0,0]=3 5662 B12R1.69 C=CCSc1ccc(cc1F)Br 62a_100000210623_100009814013 [0,2,0,0,0,0|1,0,0]=3 5663 B12R1.69 C=CCSc1ccc(cc1F)Br 62a_100009814013_100000210623 [0,2,0,0,0,0|1,0,0]=3 5664 B12R1.69 C=CCSc1ccc(cc1F)C 62a_100000210623_100011216119 [0,2,0,0,0,0|1,0,0]=3 5665 B12R1.69 C=CCSc1ccc(cc1F)C 62a_100011216119_100000210623 [0,2,0,0,0,0|1,0,0]=3 5666 B12R1.69 C=CCSc1ccc(cc1F)Cl 62a_100000210623_100011216042 [0,2,0,0,0,0|1,0,0]=3 5667 B12R1.69 C=CCSc1ccc(cc1F)Cl 62a_100011216042_100000210623 [0,2,0,0,0,0|1,0,0]=3 5668 B12R1.69 C=CCSc1ccc(cc1F)F 62a_100000210623_100000750030 [0,2,0,0,0,0|1,0,0]=3 5669 B12R1.69 C=CCSc1ccc(cc1F)F 62a_100000750030_100000210623 [0,2,0,0,0,0|1,0,0]=3 5670 B12R1.69 C=CCSc1ccc(cc1F)N 62a_100000210623_100011356925 [0,2,0,0,0,0|1,0,0]=3 5671 B12R1.69 C=CCSc1ccc(cc1F)N 62a_100011356925_100000210623 [0,2,0,0,0,0|1,0,0]=3 5672 B12R1.69 C=CCSc1ccc(cc1F)O 62a_100000210623_100000755031 [0,2,0,0,0,0|1,0,0]=3 5673 B12R1.69 C=CCSc1ccc(cc1F)O 62a_100000755031_100000210623 [0,2,0,0,0,0|1,0,0]=3 5674 B12R1.69 C=CCSc1ccc(cc1N)Br 62a_100000210623_100000743836 [0,2,0,0,0,0|1,0,0]=3 5675 B12R1.69 C=CCSc1ccc(cc1N)Br 62a_100000743836_100000210623 [0,2,0,0,0,0|1,0,0]=3 5676 B12R1.69 C=CCSc1ccc(cc1N)C 62a_100000210623_100011216686 [0,2,0,0,0,0|1,0,0]=3 5677 B12R1.69 C=CCSc1ccc(cc1N)C 62a_100011216686_100000210623 [0,2,0,0,0,0|1,0,0]=3 5678 B12R1.69 C=CCSc1ccc(cc1N)Cl 62a_100000210623_100000761886 [0,2,0,0,0,0|1,0,0]=3 5679 B12R1.69 C=CCSc1ccc(cc1N)Cl 62a_100000761886_100000210623 [0,2,0,0,0,0|1,0,0]=3 5680 B12R1.69 C=CCSc1ccc(cc1N)F 62a_100000210623_100000687223 [0,2,0,0,0,0|1,0,0]=3 5681 B12R1.69 C=CCSc1ccc(cc1N)F 62a_100000687223_100000210623 [0,2,0,0,0,0|1,0,0]=3 5682 B12R1.69 C=CCSc1ccc(cc1N)N 62a_100000210623_200012175722 [0,2,0,0,0,0|1,0,0]=3 5683 B12R1.69 C=CCSc1ccc(cc1N)N 62a_200012175722_100000210623 [0,2,0,0,0,0|1,0,0]=3 5684 B12R1.69 C=CCSc1ccc(cc1N)O 62a_100000210623_100011999798 [0,2,0,0,0,0|1,0,0]=3 5685 B12R1.69 C=CCSc1ccc(cc1N)O 62a_100011999798_100000210623 [0,2,0,0,0,0|1,0,0]=3 5686 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100000210623_100012344904 [0,2,0,0,0,0|0,0,0]=2 5687 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100012344904_100000210623 [0,2,0,0,0,0|0,0,0]=2 5688 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100000210623_100012002257 [0,2,0,0,0,0|0,0,0]=2 5689 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100012002257_100000210623 [0,2,0,0,0,0|0,0,0]=2 5690 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000050036_100000210623 [0,2,0,0,0,0|0,0,0]=2 5691 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000210623_100000050036 [0,2,0,0,0,0|0,0,0]=2 5692 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000210623_100000690578 [0,2,0,0,0,0|0,0,0]=2 5693 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000690578_100000210623 [0,2,0,0,0,0|0,0,0]=2 5694 B12R1.69 C=CCSc1ccc(cc1O)O 62a_100000210623_100009813921 [0,2,0,0,0,0|0,0,0]=2 5695 B12R1.69 C=CCSc1ccc(nc1Br)N 62a_100000210623_100010734177 [0,2,0,0,0,0|2,0,0]=4 5696 B12R1.69 C=CCSc1ccc(nc1Br)N 62a_100010734177_100000210623 [0,2,0,0,0,0|2,0,0]=4 5697 B12R1.69 C=CCSc1ccc(nc1C)C 62a_100000210623_100009813853 [0,2,0,0,0,0|2,0,0]=4 5698 B12R1.69 C=CCSc1ccc(nc1C)C 62a_100009813853_100000210623 [0,2,0,0,0,0|2,0,0]=4 5699 B12R1.69 C=CCSc1ccc(nc1C)Cl 62a_100000062408_100000210623 [0,2,0,0,0,0|2,0,0]=4 5700 B12R1.69 C=CCSc1ccc(nc1C)Cl 62a_100000210623_100000062408 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.69 C=CCSc1ccc(nc1C)F 62a_100000210623_100000688911 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.69 C=CCSc1ccc(nc1C)F 62a_100000688911_100000210623 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.69 C=CCSc1ccc(nc1C)N 62a_100000187202_100000210623 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.69 C=CCSc1ccc(nc1C)N 62a_100000210623_100000187202 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.69 C=CCSc1ccc(nc1C)O 62a_100000210623_100000691680 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.69 C=CCSc1ccc(nc1C)O 62a_100000691680_100000210623 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.69 C=CCSc1ccc(nc1Cl)Br 62a_100000210623_100010246183 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.69 C=CCSc1ccc(nc1Cl)Br 62a_100010246183_100000210623 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.69 C=CCSc1ccc(nc1Cl)Cl 62a_100000210623_100000043682 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.69 C=CCSc1ccc(nc1Cl)N 62a_100000210623_100010270343 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.69 C=CCSc1ccc(nc1Cl)N 62a_100010270343_100000210623 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.69 C=CCSc1ccc(nc1F)C 62a_100000210623_100010006597 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.69 C=CCSc1ccc(nc1F)C 62a_100010006597_100000210623 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.69 C=CCSc1ccc(nc1F)Cl 62a_100000210623_100010168078 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.69 C=CCSc1ccc(nc1F)Cl 62a_100010168078_100000210623 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.69 C=CCSc1ccc(nc1F)F 62a_100000070099_100000210623 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.69 C=CCSc1ccc(nc1F)F 62a_100000210623_100000070099 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.69 C=CCSc1ccc(nc1F)N 62a_100000210623_100009882772 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.69 C=CCSc1ccc(nc1F)N 62a_100009882772_100000210623 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.69 C=CCSc1ccc(nc1F)O 62a_100000210623_100009879308 [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.69 C=CCSc1ccc(nc1F)O 62a_100009879308_100000210623 [0,2,0,0,0,0|2,0,0]=4 5722 B12R1.69 C=CCSc1ccc(nc1N)C 62a_100000210623_100009816662 [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.69 C=CCSc1ccc(nc1N)C 62a_100009816662_100000210623 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.69 C=CCSc1ccc(nc1N)Cl 62a_100000210623_100010171640 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.69 C=CCSc1ccc(nc1N)Cl 62a_100010171640_100000210623 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.69 C=CCSc1ccc(nc1N)F 62a_100000210623_100009854977 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.69 C=CCSc1ccc(nc1N)F 62a_100009854977_100000210623 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.69 C=CCSc1ccc(nc1N)N 62a_100011356871_100000210623 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.69 C=CCSc1ccc(nc1O)C 62a_100000210623_100009817604 [0,2,0,0,0,0|1,0,0]=3 5730 B12R1.69 C=CCSc1ccc(nc1O)C 62a_100009817604_100000210623 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.69 C=CCSc1cnc(cc1Br)F 62a_100000210623_100015451857 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.69 C=CCSc1cnc(cc1Br)F 62a_100015451857_100000210623 [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.69 C=CCSc1cnc(cc1Br)N 62a_100000210623_100010074611 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.69 C=CCSc1cnc(cc1Br)N 62a_100010074611_100000210623 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.69 C=CCSc1cnc(cc1C)Br 62a_100000210623_100009816104 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.69 C=CCSc1cnc(cc1C)Br 62a_100009816104_100000210623 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.69 C=CCSc1cnc(cc1C)C 62a_100000210623_100009819613 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.69 C=CCSc1cnc(cc1C)C 62a_100009819613_100000210623 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.69 C=CCSc1cnc(cc1C)Cl 62a_100000210623_100010172789 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.69 C=CCSc1cnc(cc1C)Cl 62a_100010172789_100000210623 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.69 C=CCSc1cnc(cc1C)F 62a_100000210623_100009820716 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.69 C=CCSc1cnc(cc1C)F 62a_100009820716_100000210623 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.69 C=CCSc1cnc(cc1C)N 62a_100000050067_100000210623 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.69 C=CCSc1cnc(cc1C)N 62a_100000210623_100000050067 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.69 C=CCSc1cnc(cc1C)O 62a_100000210623_100000766222 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.69 C=CCSc1cnc(cc1C)O 62a_100000766222_100000210623 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.69 C=CCSc1cnc(cc1Cl)Br 62a_100000210623_100010381092 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.69 C=CCSc1cnc(cc1Cl)Br 62a_100010381092_100000210623 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.69 C=CCSc1cnc(cc1Cl)Cl 62a_100000210623_100010200927 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.69 C=CCSc1cnc(cc1Cl)Cl 62a_100010200927_100000210623 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.69 C=CCSc1cnc(cc1Cl)N 62a_100000210623_100000694920 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.69 C=CCSc1cnc(cc1Cl)N 62a_100000694920_100000210623 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.69 C=CCSc1cnc(cc1F)Cl 62a_100000210623_100010128100 [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.69 C=CCSc1cnc(cc1F)Cl 62a_100010128100_100000210623 [0,2,0,0,0,0|2,0,0]=4 5755 B12R1.69 C=CCSc1cnc(cc1F)N 62a_100000210623_100009844730 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.69 C=CCSc1cnc(cc1F)N 62a_100009844730_100000210623 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.69 C=CCSc1cnc(cc1N)C 62a_100000210623_100009817891 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.69 C=CCSc1cnc(cc1N)C 62a_100009817891_100000210623 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.69 C=CCSc1cnc(cc1N)Cl 62a_100000210623_100010209552 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.69 C=CCSc1cnc(cc1N)Cl 62a_100010209552_100000210623 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.69 C=CCSc1cnc(cc1N)N 62a_100000210623_200009857908 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.69 C=CCSc1cnc(cc1N)N 62a_200009857908_100000210623 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.69 C=CCSc1cnc(cc1O)C 62a_100000210623_100011016184 [0,2,0,0,0,0|1,0,0]=3 5764 B12R1.69 C=CCSc1cnc(cc1O)C 62a_100011016184_100000210623 [0,2,0,0,0,0|1,0,0]=3 5765 B12R1.69 C=CCSc1ncc(cc1Br)Cl 62a_100000210623_100012154958 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.69 C=CCSc1ncc(cc1Br)Cl 62a_100012154958_100000210623 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.69 C=CCSc1ncc(cc1C)Br 62a_100000210623_100012353652 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.69 C=CCSc1ncc(cc1C)Br 62a_100012353652_100000210623 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.69 C=CCSc1ncc(cc1C)C 62a_100000210623_100009864548 [0,2,0,0,0,0|2,0,0]=4 5770 B12R1.69 C=CCSc1ncc(cc1C)C 62a_100009864548_100000210623 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.69 C=CCSc1ncc(cc1C)F 62a_100000210623_100009817009 [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.69 C=CCSc1ncc(cc1C)F 62a_100009817009_100000210623 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.69 C=CCSc1ncc(cc1C)N 62a_100000210623_100000761747 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.69 C=CCSc1ncc(cc1C)N 62a_100000761747_100000210623 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.69 C=CCSc1ncc(cc1C)O 62a_100000210623_100012000486 [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.69 C=CCSc1ncc(cc1C)O 62a_100012000486_100000210623 [0,2,0,0,0,0|2,0,0]=4 5777 B12R1.69 C=CCSc1ncc(cc1F)Br 62a_100000210623_100012348576 [0,2,0,0,0,0|2,0,0]=4 5778 B12R1.69 C=CCSc1ncc(cc1F)Br 62a_100012348576_100000210623 [0,2,0,0,0,0|2,0,0]=4 5779 B12R1.69 C=CCSc1ncc(cc1F)C 62a_100000210623_100009819633 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.69 C=CCSc1ncc(cc1F)C 62a_100009819633_100000210623 [0,2,0,0,0,0|2,0,0]=4 5781 B12R1.69 C=CCSc1ncc(cc1F)Cl 62a_100000210623_100012348686 [0,2,0,0,0,0|2,0,0]=4 5782 B12R1.69 C=CCSc1ncc(cc1F)Cl 62a_100012348686_100000210623 [0,2,0,0,0,0|2,0,0]=4 5783 B12R1.69 C=CCSc1ncc(cc1F)F 62a_100000210623_100011219543 [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.69 C=CCSc1ncc(cc1F)F 62a_100011219543_100000210623 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.69 C=CCSc1ncc(cc1F)N 62a_100000210623_100010280766 [0,2,0,0,0,0|2,0,0]=4 5786 B12R1.69 C=CCSc1ncc(cc1F)N 62a_100010280766_100000210623 [0,2,0,0,0,0|2,0,0]=4 5787 B12R1.69 C=CCSc1ncc(cc1F)O 62a_100000210623_100000063512 [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.69 C=CCSc1ncc(cc1N)Br 62a_100000210623_100010090555 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.69 C=CCSc1ncc(cc1N)Br 62a_100010090555_100000210623 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.69 C=CCSc1ncc(cc1N)C 62a_100000210623_100000733613 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.69 C=CCSc1ncc(cc1N)C 62a_100000733613_100000210623 [0,2,0,0,0,0|2,0,0]=4 5792 B12R1.69 C=CCSc1ncc(cc1N)F 62a_100000210623_100009817643 [0,2,0,0,0,0|2,0,0]=4 5793 B12R1.69 C=CCSc1ncc(cc1N)F 62a_100009817643_100000210623 [0,2,0,0,0,0|2,0,0]=4 5794 B12R1.69 C=CCSc1ncc(cc1N)N 62a_100000210623_200000093520 [0,2,0,0,0,0|2,0,0]=4 5795 B12R1.69 C=CCSc1ncc(cc1N)N 62a_200000093520_100000210623 [0,2,0,0,0,0|2,0,0]=4 5796 B12R1.69 C=CCSc1ncc(cc1O)Br 62a_100000210623_100010210634 [0,2,0,0,0,0|1,0,0]=3 5797 B12R1.69 C=CCSc1ncc(cc1O)Br 62a_100010210634_100000210623 [0,2,0,0,0,0|1,0,0]=3 5798 B12R1.69 C=CCSc1ncc(cc1O)C 62a_100000210623_100012000487 [0,2,0,0,0,0|1,0,0]=3 5799 B12R1.69 C=CCSc1ncc(cc1O)Cl 62a_100000210623_100010233512 [0,2,0,0,0,0|1,0,0]=3 5800 B12R1.69 C=CCSc1ncc(cc1O)Cl 62a_100010233512_100000210623 [0,2,0,0,0,0|1,0,0]=3 5801 B12R1.69 C=CCSc1ncc(cc1O)F 62a_100000210623_100000079967 [0,2,0,0,0,0|1,0,0]=3 5802 B12R1.69 C=CCSc1ncc(cc1O)F 62a_100009820119_100000210623 [0,2,0,0,0,0|1,0,0]=3 5803 B12R1.69 CCCCc1ccc(cc1O)Br 271570a_100020621405_100012344904 [0,2,0,0,0,0|0,0,2]=4 5804 B12R1.69 CCCCc1ccc(cc1O)C 271570a_100020621405_100012002257 [0,2,0,0,0,0|0,0,2]=4 5805 B12R1.69 CCCCc1ccc(cc1O)Cl 271570a_100020621405_100000050036 [0,2,0,0,0,0|0,0,2]=4 5806 B12R1.69 CCCCc1ccc(cc1O)F 271570a_100020621405_100000690578 [0,2,0,0,0,0|0,0,2]=4 5807 B12R1.69 CCCCc1ccc(cc1O)O 271570a_100020621405_100009813921 [0,2,0,0,0,0|0,0,2]=4 5808 B12R1.69 CCCNc1ccc(cc1O)Br 34a_100000739049_100000210303 [0,2,0,0,0,0|0,0,2]=4 5809 B12R1.69 CCCNc1ccc(cc1O)C 34a_100000211527_100000210303 [0,2,0,0,0,0|0,0,2]=4 5810 B12R1.69 CCCNc1ccc(cc1O)Cl 34a_100000185728_100000210303 [0,2,0,0,0,0|0,0,2]=4 5811 B12R1.69 CCCNc1ccc(cc1O)F 34a_100000753323_100000210303 [0,2,0,0,0,0|0,0,2]=4 5812 B12R1.69 CCCNc1ccc(cc1O)O 34a_100000106777_100000210303 [0,2,0,0,0,0|0,0,2]=4 5813 B12R1.69 CCCOc1ccc(cc1O)F 271570a_203496583355_200000171698 [0,2,0,0,0,0|0,0,2]=4 5814 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100000210303_100012344904 [0,2,0,0,0,0|0,0,2]=4 5815 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100012344904_100000210303 [0,2,0,0,0,0|0,0,2]=4 5816 B12R1.69 CCCSc1ccc(cc1O)C 62a_100000210303_100012002257 [0,2,0,0,0,0|0,0,2]=4 5817 B12R1.69 CCCSc1ccc(cc1O)C 62a_100012002257_100000210303 [0,2,0,0,0,0|0,0,2]=4 5818 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000050036_100000210303 [0,2,0,0,0,0|0,0,2]=4 5819 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000210303_100000050036 [0,2,0,0,0,0|0,0,2]=4 5820 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000210303_100000690578 [0,2,0,0,0,0|0,0,2]=4 5821 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000690578_100000210303 [0,2,0,0,0,0|0,0,2]=4 5822 B12R1.69 CCCSc1ccc(cc1O)O 62a_100000210303_100009813921 [0,2,0,0,0,0|0,0,2]=4 5823 B12R1.69 COCOc1ccc(cc1O)C 271570a_203496583355_100012265689 [0,2,0,0,0,0|1,0,1]=4 5824 B12R1.69 COCSc1ccc(cc1O)Br 62a_100000766300_100012344904 [0,2,0,0,0,0|1,0,1]=4 5825 B12R1.69 COCSc1ccc(cc1O)Br 62a_100012344904_100000766300 [0,2,0,0,0,0|1,0,1]=4 5826 B12R1.69 COCSc1ccc(cc1O)C 62a_100000766300_100012002257 [0,2,0,0,0,0|1,0,1]=4 5827 B12R1.69 COCSc1ccc(cc1O)C 62a_100012002257_100000766300 [0,2,0,0,0,0|1,0,1]=4 5828 B12R1.69 COCSc1ccc(cc1O)Cl 62a_100000050036_100000766300 [0,2,0,0,0,0|1,0,1]=4 5829 B12R1.69 COCSc1ccc(cc1O)Cl 62a_100000766300_100000050036 [0,2,0,0,0,0|1,0,1]=4 5830 B12R1.69 COCSc1ccc(cc1O)F 62a_100000690578_100000766300 [0,2,0,0,0,0|1,0,1]=4 5831 B12R1.69 COCSc1ccc(cc1O)F 62a_100000766300_100000690578 [0,2,0,0,0,0|1,0,1]=4 5832 B12R1.69 COCSc1ccc(cc1O)O 62a_100000766300_100009813921 [0,2,0,0,0,0|1,0,1]=4 5833 B12R1.69 CSCNc1ccc(cc1O)Br 34a_100000739049_100011218213 [0,2,0,0,0,0|1,0,1]=4 5834 B12R1.69 CSCNc1ccc(cc1O)C 34a_100000211527_100011218213 [0,2,0,0,0,0|1,0,1]=4 5835 B12R1.69 CSCNc1ccc(cc1O)Cl 34a_100000185728_100011218213 [0,2,0,0,0,0|1,0,1]=4 5836 B12R1.69 CSCNc1ccc(cc1O)F 34a_100000753323_100011218213 [0,2,0,0,0,0|1,0,1]=4 5837 B12R1.69 CSCNc1ccc(cc1O)O 34a_100000106777_100011218213 [0,2,0,0,0,0|1,0,1]=4 5838 B12R1.69 CSCSc1ccc(cc1O)Br 62a_100011218213_100012344904 [0,2,0,0,0,0|1,0,1]=4 5839 B12R1.69 CSCSc1ccc(cc1O)Br 62a_100012344904_100011218213 [0,2,0,0,0,0|1,0,1]=4 5840 B12R1.69 CSCSc1ccc(cc1O)C 62a_100011218213_100012002257 [0,2,0,0,0,0|1,0,1]=4 5841 B12R1.69 CSCSc1ccc(cc1O)C 62a_100012002257_100011218213 [0,2,0,0,0,0|1,0,1]=4 5842 B12R1.69 CSCSc1ccc(cc1O)Cl 62a_100000050036_100011218213 [0,2,0,0,0,0|1,0,1]=4 5843 B12R1.69 CSCSc1ccc(cc1O)Cl 62a_100011218213_100000050036 [0,2,0,0,0,0|1,0,1]=4 5844 B12R1.69 CSCSc1ccc(cc1O)F 62a_100000690578_100011218213 [0,2,0,0,0,0|1,0,1]=4 5845 B12R1.69 CSCSc1ccc(cc1O)F 62a_100011218213_100000690578 [0,2,0,0,0,0|1,0,1]=4 5846 B12R1.69 CSCSc1ccc(cc1O)O 62a_100011218213_100009813921 [0,2,0,0,0,0|1,0,1]=4 5847 B12R1.69 Cc1cc(c(cn1)SCC=O)O 62a_100011016184_200015260668 [0,2,0,0,0,0|2,0,0]=4 5848 B12R1.69 Cc1cc(c(cn1)SCC=O)O 62a_200015260668_100011016184 [0,2,0,0,0,0|2,0,0]=4 5849 B12R1.69 Cc1cc(ccc1NCC=O)Br 34a_100000211769_200009817547 [0,2,0,0,0,0|2,0,0]=4 5850 B12R1.69 Cc1cc(ccc1NCC=O)Br 7a_100000211769_200015260668 [0,2,0,0,0,0|2,0,0]=4 5851 B12R1.69 Cc1cc(ccc1NCC=O)Cl 34a_100000210418_200009817547 [0,2,0,0,0,0|2,0,0]=4 5852 B12R1.69 Cc1cc(ccc1NCC=O)Cl 7a_100000210418_200015260668 [0,2,0,0,0,0|2,0,0]=4 5853 B12R1.69 Cc1cc(ccc1NCC=O)F 34a_100000211637_200009817547 [0,2,0,0,0,0|2,0,0]=4 5854 B12R1.69 Cc1cc(ccc1NCC=O)F 7a_100000211637_200015260668 [0,2,0,0,0,0|2,0,0]=4 5855 B12R1.69 Cc1cc(ccc1NCC=O)I 34a_100000184554_200009817547 [0,2,0,0,0,0|2,0,0]=4 5856 B12R1.69 Cc1cc(ccc1NCC=O)I 7a_100000184554_200015260668 [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.69 Cc1cc(ccc1NCC=O)O 34a_100000756630_200009817547 [0,2,0,0,0,0|2,0,0]=4 5858 B12R1.69 Cc1cc(ccc1OCC=O)Br 34a_100000186361_200009817547 [0,2,0,0,0,0|2,0,0]=4 5859 B12R1.69 Cc1cc(ccc1OCC=O)Br 7a_100000186361_200015260668 [0,2,0,0,0,0|2,0,0]=4 5860 B12R1.69 Cc1cc(ccc1OCC=O)Cl 34a_100000211091_200009817547 [0,2,0,0,0,0|2,0,0]=4 5861 B12R1.69 Cc1cc(ccc1OCC=O)Cl 7a_100000211091_200015260668 [0,2,0,0,0,0|2,0,0]=4 5862 B12R1.69 Cc1cc(ccc1OCC=O)F 34a_100000764316_200009817547 [0,2,0,0,0,0|2,0,0]=4 5863 B12R1.69 Cc1cc(ccc1OCC=O)F 7a_100000764316_200015260668 [0,2,0,0,0,0|2,0,0]=4 5864 B12R1.69 Cc1cc(ccc1OCC=O)I 34a_100011218673_200009817547 [0,2,0,0,0,0|2,0,0]=4 5865 B12R1.69 Cc1cc(ccc1OCC=O)I 7a_100011218673_200015260668 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.69 Cc1cc(ccc1OCC=O)N 34a_100011218179_200009817547 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.69 Cc1cc(ccc1OCC=O)N 7a_100011218179_200015260668 [0,2,0,0,0,0|2,0,0]=4 5868 B12R1.69 Cc1cc(ccc1SCC=O)Br 62a_100000701812_200015260668 [0,2,0,0,0,0|2,0,0]=4 5869 B12R1.69 Cc1cc(ccc1SCC=O)Br 62a_200015260668_100000701812 [0,2,0,0,0,0|2,0,0]=4 5870 B12R1.69 Cc1cc(ccc1SCC=O)Cl 62a_100011219607_200015260668 [0,2,0,0,0,0|2,0,0]=4 5871 B12R1.69 Cc1cc(ccc1SCC=O)Cl 62a_200015260668_100011219607 [0,2,0,0,0,0|2,0,0]=4 5872 B12R1.69 Cc1cc(ccc1SCC=O)F 62a_100011205405_200015260668 [0,2,0,0,0,0|2,0,0]=4 5873 B12R1.69 Cc1cc(ccc1SCC=O)F 62a_200015260668_100011205405 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.69 Cc1cc(ccc1SCC=O)N 62a_100000210723_200015260668 [0,2,0,0,0,0|2,0,0]=4 5875 B12R1.69 Cc1cc(ccc1SCC=O)N 62a_200015260668_100000210723 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.69 Cc1cc(ccc1SCC=O)O 62a_200015260668_100000690111 [0,2,0,0,0,0|2,0,0]=4 5877 B12R1.69 Cc1ccc(c(c1)Br)NCC=O 34a_100000210942_200009817547 [0,2,0,0,0,0|2,0,0]=4 5878 B12R1.69 Cc1ccc(c(c1)Br)OCC=O 34a_100000210800_200009817547 [0,2,0,0,0,0|2,0,0]=4 5879 B12R1.69 Cc1ccc(c(c1)Br)OCC=O 7a_100000210800_200015260668 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.69 Cc1ccc(c(c1)Br)SCC=O 62a_100009813563_200015260668 [0,2,0,0,0,0|2,0,0]=4 5881 B12R1.69 Cc1ccc(c(c1)Br)SCC=O 62a_200015260668_100009813563 [0,2,0,0,0,0|2,0,0]=4 5882 B12R1.69 Cc1ccc(c(c1)C)NCC=O 34a_100000736561_200009817547 [0,2,0,0,0,0|2,0,0]=4 5883 B12R1.69 Cc1ccc(c(c1)C)NCC=O 7a_100000736561_200015260668 [0,2,0,0,0,0|2,0,0]=4 5884 B12R1.69 Cc1ccc(c(c1)C)OCC=O 34a_100000211776_200009817547 [0,2,0,0,0,0|2,0,0]=4 5885 B12R1.69 Cc1ccc(c(c1)C)OCC=O 7a_100000211776_200015260668 [0,2,0,0,0,0|2,0,0]=4 5886 B12R1.69 Cc1ccc(c(c1)C)SCC=O 62a_100011217332_200015260668 [0,2,0,0,0,0|2,0,0]=4 5887 B12R1.69 Cc1ccc(c(c1)C)SCC=O 62a_200015260668_100011217332 [0,2,0,0,0,0|2,0,0]=4 5888 B12R1.69 Cc1ccc(c(c1)Cl)NCC=O 34a_100000210522_200009817547 [0,2,0,0,0,0|2,0,0]=4 5889 B12R1.69 Cc1ccc(c(c1)Cl)OCC=O 34a_100000749699_200009817547 [0,2,0,0,0,0|2,0,0]=4 5890 B12R1.69 Cc1ccc(c(c1)Cl)OCC=O 7a_100000749699_200015260668 [0,2,0,0,0,0|2,0,0]=4 5891 B12R1.69 Cc1ccc(c(c1)Cl)SCC=O 62a_100011263221_200015260668 [0,2,0,0,0,0|2,0,0]=4 5892 B12R1.69 Cc1ccc(c(c1)Cl)SCC=O 62a_200015260668_100011263221 [0,2,0,0,0,0|2,0,0]=4 5893 B12R1.69 Cc1ccc(c(c1)F)NCC=O 34a_100000211023_200009817547 [0,2,0,0,0,0|2,0,0]=4 5894 B12R1.69 Cc1ccc(c(c1)F)OCC=O 34a_100011216688_200009817547 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.69 Cc1ccc(c(c1)F)OCC=O 7a_100011216688_200015260668 [0,2,0,0,0,0|2,0,0]=4 5896 B12R1.69 Cc1ccc(c(c1)F)SCC=O 62a_100011216119_200015260668 [0,2,0,0,0,0|2,0,0]=4 5897 B12R1.69 Cc1ccc(c(c1)F)SCC=O 62a_200015260668_100011216119 [0,2,0,0,0,0|2,0,0]=4 5898 B12R1.69 Cc1ccc(c(c1)I)NCC=O 34a_100011356834_200009817547 [0,2,0,0,0,0|2,0,0]=4 5899 B12R1.69 Cc1ccc(c(c1)I)OCC=O 34a_100000765521_200009817547 [0,2,0,0,0,0|2,0,0]=4 5900 B12R1.69 Cc1ccc(c(c1)I)OCC=O 7a_100000765521_200015260668 [0,2,0,0,0,0|2,0,0]=4 5901 B12R1.69 Cc1ccc(c(c1)N)OCC=O 34a_100011215204_200009817547 [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.69 Cc1ccc(c(c1)N)OCC=O 7a_100011215204_200015260668 [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.69 Cc1ccc(c(c1)N)SCC=O 62a_100011216686_200015260668 [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.69 Cc1ccc(c(c1)N)SCC=O 62a_200015260668_100011216686 [0,2,0,0,0,0|2,0,0]=4 5905 B12R1.69 Cc1ccc(c(c1)O)NCC=O 34a_100000211527_200009817547 [0,2,0,0,0,0|1,0,0]=3 5906 B12R1.69 Cc1ccc(c(c1)O)NCCF 34a_100000211527_100011217306 [0,2,0,0,0,0|1,0,1]=4 5907 B12R1.69 Cc1ccc(c(c1)O)NCCO 34a_100000211527_100000211926 [0,2,0,0,0,0|1,0,1]=4 5908 B12R1.69 Cc1ccc(c(c1)O)OCCN 271570a_203496583355_100025744979 [0,2,0,0,0,0|1,0,1]=4 5909 B12R1.69 Cc1ccc(c(c1)O)SCC#N 62a_100011215382_100012002257 [0,2,0,0,0,0|1,0,1]=4 5910 B12R1.69 Cc1ccc(c(c1)O)SCC#N 62a_100012002257_100011215382 [0,2,0,0,0,0|1,0,1]=4 5911 B12R1.69 Cc1ccc(c(c1)O)SCC=O 62a_100012002257_200015260668 [0,2,0,0,0,0|1,0,0]=3 5912 B12R1.69 Cc1ccc(c(c1)O)SCC=O 62a_200015260668_100012002257 [0,2,0,0,0,0|1,0,0]=3 5913 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100011217306_100012002257 [0,2,0,0,0,0|1,0,1]=4 5914 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100012002257_100011217306 [0,2,0,0,0,0|1,0,1]=4 5915 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100000211926_100012002257 [0,2,0,0,0,0|1,0,1]=4 5916 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100012002257_100000211926 [0,2,0,0,0,0|1,0,1]=4 5917 B12R1.69 Cc1ccc(c(n1)O)SCC=O 62a_100009817604_200015260668 [0,2,0,0,0,0|2,0,0]=4 5918 B12R1.69 Cc1ccc(c(n1)O)SCC=O 62a_200015260668_100009817604 [0,2,0,0,0,0|2,0,0]=4 5919 B12R1.69 Cc1cnc(c(c1)O)SCC=O 62a_200015260668_100012000487 [0,2,0,0,0,0|2,0,0]=4 5920 B12R1.69 N#CCSc1ccc(cc1O)Br 62a_100011215382_100012344904 [0,2,0,0,0,0|1,0,1]=4 5921 B12R1.69 N#CCSc1ccc(cc1O)Br 62a_100012344904_100011215382 [0,2,0,0,0,0|1,0,1]=4 5922 B12R1.69 N#CCSc1ccc(cc1O)Cl 62a_100000050036_100011215382 [0,2,0,0,0,0|1,0,1]=4 5923 B12R1.69 N#CCSc1ccc(cc1O)Cl 62a_100011215382_100000050036 [0,2,0,0,0,0|1,0,1]=4 5924 B12R1.69 N#CCSc1ccc(cc1O)F 62a_100000690578_100011215382 [0,2,0,0,0,0|1,0,1]=4 5925 B12R1.69 N#CCSc1ccc(cc1O)F 62a_100011215382_100000690578 [0,2,0,0,0,0|1,0,1]=4 5926 B12R1.69 N#CCSc1ccc(cc1O)O 62a_100011215382_100009813921 [0,2,0,0,0,0|1,0,1]=4 5927 B12R1.69 Nc1cc(ccc1OCC=O)Br 34a_100000752626_200009817547 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.69 Nc1cc(ccc1OCC=O)Br 7a_100000752626_200015260668 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.69 Nc1cc(ccc1OCC=O)Cl 34a_100000210500_200009817547 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.69 Nc1cc(ccc1OCC=O)Cl 7a_100000210500_200015260668 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.69 Nc1cc(ccc1OCC=O)F 34a_100000759472_200009817547 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.69 Nc1cc(ccc1OCC=O)F 7a_100000759472_200015260668 [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.69 Nc1cc(ccc1OCC=O)I 34a_100000753495_200009817547 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.69 Nc1cc(ccc1OCC=O)I 7a_100000753495_200015260668 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.69 Nc1cc(ccc1SCC=O)Br 62a_100000743836_200015260668 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.69 Nc1cc(ccc1SCC=O)Br 62a_200015260668_100000743836 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.69 Nc1cc(ccc1SCC=O)Cl 62a_100000761886_200015260668 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.69 Nc1cc(ccc1SCC=O)Cl 62a_200015260668_100000761886 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.69 Nc1cc(ccc1SCC=O)F 62a_100000687223_200015260668 [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.69 Nc1cc(ccc1SCC=O)F 62a_200015260668_100000687223 [0,2,0,0,0,0|2,0,0]=4 5941 B12R1.69 Nc1cc(ccc1SCC=O)O 62a_100011999798_200015260668 [0,2,0,0,0,0|2,0,0]=4 5942 B12R1.69 Nc1cc(ccc1SCC=O)O 62a_200015260668_100011999798 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.69 Nc1ccc(c(c1)Br)OCC=O 34a_100011534360_200009817547 [0,2,0,0,0,0|2,0,0]=4 5944 B12R1.69 Nc1ccc(c(c1)Br)OCC=O 7a_100011534360_200015260668 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.69 Nc1ccc(c(c1)Br)SCC=O 62a_100000750458_200015260668 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.69 Nc1ccc(c(c1)Br)SCC=O 62a_200015260668_100000750458 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.69 Nc1ccc(c(c1)Cl)OCC=O 34a_100000744943_200009817547 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.69 Nc1ccc(c(c1)Cl)OCC=O 7a_100000744943_200015260668 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.69 Nc1ccc(c(c1)Cl)SCC=O 62a_100000761885_200015260668 [0,2,0,0,0,0|2,0,0]=4 5950 B12R1.69 Nc1ccc(c(c1)Cl)SCC=O 62a_200015260668_100000761885 [0,2,0,0,0,0|2,0,0]=4 5951 B12R1.69 Nc1ccc(c(c1)F)OCC=O 34a_100011220035_200009817547 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.69 Nc1ccc(c(c1)F)OCC=O 7a_100011220035_200015260668 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.69 Nc1ccc(c(c1)F)SCC=O 62a_100011356925_200015260668 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.69 Nc1ccc(c(c1)F)SCC=O 62a_200015260668_100011356925 [0,2,0,0,0,0|2,0,0]=4 5955 B12R1.69 Nc1ccc(c(c1)N)OCC=O 34a_100000725306_200009817547 [0,2,0,0,0,0|2,0,0]=4 5956 B12R1.69 Nc1ccc(c(c1)N)SCC=O 62a_200012175722_200015260668 [0,2,0,0,0,0|2,0,0]=4 5957 B12R1.69 Nc1ccc(c(c1)N)SCC=O 62a_200015260668_200012175722 [0,2,0,0,0,0|2,0,0]=4 5958 B12R1.69 O=CCNc1ccc(cc1Br)Br 34a_100000211012_200009817547 [0,2,0,0,0,0|2,0,0]=4 5959 B12R1.69 O=CCNc1ccc(cc1Br)Cl 34a_100000752454_200009817547 [0,2,0,0,0,0|2,0,0]=4 5960 B12R1.69 O=CCNc1ccc(cc1Br)F 34a_100000738039_200009817547 [0,2,0,0,0,0|2,0,0]=4 5961 B12R1.69 O=CCNc1ccc(cc1Br)O 34a_100012001276_200009817547 [0,2,0,0,0,0|2,0,0]=4 5962 B12R1.69 O=CCNc1ccc(cc1Cl)Br 34a_100000211467_200009817547 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.69 O=CCNc1ccc(cc1Cl)Cl 34a_100000185861_200009817547 [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.69 O=CCNc1ccc(cc1Cl)F 34a_100000212003_200009817547 [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.69 O=CCNc1ccc(cc1Cl)I 34a_100011218065_200009817547 [0,2,0,0,0,0|2,0,0]=4 5966 B12R1.69 O=CCNc1ccc(cc1Cl)O 34a_100011215599_200009817547 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.69 O=CCNc1ccc(cc1F)Br 34a_100000210722_200009817547 [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.69 O=CCNc1ccc(cc1F)Cl 34a_100000211020_200009817547 [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.69 O=CCNc1ccc(cc1F)F 34a_100000210720_200009817547 [0,2,0,0,0,0|2,0,0]=4 5970 B12R1.69 O=CCNc1ccc(cc1F)I 34a_100011215594_200009817547 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.69 O=CCNc1ccc(cc1F)O 34a_100000759473_200009817547 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.69 O=CCNc1ccc(cc1I)Br 34a_100000187925_200009817547 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.69 O=CCNc1ccc(cc1I)Cl 34a_100000761889_200009817547 [0,2,0,0,0,0|2,0,0]=4 5974 B12R1.69 O=CCNc1ccc(cc1I)F 34a_100000760547_200009817547 [0,2,0,0,0,0|2,0,0]=4 5975 B12R1.69 O=CCNc1ccc(cc1I)O 34a_100010084370_200009817547 [0,2,0,0,0,0|2,0,0]=4 5976 B12R1.69 O=CCNc1ccc(cc1O)Br 34a_100000739049_200009817547 [0,2,0,0,0,0|1,0,0]=3 5977 B12R1.69 O=CCNc1ccc(cc1O)Cl 34a_100000185728_200009817547 [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.69 O=CCNc1ccc(cc1O)F 34a_100000753323_200009817547 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.69 O=CCNc1ccc(cc1O)O 34a_100000106777_200009817547 [0,2,0,0,0,0|1,0,0]=3 5980 B12R1.69 O=CCOc1ccc(cc1Br)Br 34a_100000188717_200009817547 [0,2,0,0,0,0|2,0,0]=4 5981 B12R1.69 O=CCOc1ccc(cc1Br)Br 7a_100000188717_200015260668 [0,2,0,0,0,0|2,0,0]=4 5982 B12R1.69 O=CCOc1ccc(cc1Br)Cl 34a_100000211998_200009817547 [0,2,0,0,0,0|2,0,0]=4 5983 B12R1.69 O=CCOc1ccc(cc1Br)Cl 7a_100000211998_200015260668 [0,2,0,0,0,0|2,0,0]=4 5984 B12R1.69 O=CCOc1ccc(cc1Br)F 34a_100000211999_200009817547 [0,2,0,0,0,0|2,0,0]=4 5985 B12R1.69 O=CCOc1ccc(cc1Br)F 7a_100000211999_200015260668 [0,2,0,0,0,0|2,0,0]=4 5986 B12R1.69 O=CCOc1ccc(cc1Br)I 34a_100012361655_200009817547 [0,2,0,0,0,0|2,0,0]=4 5987 B12R1.69 O=CCOc1ccc(cc1Br)I 7a_100012361655_200015260668 [0,2,0,0,0,0|2,0,0]=4 5988 B12R1.69 O=CCOc1ccc(cc1Cl)Br 34a_100000186472_200009817547 [0,2,0,0,0,0|2,0,0]=4 5989 B12R1.69 O=CCOc1ccc(cc1Cl)Br 7a_100000186472_200015260668 [0,2,0,0,0,0|2,0,0]=4 5990 B12R1.69 O=CCOc1ccc(cc1Cl)Cl 34a_100015191787_200009817547 [0,2,0,0,0,0|2,0,0]=4 5991 B12R1.69 O=CCOc1ccc(cc1Cl)Cl 7a_100015191787_200015260668 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.69 O=CCOc1ccc(cc1Cl)F 34a_100000212004_200009817547 [0,2,0,0,0,0|2,0,0]=4 5993 B12R1.69 O=CCOc1ccc(cc1Cl)F 7a_100000212004_200015260668 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.69 O=CCOc1ccc(cc1Cl)I 34a_100012360047_200009817547 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.69 O=CCOc1ccc(cc1Cl)I 7a_100012360047_200015260668 [0,2,0,0,0,0|2,0,0]=4 5996 B12R1.69 O=CCOc1ccc(cc1F)Br 34a_100000185481_200009817547 [0,2,0,0,0,0|2,0,0]=4 5997 B12R1.69 O=CCOc1ccc(cc1F)Br 7a_100000185481_200015260668 [0,2,0,0,0,0|2,0,0]=4 5998 B12R1.69 O=CCOc1ccc(cc1F)Cl 34a_100000230166_200009817547 [0,2,0,0,0,0|2,0,0]=4 5999 B12R1.69 O=CCOc1ccc(cc1F)Cl 7a_100000230166_200015260668 [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.69 O=CCOc1ccc(cc1F)F 34a_100000230127_200009817547 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.69 O=CCOc1ccc(cc1F)F 7a_100000230127_200015260668 [0,2,0,0,0,0|2,0,0]=4 6002 B12R1.69 O=CCOc1ccc(cc1F)I 34a_100011356965_200009817547 [0,2,0,0,0,0|2,0,0]=4 6003 B12R1.69 O=CCOc1ccc(cc1F)I 7a_100011356965_200015260668 [0,2,0,0,0,0|2,0,0]=4 6004 B12R1.69 O=CCOc1ccc(cc1I)Br 34a_100012355227_200009817547 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.69 O=CCOc1ccc(cc1I)Br 7a_100012355227_200015260668 [0,2,0,0,0,0|2,0,0]=4 6006 B12R1.69 O=CCOc1ccc(cc1I)Cl 34a_100011356953_200009817547 [0,2,0,0,0,0|2,0,0]=4 6007 B12R1.69 O=CCOc1ccc(cc1I)Cl 7a_100011356953_200015260668 [0,2,0,0,0,0|2,0,0]=4 6008 B12R1.69 O=CCOc1ccc(cc1I)F 34a_100012355409_200009817547 [0,2,0,0,0,0|2,0,0]=4 6009 B12R1.69 O=CCOc1ccc(cc1I)F 7a_100012355409_200015260668 [0,2,0,0,0,0|2,0,0]=4 6010 B12R1.69 O=CCOc1ccc(cc1I)I 7a_100010001573_200015260668 [0,2,0,0,0,0|2,0,0]=4 6011 B12R1.69 O=CCSc1ccc(cc1Br)Br 62a_100011484698_200015260668 [0,2,0,0,0,0|2,0,0]=4 6012 B12R1.69 O=CCSc1ccc(cc1Br)Br 62a_200015260668_100011484698 [0,2,0,0,0,0|2,0,0]=4 6013 B12R1.69 O=CCSc1ccc(cc1Br)Cl 62a_100011219703_200015260668 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.69 O=CCSc1ccc(cc1Br)Cl 62a_200015260668_100011219703 [0,2,0,0,0,0|2,0,0]=4 6015 B12R1.69 O=CCSc1ccc(cc1Br)F 62a_100011217111_200015260668 [0,2,0,0,0,0|2,0,0]=4 6016 B12R1.69 O=CCSc1ccc(cc1Br)F 62a_200015260668_100011217111 [0,2,0,0,0,0|2,0,0]=4 6017 B12R1.69 O=CCSc1ccc(cc1Br)O 62a_100000701344_200015260668 [0,2,0,0,0,0|2,0,0]=4 6018 B12R1.69 O=CCSc1ccc(cc1Br)O 62a_200015260668_100000701344 [0,2,0,0,0,0|2,0,0]=4 6019 B12R1.69 O=CCSc1ccc(cc1Cl)Br 62a_100011216062_200015260668 [0,2,0,0,0,0|2,0,0]=4 6020 B12R1.69 O=CCSc1ccc(cc1Cl)Br 62a_200015260668_100011216062 [0,2,0,0,0,0|2,0,0]=4 6021 B12R1.69 O=CCSc1ccc(cc1Cl)Cl 62a_100000699841_200015260668 [0,2,0,0,0,0|2,0,0]=4 6022 B12R1.69 O=CCSc1ccc(cc1Cl)Cl 62a_200015260668_100000699841 [0,2,0,0,0,0|2,0,0]=4 6023 B12R1.69 O=CCSc1ccc(cc1Cl)F 62a_100000733362_200015260668 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.69 O=CCSc1ccc(cc1Cl)F 62a_200015260668_100000733362 [0,2,0,0,0,0|2,0,0]=4 6025 B12R1.69 O=CCSc1ccc(cc1Cl)O 62a_100000047559_200015260668 [0,2,0,0,0,0|2,0,0]=4 6026 B12R1.69 O=CCSc1ccc(cc1Cl)O 62a_200015260668_100000047559 [0,2,0,0,0,0|2,0,0]=4 6027 B12R1.69 O=CCSc1ccc(cc1F)Br 62a_100009814013_200015260668 [0,2,0,0,0,0|2,0,0]=4 6028 B12R1.69 O=CCSc1ccc(cc1F)Br 62a_200015260668_100009814013 [0,2,0,0,0,0|2,0,0]=4 6029 B12R1.69 O=CCSc1ccc(cc1F)Cl 62a_100011216042_200015260668 [0,2,0,0,0,0|2,0,0]=4 6030 B12R1.69 O=CCSc1ccc(cc1F)Cl 62a_200015260668_100011216042 [0,2,0,0,0,0|2,0,0]=4 6031 B12R1.69 O=CCSc1ccc(cc1F)F 62a_100000750030_200015260668 [0,2,0,0,0,0|2,0,0]=4 6032 B12R1.69 O=CCSc1ccc(cc1F)F 62a_200015260668_100000750030 [0,2,0,0,0,0|2,0,0]=4 6033 B12R1.69 O=CCSc1ccc(cc1F)O 62a_100000755031_200015260668 [0,2,0,0,0,0|2,0,0]=4 6034 B12R1.69 O=CCSc1ccc(cc1F)O 62a_200015260668_100000755031 [0,2,0,0,0,0|2,0,0]=4 6035 B12R1.69 O=CCSc1ccc(cc1O)Br 62a_100012344904_200015260668 [0,2,0,0,0,0|1,0,0]=3 6036 B12R1.69 O=CCSc1ccc(cc1O)Br 62a_200015260668_100012344904 [0,2,0,0,0,0|1,0,0]=3 6037 B12R1.69 O=CCSc1ccc(cc1O)Cl 62a_100000050036_200015260668 [0,2,0,0,0,0|1,0,0]=3 6038 B12R1.69 O=CCSc1ccc(cc1O)Cl 62a_200015260668_100000050036 [0,2,0,0,0,0|1,0,0]=3 6039 B12R1.69 O=CCSc1ccc(cc1O)F 62a_100000690578_200015260668 [0,2,0,0,0,0|1,0,0]=3 6040 B12R1.69 O=CCSc1ccc(cc1O)F 62a_200015260668_100000690578 [0,2,0,0,0,0|1,0,0]=3 6041 B12R1.69 O=CCSc1ccc(cc1O)O 62a_200015260668_100009813921 [0,2,0,0,0,0|1,0,0]=3 6042 B12R1.69 O=CCSc1ncc(cc1O)Br 62a_100010210634_200015260668 [0,2,0,0,0,0|2,0,0]=4 6043 B12R1.69 O=CCSc1ncc(cc1O)Br 62a_200015260668_100010210634 [0,2,0,0,0,0|2,0,0]=4 6044 B12R1.69 O=CCSc1ncc(cc1O)Cl 62a_100010233512_200015260668 [0,2,0,0,0,0|2,0,0]=4 6045 B12R1.69 O=CCSc1ncc(cc1O)Cl 62a_200015260668_100010233512 [0,2,0,0,0,0|2,0,0]=4 6046 B12R1.69 O=CCSc1ncc(cc1O)F 62a_100009820119_200015260668 [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.69 O=CCSc1ncc(cc1O)F 62a_200015260668_100000079967 [0,2,0,0,0,0|2,0,0]=4 6048 B12R1.69 OCCNc1ccc(cc1O)Br 34a_100000739049_100000211926 [0,2,0,0,0,0|1,0,1]=4 6049 B12R1.69 OCCNc1ccc(cc1O)Cl 34a_100000185728_100000211926 [0,2,0,0,0,0|1,0,1]=4 6050 B12R1.69 OCCNc1ccc(cc1O)F 34a_100000753323_100000211926 [0,2,0,0,0,0|1,0,1]=4 6051 B12R1.69 OCCNc1ccc(cc1O)O 34a_100000106777_100000211926 [0,2,0,0,0,0|1,0,1]=4 6052 B12R1.69 OCCSc1ccc(cc1O)Br 62a_100000211926_100012344904 [0,2,0,0,0,0|1,0,1]=4 6053 B12R1.69 OCCSc1ccc(cc1O)Br 62a_100012344904_100000211926 [0,2,0,0,0,0|1,0,1]=4 6054 B12R1.69 OCCSc1ccc(cc1O)Cl 62a_100000050036_100000211926 [0,2,0,0,0,0|1,0,1]=4 6055 B12R1.69 OCCSc1ccc(cc1O)Cl 62a_100000211926_100000050036 [0,2,0,0,0,0|1,0,1]=4 6056 B12R1.69 OCCSc1ccc(cc1O)F 62a_100000211926_100000690578 [0,2,0,0,0,0|1,0,1]=4 6057 B12R1.69 OCCSc1ccc(cc1O)F 62a_100000690578_100000211926 [0,2,0,0,0,0|1,0,1]=4 6058 B12R1.69 OCCSc1ccc(cc1O)O 62a_100000211926_100009813921 [0,2,0,0,0,0|1,0,1]=4 6059 B12R1.69 Oc1cc(ccc1NCCF)Br 34a_100000739049_100011217306 [0,2,0,0,0,0|1,0,1]=4 6060 B12R1.69 Oc1cc(ccc1NCCF)Cl 34a_100000185728_100011217306 [0,2,0,0,0,0|1,0,1]=4 6061 B12R1.69 Oc1cc(ccc1NCCF)F 34a_100000753323_100011217306 [0,2,0,0,0,0|1,0,1]=4 6062 B12R1.69 Oc1cc(ccc1SCCF)Br 62a_100011217306_100012344904 [0,2,0,0,0,0|1,0,1]=4 6063 B12R1.69 Oc1cc(ccc1SCCF)Br 62a_100012344904_100011217306 [0,2,0,0,0,0|1,0,1]=4 6064 B12R1.69 Oc1cc(ccc1SCCF)Cl 62a_100000050036_100011217306 [0,2,0,0,0,0|1,0,1]=4 6065 B12R1.69 Oc1cc(ccc1SCCF)Cl 62a_100011217306_100000050036 [0,2,0,0,0,0|1,0,1]=4 6066 B12R1.69 Oc1cc(ccc1SCCF)F 62a_100000690578_100011217306 [0,2,0,0,0,0|1,0,1]=4 6067 B12R1.69 Oc1cc(ccc1SCCF)F 62a_100011217306_100000690578 [0,2,0,0,0,0|1,0,1]=4 6068 B12R1.69 Oc1ccc(c(c1)O)NCCF 34a_100000106777_100011217306 [0,2,0,0,0,0|1,0,1]=4 6069 B12R1.69 Oc1ccc(c(c1)O)SCCF 62a_100011217306_100009813921 [0,2,0,0,0,0|1,0,1]=4 6070 B12R1.121 C#CCNc1ccccc1CO 34a_100000212039_100000184674 [0,2,0,0,0,0|0,0,2]=4 6071 B12R1.121 C#CCNc1ccccc1OC 34a_100000210025_100000184674 [0,2,0,0,0,0|0,0,2]=4 6072 B12R1.121 C#CCOc1ccccc1CO 34a_100011216872_100000184674 [0,2,0,0,0,0|0,0,2]=4 6073 B12R1.121 C#CCOc1ccccc1OC 34a_100000210385_100000184674 [0,2,0,0,0,0|0,0,2]=4 6074 B12R1.121 C#CCSc1ccccc1CO 62a_100000038162_100000187465 [0,2,0,0,0,0|0,0,2]=4 6075 B12R1.121 C#CCSc1ccccc1OC 62a_100000038162_100000210334 [0,2,0,0,0,0|0,0,2]=4 6076 B12R1.121 C#Cc1ccccc1NCC=C 34a_100011470550_100015514636 [0,2,0,0,0,0|1,0,0]=3 6077 B12R1.121 C#Cc1ccccc1NCC=O 34a_100011470550_200009817547 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.121 C#Cc1ccccc1OCC=C 34a_200011470546_100015514636 [0,2,0,0,0,0|1,0,0]=3 6079 B12R1.121 C#Cc1ccccc1OCC=C 7a_200011470546_100015514636 [0,2,0,0,0,0|1,0,0]=3 6080 B12R1.121 C#Cc1ccccc1OCC=O 34a_200011470546_200009817547 [0,2,0,0,0,0|2,0,0]=4 6081 B12R1.121 C#Cc1ccccc1OCC=O 7a_200011470546_200015260668 [0,2,0,0,0,0|2,0,0]=4 6082 B12R1.121 C=CCNc1ccccc1C#N 34a_100000211148_100015514636 [0,2,0,0,0,0|1,0,0]=3 6083 B12R1.121 C=CCNc1ccccc1C=C 34a_100012022501_100015514636 [0,2,0,0,0,0|1,0,0]=3 6084 B12R1.121 C=CCNc1ccccc1CC 2230a_100000212081_100000210623 [0,2,0,0,0,0|1,0,0]=3 6085 B12R1.121 C=CCNc1ccccc1CC 34a_100000212081_100015514636 [0,2,0,0,0,0|1,0,0]=3 6086 B12R1.121 C=CCNc1ccccc1CC 7a_100000212081_100015514636 [0,2,0,0,0,0|1,0,0]=3 6087 B12R1.121 C=CCNc1ccccc1CO 34a_100000212039_100015514636 [0,2,0,0,0,0|0,0,0]=2 6088 B12R1.121 C=CCNc1ccccc1OC 34a_100000210025_100015514636 [0,2,0,0,0,0|0,0,0]=2 6089 B12R1.121 C=CCNc1ccccc1SC 34a_100000211160_100015514636 [0,2,0,0,0,0|0,1,0]=3 6090 B12R1.121 C=CCNc1ccncc1C#N 27a_100020586998_100000687039 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.121 C=CCNc1ccncc1CO 27a_100020586998_100000117392 [0,2,0,0,0,0|1,0,0]=3 6092 B12R1.121 C=CCNc1cnccc1C#N 27a_100020586998_100000684818 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.121 C=CCNc1ncccc1C#N 27a_100020586998_100000211984 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.121 C=CCNc1nccnc1OC 27a_100020586998_100009858322 [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.121 C=CCNc1ncncc1OC 27a_100020586998_100012001275 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.121 C=CCOc1ccccc1C#N 34a_100000211048_100015514636 [0,2,0,0,0,0|1,0,0]=3 6097 B12R1.121 C=CCOc1ccccc1C#N 7a_100000211048_100015514636 [0,2,0,0,0,0|1,0,0]=3 6098 B12R1.121 C=CCOc1ccccc1CC 34a_100000210936_100015514636 [0,2,0,0,0,0|1,0,0]=3 6099 B12R1.121 C=CCOc1ccccc1CC 7a_100000210936_100015514636 [0,2,0,0,0,0|1,0,0]=3 6100 B12R1.121 C=CCOc1ccccc1CN 34a_100000185550_100015514636 [0,2,0,0,0,0|1,0,0]=3 6101 B12R1.121 C=CCOc1ccccc1CO 34a_100011216872_100015514636 [0,2,0,0,0,0|0,0,0]=2 6102 B12R1.121 C=CCOc1ccccc1NC 34a_100000033821_100015514636 [0,2,0,0,0,0|1,0,0]=3 6103 B12R1.121 C=CCOc1ccccc1OC 34a_100000210385_100015514636 [0,2,0,0,0,0|0,0,0]=2 6104 B12R1.121 C=CCOc1ccccc1OC 34a_200011262142_200000210301 [0,2,0,0,0,0|0,0,0]=2 6105 B12R1.121 C=CCOc1ccccc1OC 7a_200011262142_200000210301 [0,2,0,0,0,0|0,0,0]=2 6106 B12R1.121 C=CCOc1ccccc1O[13CH3] 34a_200011262142_200025704644 [0,2,0,0,0,0|0,0,0]=2 6107 B12R1.121 C=CCOc1ccccc1O[13CH3] 7a_200011262142_200025704644 [0,2,0,0,0,0|0,0,0]=2 6108 B12R1.121 C=CCOc1ccccc1SC 34a_100011216402_100015514636 [0,2,0,0,0,0|0,1,0]=3 6109 B12R1.121 C=CCOc1cccnc1C#N 34a_100000722750_100015514636 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.121 C=CCOc1cccnc1C#N 7a_100000722750_100015514636 [0,2,0,0,0,0|2,0,0]=4 6111 B12R1.121 C=CCOc1cccnc1CBr 34a_200020655725_100015514636 [0,2,0,0,0,0|2,0,0]=4 6112 B12R1.121 C=CCOc1cccnc1CBr 7a_200020655725_100015514636 [0,2,0,0,0,0|2,0,0]=4 6113 B12R1.121 C=CCOc1cccnc1CO 34a_100000731849_100015514636 [0,2,0,0,0,0|1,0,0]=3 6114 B12R1.121 C=CCOc1cccnc1OC 34a_100000698397_100015514636 [0,2,0,0,0,0|1,0,0]=3 6115 B12R1.121 C=CCOc1cccnc1OC 7a_100000698397_100015514636 [0,2,0,0,0,0|1,0,0]=3 6116 B12R1.121 C=CCOc1cnccc1C#N 7a_100012181322_100015514636 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.121 C=CCOc1cnccc1CO 34a_100000078615_100015514636 [0,2,0,0,0,0|1,0,0]=3 6118 B12R1.121 C=CCOc1cnccc1OC 34a_100000101186_100015514636 [0,2,0,0,0,0|1,0,0]=3 6119 B12R1.121 C=CCOc1ncccc1OC 34a_100025773188_100015514636 [0,2,0,0,0,0|1,0,0]=3 6120 B12R1.121 C=CCSc1ccccc1C#N 62a_100000210623_100000188569 [0,2,0,0,0,0|1,0,0]=3 6121 B12R1.121 C=CCSc1ccccc1C=C 62a_100000210623_100011218376 [0,2,0,0,0,0|1,0,0]=3 6122 B12R1.121 C=CCSc1ccccc1C=C 62a_100011218376_100000210623 [0,2,0,0,0,0|1,0,0]=3 6123 B12R1.121 C=CCSc1ccccc1C=O 62a_100000210073_100000210623 [0,2,0,0,0,0|0,0,1]=3 6124 B12R1.121 C=CCSc1ccccc1C=O 62a_100000210623_100000210073 [0,2,0,0,0,0|0,0,1]=3 6125 B12R1.121 C=CCSc1ccccc1CC 62a_100000210623_100011215823 [0,2,0,0,0,0|1,0,0]=3 6126 B12R1.121 C=CCSc1ccccc1CC 62a_100011215823_100000210623 [0,2,0,0,0,0|1,0,0]=3 6127 B12R1.121 C=CCSc1ccccc1CN 62a_100000210623_100000689332 [0,2,0,0,0,0|1,0,0]=3 6128 B12R1.121 C=CCSc1ccccc1CN 62a_100000689332_100000210623 [0,2,0,0,0,0|1,0,0]=3 6129 B12R1.121 C=CCSc1ccccc1CO 62a_100000187465_100000210623 [0,2,0,0,0,0|0,0,0]=2 6130 B12R1.121 C=CCSc1ccccc1CO 62a_100000210623_100000187465 [0,2,0,0,0,0|0,0,0]=2 6131 B12R1.121 C=CCSc1ccccc1NC 2230a_100000198565_200000210301 [0,2,0,0,0,0|1,0,0]=3 6132 B12R1.121 C=CCSc1ccccc1NC 62a_100000210623_100020606079 [0,2,0,0,0,0|1,0,0]=3 6133 B12R1.121 C=CCSc1ccccc1NC 62a_100020606079_100000210623 [0,2,0,0,0,0|1,0,0]=3 6134 B12R1.121 C=CCSc1ccccc1NC 7a_100000198565_200000210301 [0,2,0,0,0,0|1,0,0]=3 6135 B12R1.121 C=CCSc1ccccc1NN 62a_100000210623_100000241748 [0,2,0,0,0,0|1,0,0]=3 6136 B12R1.121 C=CCSc1ccccc1NN 62a_100000241748_100000210623 [0,2,0,0,0,0|1,0,0]=3 6137 B12R1.121 C=CCSc1ccccc1N[13CH3] 2230a_100000198565_200025704644 [0,2,0,0,0,0|1,0,0]=3 6138 B12R1.121 C=CCSc1ccccc1N[13CH3] 7a_100000198565_200025704644 [0,2,0,0,0,0|1,0,0]=3 6139 B12R1.121 C=CCSc1ccccc1OC 62a_100000210334_100000210623 [0,2,0,0,0,0|0,0,0]=2 6140 B12R1.121 C=CCSc1ccccc1OC 62a_100000210623_100000210334 [0,2,0,0,0,0|0,0,0]=2 6141 B12R1.121 C=CCSc1ccccc1SC 62a_100000210623_100011217816 [0,2,0,0,0,0|0,1,0]=3 6142 B12R1.121 C=CCSc1ccccc1SC 62a_100011217816_100000210623 [0,2,0,0,0,0|0,1,0]=3 6143 B12R1.121 C=CCSc1cccnc1C#N 62a_100000210623_100000685805 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.121 C=CCSc1cccnc1C=O 62a_100000210623_100011934733 [0,2,0,0,0,0|1,0,1]=4 6145 B12R1.121 C=CCSc1cccnc1C=O 62a_100011934733_100000210623 [0,2,0,0,0,0|1,0,1]=4 6146 B12R1.121 C=CCSc1cccnc1CC 62a_100000210623_100009877225 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.121 C=CCSc1cccnc1CC 62a_100009877225_100000210623 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.121 C=CCSc1cccnc1CN 62a_100000210623_100020591323 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.121 C=CCSc1cccnc1CN 62a_100020591323_100000210623 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.121 C=CCSc1cccnc1CO 62a_100000210623_100011996772 [0,2,0,0,0,0|1,0,0]=3 6151 B12R1.121 C=CCSc1cccnc1CO 62a_100011996772_100000210623 [0,2,0,0,0,0|1,0,0]=3 6152 B12R1.121 C=CCSc1cccnc1NC 62a_100000210623_100000700899 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.121 C=CCSc1cccnc1NC 62a_100000700899_100000210623 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.121 C=CCSc1cccnc1NN 62a_100000210623_100011464834 [0,2,0,0,0,0|2,0,0]=4 6155 B12R1.121 C=CCSc1cccnc1NN 62a_100011464834_100000210623 [0,2,0,0,0,0|2,0,0]=4 6156 B12R1.121 C=CCSc1cccnc1OC 62a_100000047025_100000210623 [0,2,0,0,0,0|1,0,0]=3 6157 B12R1.121 C=CCSc1cccnc1OC 62a_100000210623_100000047025 [0,2,0,0,0,0|1,0,0]=3 6158 B12R1.121 C=CCSc1cccnc1SC 62a_100000210623_100011465278 [0,2,0,0,0,0|1,1,0]=4 6159 B12R1.121 C=CCSc1cccnc1SC 62a_100011465278_100000210623 [0,2,0,0,0,0|1,1,0]=4 6160 B12R1.121 C=CCSc1ccncc1C#N 62a_100000210623_100000687039 [0,2,0,0,0,0|2,0,0]=4 6161 B12R1.121 C=CCSc1ccncc1C=O 62a_100000050567_100000210623 [0,2,0,0,0,0|1,0,1]=4 6162 B12R1.121 C=CCSc1ccncc1C=O 62a_100000210623_100000050567 [0,2,0,0,0,0|1,0,1]=4 6163 B12R1.121 C=CCSc1ccncc1CC 62a_100000210623_100025704421 [0,2,0,0,0,0|2,0,0]=4 6164 B12R1.121 C=CCSc1ccncc1CC 62a_100025704421_100000210623 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.121 C=CCSc1ccncc1CO 62a_100000117392_100000210623 [0,2,0,0,0,0|1,0,0]=3 6166 B12R1.121 C=CCSc1ccncc1CO 62a_100000210623_100000117392 [0,2,0,0,0,0|1,0,0]=3 6167 B12R1.121 C=CCSc1ccncc1OC 62a_100000210623_100016988167 [0,2,0,0,0,0|1,0,0]=3 6168 B12R1.121 C=CCSc1ccncc1OC 62a_100016988167_100000210623 [0,2,0,0,0,0|1,0,0]=3 6169 B12R1.121 C=CCSc1cnccc1C#N 62a_100000210623_100000684818 [0,2,0,0,0,0|2,0,0]=4 6170 B12R1.121 C=CCSc1cnccc1C=O 62a_100000210623_100011934409 [0,2,0,0,0,0|1,0,1]=4 6171 B12R1.121 C=CCSc1cnccc1C=O 62a_100011934409_100000210623 [0,2,0,0,0,0|1,0,1]=4 6172 B12R1.121 C=CCSc1cnccc1CC 62a_100000210623_100009819861 [0,2,0,0,0,0|2,0,0]=4 6173 B12R1.121 C=CCSc1cnccc1CC 62a_100009819861_100000210623 [0,2,0,0,0,0|2,0,0]=4 6174 B12R1.121 C=CCSc1cnccc1CN 62a_100000210623_100020640021 [0,2,0,0,0,0|2,0,0]=4 6175 B12R1.121 C=CCSc1cnccc1CN 62a_100020640021_100000210623 [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.121 C=CCSc1cnccc1CO 62a_100000210623_100009873359 [0,2,0,0,0,0|1,0,0]=3 6177 B12R1.121 C=CCSc1cnccc1CO 62a_100009873359_100000210623 [0,2,0,0,0,0|1,0,0]=3 6178 B12R1.121 C=CCSc1cnccc1NC 62a_100000210623_100010069531 [0,2,0,0,0,0|2,0,0]=4 6179 B12R1.121 C=CCSc1cnccc1NC 62a_100010069531_100000210623 [0,2,0,0,0,0|2,0,0]=4 6180 B12R1.121 C=CCSc1cnccc1NN 62a_100000210623_100013404636 [0,2,0,0,0,0|2,0,0]=4 6181 B12R1.121 C=CCSc1cnccc1NN 62a_100013404636_100000210623 [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.121 C=CCSc1cnccc1OC 62a_100000210623_100011997281 [0,2,0,0,0,0|1,0,0]=3 6183 B12R1.121 C=CCSc1cnccc1OC 62a_100011997281_100000210623 [0,2,0,0,0,0|1,0,0]=3 6184 B12R1.121 C=CCSc1cncnc1OC 62a_100000210623_100000719902 [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.121 C=CCSc1cncnc1OC 62a_100000719902_100000210623 [0,2,0,0,0,0|2,0,0]=4 6186 B12R1.121 C=CCSc1ncccc1C#N 62a_100000210623_100000211984 [0,2,0,0,0,0|2,0,0]=4 6187 B12R1.121 C=CCSc1ncccc1C=O 62a_100000210623_100009816751 [0,2,0,0,0,0|1,0,1]=4 6188 B12R1.121 C=CCSc1ncccc1C=O 62a_100009816751_100000210623 [0,2,0,0,0,0|1,0,1]=4 6189 B12R1.121 C=CCSc1ncccc1CN 62a_100000210623_100015189234 [0,2,0,0,0,0|2,0,0]=4 6190 B12R1.121 C=CCSc1ncccc1CN 62a_100015189234_100000210623 [0,2,0,0,0,0|2,0,0]=4 6191 B12R1.121 C=CCSc1ncccc1CO 62a_100000210623_100000748726 [0,2,0,0,0,0|1,0,0]=3 6192 B12R1.121 C=CCSc1ncccc1CO 62a_100000748726_100000210623 [0,2,0,0,0,0|1,0,0]=3 6193 B12R1.121 C=CCSc1ncccc1NC 62a_100000210623_200011806188 [0,2,0,0,0,0|2,0,0]=4 6194 B12R1.121 C=CCSc1ncccc1OC 62a_100000210623_100000690851 [0,2,0,0,0,0|1,0,0]=3 6195 B12R1.121 C=CCSc1ncccc1OC 62a_100000767102_100000210623 [0,2,0,0,0,0|1,0,0]=3 6196 B12R1.121 C=CCSc1nccnc1CO 62a_100000057004_100000210623 [0,2,0,0,0,0|2,0,0]=4 6197 B12R1.121 C=CCSc1nccnc1CO 62a_100000210623_100000057004 [0,2,0,0,0,0|2,0,0]=4 6198 B12R1.121 C=CCSc1nccnc1OC 62a_100000210623_100000749998 [0,2,0,0,0,0|2,0,0]=4 6199 B12R1.121 C=CCSc1nccnc1OC 62a_100009858322_100000210623 [0,2,0,0,0,0|2,0,0]=4 6200 B12R1.121 C=CCSc1ncncc1OC 62a_100000210623_100012001275 [0,2,0,0,0,0|2,0,0]=4 6201 B12R1.121 C=CCSc1ncncc1OC 62a_100012001275_100000210623 [0,2,0,0,0,0|2,0,0]=4 6202 B12R1.121 C=Cc1ccccc1CCC=O 271570a_100011290941_100011713448 [0,2,0,0,0,0|1,0,1]=4 6203 B12R1.121 C=Cc1ccccc1NCC=O 34a_100012022501_200009817547 [0,2,0,0,0,0|2,0,0]=4 6204 B12R1.121 C=Cc1ccccc1SCC=O 62a_100011218376_200015260668 [0,2,0,0,0,0|2,0,0]=4 6205 B12R1.121 C=Cc1ccccc1SCC=O 62a_200015260668_100011218376 [0,2,0,0,0,0|2,0,0]=4 6206 B12R1.121 CC=NNc1ccccc1OC 4a_100000751209_200000210099 [0,2,0,0,0,0|1,0,1]=4 6207 B12R1.121 CCCCc1ccccc1CO 271570a_100020621405_100000187465 [0,2,0,0,0,0|0,0,2]=4 6208 B12R1.121 CCCCc1ccccc1OC 271570a_100020621405_100000174000 [0,2,0,0,0,0|0,0,2]=4 6209 B12R1.121 CCCNc1ccccc1CO 34a_100000212039_100000210303 [0,2,0,0,0,0|0,0,2]=4 6210 B12R1.121 CCCNc1ccccc1OC 34a_100000210025_100000210303 [0,2,0,0,0,0|0,0,2]=4 6211 B12R1.121 CCCOc1ccccc1CO 34a_100011216872_100000210303 [0,2,0,0,0,0|0,0,2]=4 6212 B12R1.121 CCCOc1ccccc1OC 34a_100000180214_200000210301 [0,2,0,0,0,0|0,0,2]=4 6213 B12R1.121 CCCOc1ccccc1OC 34a_100000210385_100000210303 [0,2,0,0,0,0|0,0,2]=4 6214 B12R1.121 CCCOc1ccccc1OC 7a_100000180214_200000210301 [0,2,0,0,0,0|0,0,2]=4 6215 B12R1.121 CCCOc1ccccc1O[13CH3] 34a_100000180214_200025704644 [0,2,0,0,0,0|0,0,2]=4 6216 B12R1.121 CCCOc1ccccc1O[13CH3] 7a_100000180214_200025704644 [0,2,0,0,0,0|0,0,2]=4 6217 B12R1.121 CCCSc1ccccc1CO 62a_100000187465_100000210303 [0,2,0,0,0,0|0,0,2]=4 6218 B12R1.121 CCCSc1ccccc1CO 62a_100000210303_100000187465 [0,2,0,0,0,0|0,0,2]=4 6219 B12R1.121 CCCSc1ccccc1OC 62a_100000210303_100000210334 [0,2,0,0,0,0|0,0,2]=4 6220 B12R1.121 CCCSc1ccccc1OC 62a_100000210334_100000210303 [0,2,0,0,0,0|0,0,2]=4 6221 B12R1.121 CCNCc1ccccc1CO 2230a_100015525214_100009816955 [0,2,0,0,0,0|0,0,2]=4 6222 B12R1.121 CCNCc1ccccc1OC 207a_100015525214_100000169842 [0,2,0,0,0,0|0,0,2]=4 6223 B12R1.121 CCNCc1ccccc1OC 2230a_100015525214_100000210004 [0,2,0,0,0,0|0,0,2]=4 6224 B12R1.121 CCNCc1ccccc1OC 270004a_100015525214_100000169842 [0,2,0,0,0,0|0,0,2]=4 6225 B12R1.121 CCNCc1ccccc1OC 34a_100000188900_100000210202 [0,2,0,0,0,0|0,0,2]=4 6226 B12R1.121 CCOCc1ccccc1CO 34a_100121572206_100009816955 [0,2,0,0,0,0|0,0,2]=4 6227 B12R1.121 CCOCc1ccccc1OC 34a_100000211301_100000210202 [0,2,0,0,0,0|0,0,2]=4 6228 B12R1.121 CCOCc1ccccc1OC 34a_100121572206_100000210004 [0,2,0,0,0,0|0,0,2]=4 6229 B12R1.121 CCSCc1ccccc1CO 62a_100000210202_100009816955 [0,2,0,0,0,0|0,0,2]=4 6230 B12R1.121 CCSCc1ccccc1CO 62a_100009816955_100000210202 [0,2,0,0,0,0|0,0,2]=4 6231 B12R1.121 CCSCc1ccccc1OC 62a_100000210004_100000210202 [0,2,0,0,0,0|0,0,2]=4 6232 B12R1.121 CCSCc1ccccc1OC 62a_100000210202_100000210004 [0,2,0,0,0,0|0,0,2]=4 6233 B12R1.121 CCc1ccccc1NCC=O 2230a_100000212081_200015260668 [0,2,0,0,0,0|2,0,0]=4 6234 B12R1.121 CCc1ccccc1NCC=O 34a_100000212081_200009817547 [0,2,0,0,0,0|2,0,0]=4 6235 B12R1.121 CCc1ccccc1NCC=O 7a_100000212081_200015260668 [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.121 CCc1ccccc1OCC=O 34a_100000210936_200009817547 [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.121 CCc1ccccc1OCC=O 7a_100000210936_200015260668 [0,2,0,0,0,0|2,0,0]=4 6238 B12R1.121 CCc1ccccc1SCC=O 62a_100011215823_200015260668 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.121 CCc1ccccc1SCC=O 62a_200015260668_100011215823 [0,2,0,0,0,0|2,0,0]=4 6240 B12R1.121 CNCCc1ccccc1OC 2230a_100000211851_200000210301 [0,2,0,0,0,0|0,0,2]=4 6241 B12R1.121 CNCCc1ccccc1OC 2230a_106832991635_100011713687 [0,2,0,0,0,0|0,0,2]=4 6242 B12R1.121 CNCCc1ccccc1OC 270004a_106832991635_100011713418 [0,2,0,0,0,0|0,0,2]=4 6243 B12R1.121 CNCCc1ccccc1OC 34a_100000211851_200000210301 [0,2,0,0,0,0|0,0,2]=4 6244 B12R1.121 CNCCc1ccccc1OC 34a_100102657272_100011713687 [0,2,0,0,0,0|0,0,2]=4 6245 B12R1.121 CNCCc1ccccc1OC 7a_106832991635_100011713687 [0,2,0,0,0,0|0,0,2]=4 6246 B12R1.121 CNc1ccccc1OCC=O 34a_100000033821_200009817547 [0,2,0,0,0,0|2,0,0]=4 6247 B12R1.121 CNc1ccccc1SCC=O 62a_100020606079_200015260668 [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.121 CNc1ccccc1SCC=O 62a_200015260668_100020606079 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.121 COCCc1ccccc1OC 34a_100000722730_200000210301 [0,2,0,0,0,0|0,0,2]=4 6250 B12R1.121 COCCc1ccccc1OC 34a_100011218620_200000210301 [0,2,0,0,0,0|0,0,2]=4 6251 B12R1.121 COCCc1ccccc1OC 34a_100138415774_100011713687 [0,2,0,0,0,0|0,0,2]=4 6252 B12R1.121 COCCc1ccccc1OC 7a_100000722730_200000210301 [0,2,0,0,0,0|0,0,2]=4 6253 B12R1.121 COCCc1ccccc1OC 7a_100011218620_200000210301 [0,2,0,0,0,0|0,0,2]=4 6254 B12R1.121 COCCc1ccccc1O[13CH3] 34a_100000722730_200025704644 [0,2,0,0,0,0|0,0,2]=4 6255 B12R1.121 COCCc1ccccc1O[13CH3] 7a_100000722730_200025704644 [0,2,0,0,0,0|0,0,2]=4 6256 B12R1.121 COCSc1ccccc1CO 62a_100000187465_100000766300 [0,2,0,0,0,0|1,0,1]=4 6257 B12R1.121 COCSc1ccccc1CO 62a_100000766300_100000187465 [0,2,0,0,0,0|1,0,1]=4 6258 B12R1.121 COCSc1ccccc1OC 62a_100000210334_100000766300 [0,2,0,0,0,0|1,0,1]=4 6259 B12R1.121 COCSc1ccccc1OC 62a_100000766300_100000210334 [0,2,0,0,0,0|1,0,1]=4 6260 B12R1.121 COc1ccccc1CCN[13CH3] 2230a_100000211851_200025704644 [0,2,0,0,0,0|0,0,2]=4 6261 B12R1.121 COc1ccccc1CCN[13CH3] 34a_100000211851_200025704644 [0,2,0,0,0,0|0,0,2]=4 6262 B12R1.121 COc1ccccc1CCO[13CH3] 34a_100011218620_200025704644 [0,2,0,0,0,0|0,0,2]=4 6263 B12R1.121 COc1ccccc1CCO[13CH3] 7a_100011218620_200025704644 [0,2,0,0,0,0|0,0,2]=4 6264 B12R1.121 COc1ccccc1CCSC 62a_100011713687_200000210301 [0,2,0,0,0,0|0,0,2]=4 6265 B12R1.121 COc1ccccc1CCSC 62a_200000210301_100011713687 [0,2,0,0,0,0|0,0,2]=4 6266 B12R1.121 COc1ccccc1CCS[13CH3] 62a_100011713687_200025704644 [0,2,0,0,0,0|0,0,2]=4 6267 B12R1.121 COc1ccccc1CCS[13CH3] 62a_200025704644_100011713687 [0,2,0,0,0,0|0,0,2]=4 6268 B12R1.121 COc1ccccc1CNCF 34a_100000188900_100015361967 [0,2,0,0,0,0|1,0,1]=4 6269 B12R1.121 COc1ccccc1COCF 34a_100000211301_100015361967 [0,2,0,0,0,0|1,0,1]=4 6270 B12R1.121 COc1ccccc1CSCF 62a_100000210004_100015361967 [0,2,0,0,0,0|1,0,1]=4 6271 B12R1.121 COc1ccccc1CSCF 62a_100015361967_100000210004 [0,2,0,0,0,0|1,0,1]=4 6272 B12R1.121 COc1ccccc1NCC=O 34a_100000210025_200009817547 [0,2,0,0,0,0|1,0,0]=3 6273 B12R1.121 COc1ccccc1NCCF 34a_100000210025_100011217306 [0,2,0,0,0,0|1,0,1]=4 6274 B12R1.121 COc1ccccc1NCCO 34a_100000210025_100000211926 [0,2,0,0,0,0|1,0,1]=4 6275 B12R1.121 COc1ccccc1NCSC 34a_100000210025_100011218213 [0,2,0,0,0,0|1,0,1]=4 6276 B12R1.121 COc1ccccc1OCC=O 34a_100000210385_200009817547 [0,2,0,0,0,0|1,0,0]=3 6277 B12R1.121 COc1ccccc1OCCF 34a_100000210385_100011217306 [0,2,0,0,0,0|1,0,1]=4 6278 B12R1.121 COc1ccccc1OCCO 34a_100000181789_200000210301 [0,2,0,0,0,0|1,0,1]=4 6279 B12R1.121 COc1ccccc1OCCO 34a_100000210385_100000211926 [0,2,0,0,0,0|1,0,1]=4 6280 B12R1.121 COc1ccccc1OCCO 7a_100000181789_200000210301 [0,2,0,0,0,0|1,0,1]=4 6281 B12R1.121 COc1ccccc1OCSC 34a_100000210385_100011218213 [0,2,0,0,0,0|1,0,1]=4 6282 B12R1.121 COc1ccccc1SCC#N 62a_100000210334_100011215382 [0,2,0,0,0,0|1,0,1]=4 6283 B12R1.121 COc1ccccc1SCC#N 62a_100011215382_100000210334 [0,2,0,0,0,0|1,0,1]=4 6284 B12R1.121 COc1ccccc1SCC=O 62a_100000210334_200015260668 [0,2,0,0,0,0|1,0,0]=3 6285 B12R1.121 COc1ccccc1SCC=O 62a_200015260668_100000210334 [0,2,0,0,0,0|1,0,0]=3 6286 B12R1.121 COc1ccccc1SCCF 62a_100000210334_100011217306 [0,2,0,0,0,0|1,0,1]=4 6287 B12R1.121 COc1ccccc1SCCF 62a_100011217306_100000210334 [0,2,0,0,0,0|1,0,1]=4 6288 B12R1.121 COc1ccccc1SCCO 62a_100000210334_100000211926 [0,2,0,0,0,0|1,0,1]=4 6289 B12R1.121 COc1ccccc1SCCO 62a_100000211926_100000210334 [0,2,0,0,0,0|1,0,1]=4 6290 B12R1.121 COc1ccccc1SCSC 62a_100000210334_100011218213 [0,2,0,0,0,0|1,0,1]=4 6291 B12R1.121 COc1ccccc1SCSC 62a_100011218213_100000210334 [0,2,0,0,0,0|1,0,1]=4 6292 B12R1.121 COc1cccnc1OCC=O 34a_100025773188_200009817547 [0,2,0,0,0,0|2,0,0]=4 6293 B12R1.121 COc1cccnc1SCC=O 62a_100000767102_200015260668 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.121 COc1cccnc1SCC=O 62a_200015260668_100000690851 [0,2,0,0,0,0|2,0,0]=4 6295 B12R1.121 COc1ccncc1OCC=O 34a_100000101186_200009817547 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.121 COc1ccncc1SCC=O 62a_100011997281_200015260668 [0,2,0,0,0,0|2,0,0]=4 6297 B12R1.121 COc1ccncc1SCC=O 62a_200015260668_100011997281 [0,2,0,0,0,0|2,0,0]=4 6298 B12R1.121 COc1cnccc1SCC=O 62a_100016988167_200015260668 [0,2,0,0,0,0|2,0,0]=4 6299 B12R1.121 COc1cnccc1SCC=O 62a_200015260668_100016988167 [0,2,0,0,0,0|2,0,0]=4 6300 B12R1.121 COc1ncccc1OCC=O 34a_100000698397_200009817547 [0,2,0,0,0,0|2,0,0]=4 6301 B12R1.121 COc1ncccc1OCC=O 7a_100000698397_200015260668 [0,2,0,0,0,0|2,0,0]=4 6302 B12R1.121 COc1ncccc1SCC=O 62a_100000047025_200015260668 [0,2,0,0,0,0|2,0,0]=4 6303 B12R1.121 COc1ncccc1SCC=O 62a_200015260668_100000047025 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.121 CSCNc1ccccc1CO 34a_100000212039_100011218213 [0,2,0,0,0,0|1,0,1]=4 6305 B12R1.121 CSCOc1ccccc1CO 34a_100011216872_100011218213 [0,2,0,0,0,0|1,0,1]=4 6306 B12R1.121 CSCSc1ccccc1CO 62a_100000187465_100011218213 [0,2,0,0,0,0|1,0,1]=4 6307 B12R1.121 CSCSc1ccccc1CO 62a_100011218213_100000187465 [0,2,0,0,0,0|1,0,1]=4 6308 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200000210301_200016268969 [0,2,0,0,0,0|0,1,1]=4 6309 B12R1.121 CSc1ccccc1/C=C/C=O 62a_200016268969_200000210301 [0,2,0,0,0,0|0,1,1]=4 6310 B12R1.121 CSc1ccccc1CCC=O 62a_100011713448_200000210301 [0,2,0,0,0,0|0,1,1]=4 6311 B12R1.121 CSc1ccccc1CCC=O 62a_200000210301_100011713448 [0,2,0,0,0,0|0,1,1]=4 6312 B12R1.121 CSc1ccccc1NCC=O 34a_100000211160_200009817547 [0,2,0,0,0,0|1,1,0]=4 6313 B12R1.121 CSc1ccccc1OCC=O 34a_100011216402_200009817547 [0,2,0,0,0,0|1,1,0]=4 6314 B12R1.121 CSc1ccccc1SCC=O 62a_100011217816_200015260668 [0,2,0,0,0,0|1,1,0]=4 6315 B12R1.121 CSc1ccccc1SCC=O 62a_200015260668_100011217816 [0,2,0,0,0,0|1,1,0]=4 6316 B12R1.121 N#CCSc1ccccc1CO 62a_100000187465_100011215382 [0,2,0,0,0,0|1,0,1]=4 6317 B12R1.121 N#CCSc1ccccc1CO 62a_100011215382_100000187465 [0,2,0,0,0,0|1,0,1]=4 6318 B12R1.121 N#Cc1ccccc1NCC=O 34a_100000211148_200009817547 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.121 N#Cc1ccccc1OCC=O 34a_100000211048_200009817547 [0,2,0,0,0,0|2,0,0]=4 6320 B12R1.121 N#Cc1ccccc1OCC=O 7a_100000211048_200015260668 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.121 N#Cc1ccccc1SCC=O 62a_200015260668_100000188569 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.121 NCc1ccccc1OCC=O 34a_100000185550_200009817547 [0,2,0,0,0,0|2,0,0]=4 6323 B12R1.121 NCc1ccccc1SCC=O 62a_100000689332_200015260668 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.121 NCc1ccccc1SCC=O 62a_200015260668_100000689332 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.121 NNc1ccccc1SCC=O 62a_100000241748_200015260668 [0,2,0,0,0,0|2,0,0]=4 6326 B12R1.121 NNc1ccccc1SCC=O 62a_200015260668_100000241748 [0,2,0,0,0,0|2,0,0]=4 6327 B12R1.121 O=CCNc1ccccc1CO 34a_100000212039_200009817547 [0,2,0,0,0,0|1,0,0]=3 6328 B12R1.121 O=CCOc1ccccc1CO 34a_100011216872_200009817547 [0,2,0,0,0,0|1,0,0]=3 6329 B12R1.121 O=CCOc1cccnc1CO 34a_100000731849_200009817547 [0,2,0,0,0,0|2,0,0]=4 6330 B12R1.121 O=CCOc1cnccc1CO 34a_100000078615_200009817547 [0,2,0,0,0,0|2,0,0]=4 6331 B12R1.121 O=CCSc1ccccc1C=O 62a_100000210073_200015260668 [0,2,0,0,0,0|1,0,1]=4 6332 B12R1.121 O=CCSc1ccccc1C=O 62a_200015260668_100000210073 [0,2,0,0,0,0|1,0,1]=4 6333 B12R1.121 O=CCSc1ccccc1CO 62a_100000187465_200015260668 [0,2,0,0,0,0|1,0,0]=3 6334 B12R1.121 O=CCSc1ccccc1CO 62a_200015260668_100000187465 [0,2,0,0,0,0|1,0,0]=3 6335 B12R1.121 O=CCSc1cccnc1CO 62a_100011996772_200015260668 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.121 O=CCSc1cccnc1CO 62a_200015260668_100011996772 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.121 O=CCSc1ccncc1CO 62a_100000117392_200015260668 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.121 O=CCSc1ccncc1CO 62a_200015260668_100000117392 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.121 O=CCSc1cnccc1CO 62a_100009873359_200015260668 [0,2,0,0,0,0|2,0,0]=4 6340 B12R1.121 O=CCSc1cnccc1CO 62a_200015260668_100009873359 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.121 O=CCSc1ncccc1CO 62a_100000748726_200015260668 [0,2,0,0,0,0|2,0,0]=4 6342 B12R1.121 O=CCSc1ncccc1CO 62a_200015260668_100000748726 [0,2,0,0,0,0|2,0,0]=4 6343 B12R1.121 OCCNc1ccccc1CO 34a_100000212039_100000211926 [0,2,0,0,0,0|1,0,1]=4 6344 B12R1.121 OCCOc1ccccc1CO 34a_100011216872_100000211926 [0,2,0,0,0,0|1,0,1]=4 6345 B12R1.121 OCCSc1ccccc1CO 62a_100000187465_100000211926 [0,2,0,0,0,0|1,0,1]=4 6346 B12R1.121 OCCSc1ccccc1CO 62a_100000211926_100000187465 [0,2,0,0,0,0|1,0,1]=4 6347 B12R1.121 OCc1ccccc1CSCF 62a_100009816955_100015361967 [0,2,0,0,0,0|1,0,1]=4 6348 B12R1.121 OCc1ccccc1CSCF 62a_100015361967_100009816955 [0,2,0,0,0,0|1,0,1]=4 6349 B12R1.121 OCc1ccccc1NCCF 34a_100000212039_100011217306 [0,2,0,0,0,0|1,0,1]=4 6350 B12R1.121 OCc1ccccc1OCCF 34a_100011216872_100011217306 [0,2,0,0,0,0|1,0,1]=4 6351 B12R1.121 OCc1ccccc1SCCF 62a_100000187465_100011217306 [0,2,0,0,0,0|1,0,1]=4 6352 B12R1.121 OCc1ccccc1SCCF 62a_100011217306_100000187465 [0,2,0,0,0,0|1,0,1]=4 6353 B12R1.121 [13CH3]Oc1ccccc1OCCO 34a_100000181789_200025704644 [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.121 [13CH3]Oc1ccccc1OCCO 7a_100000181789_200025704644 [0,2,0,0,0,0|1,0,1]=4 6355 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200016268969_200025704644 [0,2,0,0,0,0|0,1,1]=4 6356 B12R1.121 [13CH3]Sc1ccccc1/C=C/C=O 62a_200025704644_200016268969 [0,2,0,0,0,0|0,1,1]=4 6357 B12R1.121 [13CH3]Sc1ccccc1CCC=O 62a_100011713448_200025704644 [0,2,0,0,0,0|0,1,1]=4 6358 B12R1.121 [13CH3]Sc1ccccc1CCC=O 62a_200025704644_100011713448 [0,2,0,0,0,0|0,1,1]=4 6359 B12R1.125 C=C(C)CNc1ccccc1Br 34a_100000210017_100000748629 [0,2,0,0,0,0|1,0,0]=3 6360 B12R1.125 C=C(C)CNc1ccccc1C 34a_100015192222_100000748629 [0,2,0,0,0,0|1,0,0]=3 6361 B12R1.125 C=C(C)CNc1ccccc1Cl 34a_100000185783_100000748629 [0,2,0,0,0,0|1,0,0]=3 6362 B12R1.125 C=C(C)CNc1ccccc1F 34a_100000210422_100000748629 [0,2,0,0,0,0|1,0,0]=3 6363 B12R1.125 C=C(C)CNc1ccccc1I 34a_100000210053_100000748629 [0,2,0,0,0,0|1,0,0]=3 6364 B12R1.125 C=C(C)CNc1ccccc1O 34a_100000185747_100000748629 [0,2,0,0,0,0|0,0,0]=2 6365 B12R1.125 C=C(C)CNc1ccncc1Br 27a_100000765925_100000726257 [0,2,0,0,0,0|2,0,0]=4 6366 B12R1.125 C=C(C)CNc1ccncc1C 27a_100000765925_100000765111 [0,2,0,0,0,0|2,0,0]=4 6367 B12R1.125 C=C(C)CNc1ccncc1F 27a_100000765925_100000035921 [0,2,0,0,0,0|2,0,0]=4 6368 B12R1.125 C=C(C)CNc1ncccc1Br 27a_100000765925_100000696092 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.125 C=C(C)COc1cccc[n+]1[O-] 7a_100000211761_100000748629 [0,2,0,0,0,0|1,0,1]=4 6370 B12R1.125 C=C(C)COc1ccccc1Br 34a_100000181306_100000748629 [0,2,0,0,0,0|1,0,0]=3 6371 B12R1.125 C=C(C)COc1ccccc1Br 7a_100000181306_100000748629 [0,2,0,0,0,0|1,0,0]=3 6372 B12R1.125 C=C(C)COc1ccccc1C 34a_100000210338_100000748629 [0,2,0,0,0,0|1,0,0]=3 6373 B12R1.125 C=C(C)COc1ccccc1C 7a_100000210338_100000748629 [0,2,0,0,0,0|1,0,0]=3 6374 B12R1.125 C=C(C)COc1ccccc1Cl 34a_100000210172_100000748629 [0,2,0,0,0,0|1,0,0]=3 6375 B12R1.125 C=C(C)COc1ccccc1Cl 7a_100000210172_100000748629 [0,2,0,0,0,0|1,0,0]=3 6376 B12R1.125 C=C(C)COc1ccccc1F 34a_100000210171_100000748629 [0,2,0,0,0,0|1,0,0]=3 6377 B12R1.125 C=C(C)COc1ccccc1F 7a_100000210171_100000748629 [0,2,0,0,0,0|1,0,0]=3 6378 B12R1.125 C=C(C)COc1ccccc1I 34a_100000739446_100000748629 [0,2,0,0,0,0|1,0,0]=3 6379 B12R1.125 C=C(C)COc1ccccc1I 7a_100000739446_100000748629 [0,2,0,0,0,0|1,0,0]=3 6380 B12R1.125 C=C(C)COc1ccccc1N 34a_100000185747_100000748629 [0,2,0,0,0,0|1,0,0]=3 6381 B12R1.125 C=C(C)COc1ccccc1N 7a_100000185747_100000748629 [0,2,0,0,0,0|1,0,0]=3 6382 B12R1.125 C=C(C)COc1cccnc1Br 34a_100000744436_100000748629 [0,2,0,0,0,0|2,0,0]=4 6383 B12R1.125 C=C(C)COc1cccnc1Br 7a_100000744436_100000748629 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.125 C=C(C)COc1cccnc1C 34a_100000745507_100000748629 [0,2,0,0,0,0|2,0,0]=4 6385 B12R1.125 C=C(C)COc1cccnc1C 7a_100000745507_100000748629 [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.125 C=C(C)COc1cccnc1Cl 34a_100000757616_100000748629 [0,2,0,0,0,0|2,0,0]=4 6387 B12R1.125 C=C(C)COc1cccnc1Cl 7a_100000757616_100000748629 [0,2,0,0,0,0|2,0,0]=4 6388 B12R1.125 C=C(C)COc1cccnc1F 34a_100000061740_100000748629 [0,2,0,0,0,0|2,0,0]=4 6389 B12R1.125 C=C(C)COc1cccnc1F 7a_100000061740_100000748629 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.125 C=C(C)COc1cccnc1I 34a_100000034122_100000748629 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.125 C=C(C)COc1cccnc1I 7a_100000034122_100000748629 [0,2,0,0,0,0|2,0,0]=4 6392 B12R1.125 C=C(C)COc1cccnc1N 34a_100000211975_100000748629 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.125 C=C(C)COc1cccnc1N 7a_100000211975_100000748629 [0,2,0,0,0,0|2,0,0]=4 6394 B12R1.125 C=C(C)COc1cccoc1=O 34a_100000077404_100000748629 [0,2,0,0,0,0|1,0,1]=4 6395 B12R1.125 C=C(C)COc1cccoc1=O 7a_100000077404_100000748629 [0,2,0,0,0,0|1,0,1]=4 6396 B12R1.125 C=C(C)COc1ccncc1Br 34a_100011996408_100000748629 [0,2,0,0,0,0|2,0,0]=4 6397 B12R1.125 C=C(C)COc1ccncc1C 34a_100000694293_100000748629 [0,2,0,0,0,0|2,0,0]=4 6398 B12R1.125 C=C(C)COc1ccncc1Cl 34a_100011997054_100000748629 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.125 C=C(C)COc1ccncc1F 34a_200000081243_100000748629 [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.125 C=C(C)COc1cnccc1C 34a_100011997053_100000748629 [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.125 C=C(C)COc1cnccc1C 7a_100011997053_100000748629 [0,2,0,0,0,0|2,0,0]=4 6402 B12R1.125 C=C(C)COc1cnccc1Cl 34a_100011996695_100000748629 [0,2,0,0,0,0|2,0,0]=4 6403 B12R1.125 C=C(C)COc1cnccc1I 34a_100000050107_100000748629 [0,2,0,0,0,0|2,0,0]=4 6404 B12R1.125 C=C(C)COc1cnccc1N 34a_100000753702_100000748629 [0,2,0,0,0,0|2,0,0]=4 6405 B12R1.125 C=C(C)COc1coccc1=O 34a_100000060831_100000748629 [0,2,0,0,0,0|1,0,1]=4 6406 B12R1.125 C=C(C)COc1ncccc1Cl 34a_100011290957_100000748629 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.125 C=C(C)COc1ncccc1F 34a_100011219419_100000748629 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.125 C=C(C)COc1ncccc1N 34a_100000746358_100000748629 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.125 C=C(C)CSc1c[nH]ccc1=O 62a_100000748629_100009998708 [0,2,0,0,0,0|1,0,1]=4 6410 B12R1.125 C=C(C)CSc1c[nH]ccc1=O 62a_100009998708_100000211660 [0,2,0,0,0,0|1,0,1]=4 6411 B12R1.125 C=C(C)CSc1c[nH]ccc1=S 62a_100000748629_200012280681 [0,2,0,0,0,0|1,1,0]=4 6412 B12R1.125 C=C(C)CSc1c[nH]ccc1=S 62a_200012280681_100000211660 [0,2,0,0,0,0|1,1,0]=4 6413 B12R1.125 C=C(C)CSc1cccc[n+]1C 62a_100000748629_100000212160 [0,2,0,0,0,0|2,0,0]=4 6414 B12R1.125 C=C(C)CSc1cccc[n+]1[O-] 62a_100000748629_200000042595 [0,2,0,0,0,0|1,0,1]=4 6415 B12R1.125 C=C(C)CSc1ccccc1Br 62a_100000695589_100000211660 [0,2,0,0,0,0|1,0,0]=3 6416 B12R1.125 C=C(C)CSc1ccccc1Br 62a_100000748629_100000695589 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000210755_100000211660 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000748629_100000210755 [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.125 C=C(C)CSc1ccccc1Cl 62a_100000748629_100000764095 [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.125 C=C(C)CSc1ccccc1Cl 62a_100000764095_100000211660 [0,2,0,0,0,0|1,0,0]=3 6421 B12R1.125 C=C(C)CSc1ccccc1F 62a_100000748629_100011215700 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.125 C=C(C)CSc1ccccc1F 62a_100011215700_100000211660 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.125 C=C(C)CSc1ccccc1N 62a_100000210017_100000211660 [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.125 C=C(C)CSc1ccccc1N 62a_100000748629_100000210017 [0,2,0,0,0,0|1,0,0]=3 6425 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000739446_100000211660 [0,2,0,0,0,0|0,0,0]=2 6426 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000748629_100000739446 [0,2,0,0,0,0|0,0,0]=2 6427 B12R1.125 C=C(C)CSc1cccnc1Br 62a_100000748629_100010202626 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.125 C=C(C)CSc1cccnc1Br 62a_100010202626_100000211660 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.125 C=C(C)CSc1cccnc1C 62a_100000748629_100000751574 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.125 C=C(C)CSc1cccnc1C 62a_100000751574_100000211660 [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.125 C=C(C)CSc1cccnc1Cl 62a_100000036424_100000211660 [0,2,0,0,0,0|2,0,0]=4 6432 B12R1.125 C=C(C)CSc1cccnc1Cl 62a_100000748629_100000036424 [0,2,0,0,0,0|2,0,0]=4 6433 B12R1.125 C=C(C)CSc1cccnc1F 62a_100000748629_100009816115 [0,2,0,0,0,0|2,0,0]=4 6434 B12R1.125 C=C(C)CSc1cccnc1F 62a_100009816115_100000211660 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.125 C=C(C)CSc1cccnc1N 62a_100000045569_100000211660 [0,2,0,0,0,0|2,0,0]=4 6436 B12R1.125 C=C(C)CSc1cccnc1N 62a_100000748629_100000045569 [0,2,0,0,0,0|2,0,0]=4 6437 B12R1.125 C=C(C)CSc1cccnc1O 62a_100000748629_100000760158 [0,2,0,0,0,0|1,0,0]=3 6438 B12R1.125 C=C(C)CSc1cccnc1O 62a_100000760158_100000211660 [0,2,0,0,0,0|1,0,0]=3 6439 B12R1.125 C=C(C)CSc1ccncc1Br 62a_100000726257_100000211660 [0,2,0,0,0,0|2,0,0]=4 6440 B12R1.125 C=C(C)CSc1ccncc1Br 62a_100000748629_100000726257 [0,2,0,0,0,0|2,0,0]=4 6441 B12R1.125 C=C(C)CSc1ccncc1C 62a_100000748629_100000765111 [0,2,0,0,0,0|2,0,0]=4 6442 B12R1.125 C=C(C)CSc1ccncc1C 62a_100000765111_100000211660 [0,2,0,0,0,0|2,0,0]=4 6443 B12R1.125 C=C(C)CSc1ccncc1Cl 62a_100000708259_100000211660 [0,2,0,0,0,0|2,0,0]=4 6444 B12R1.125 C=C(C)CSc1ccncc1Cl 62a_100000748629_100000708259 [0,2,0,0,0,0|2,0,0]=4 6445 B12R1.125 C=C(C)CSc1ccncc1F 62a_100000047030_100000211660 [0,2,0,0,0,0|2,0,0]=4 6446 B12R1.125 C=C(C)CSc1ccncc1F 62a_100000748629_100000047030 [0,2,0,0,0,0|2,0,0]=4 6447 B12R1.125 C=C(C)CSc1ccncc1N 62a_100000748629_100000756074 [0,2,0,0,0,0|2,0,0]=4 6448 B12R1.125 C=C(C)CSc1ccncc1N 62a_100000756074_100000211660 [0,2,0,0,0,0|2,0,0]=4 6449 B12R1.125 C=C(C)CSc1ccncc1O 62a_100000748629_100009817591 [0,2,0,0,0,0|1,0,0]=3 6450 B12R1.125 C=C(C)CSc1ccncc1O 62a_100009817591_100000211660 [0,2,0,0,0,0|1,0,0]=3 6451 B12R1.125 C=C(C)CSc1cnccc1Br 62a_100000748629_100010138639 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.125 C=C(C)CSc1cnccc1Br 62a_100010138639_100000211660 [0,2,0,0,0,0|2,0,0]=4 6453 B12R1.125 C=C(C)CSc1cnccc1C 62a_100000748629_100000761580 [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.125 C=C(C)CSc1cnccc1C 62a_100000761580_100000211660 [0,2,0,0,0,0|2,0,0]=4 6455 B12R1.125 C=C(C)CSc1cnccc1Cl 62a_100000748629_100009995489 [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.125 C=C(C)CSc1cnccc1Cl 62a_100009995489_100000211660 [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.125 C=C(C)CSc1cnccc1F 62a_100000748629_100009820683 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.125 C=C(C)CSc1cnccc1F 62a_100009820683_100000211660 [0,2,0,0,0,0|2,0,0]=4 6459 B12R1.125 C=C(C)CSc1cnccc1N 62a_100000047001_100000211660 [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.125 C=C(C)CSc1cnccc1N 62a_100000748629_100000047001 [0,2,0,0,0,0|2,0,0]=4 6461 B12R1.125 C=C(C)CSc1cncnc1O 62a_100000748629_100000751107 [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.125 C=C(C)CSc1cncnc1O 62a_100000751107_100000211660 [0,2,0,0,0,0|2,0,0]=4 6463 B12R1.125 C=C(C)CSc1ncccc1Br 62a_100000696092_100000211660 [0,2,0,0,0,0|2,0,0]=4 6464 B12R1.125 C=C(C)CSc1ncccc1Br 62a_100000748629_100000696092 [0,2,0,0,0,0|2,0,0]=4 6465 B12R1.125 C=C(C)CSc1ncccc1C 62a_100000748629_100000751373 [0,2,0,0,0,0|2,0,0]=4 6466 B12R1.125 C=C(C)CSc1ncccc1C 62a_100000751373_100000211660 [0,2,0,0,0,0|2,0,0]=4 6467 B12R1.125 C=C(C)CSc1ncccc1Cl 62a_100000748629_100011356963 [0,2,0,0,0,0|2,0,0]=4 6468 B12R1.125 C=C(C)CSc1ncccc1Cl 62a_100011356963_100000211660 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.125 C=C(C)CSc1ncccc1F 62a_100000685392_100000211660 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.125 C=C(C)CSc1ncccc1F 62a_100000748629_100000685392 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.125 C=C(C)CSc1ncccc1N 62a_100000688686_100000211660 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.125 C=C(C)CSc1ncccc1N 62a_100000748629_100000688686 [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.125 C=C(C)CSc1ncccc1O 62a_100000034122_100000211660 [0,2,0,0,0,0|1,0,0]=3 6474 B12R1.125 C=C(C)CSc1ncccc1O 62a_100000748629_100000034122 [0,2,0,0,0,0|1,0,0]=3 6475 B12R1.125 C=C(F)CNc1ccccc1Br 34a_100000210017_100009893438 [0,2,0,0,0,0|1,0,0]=3 6476 B12R1.125 C=C(F)CNc1ccccc1C 34a_100015192222_100009893438 [0,2,0,0,0,0|1,0,0]=3 6477 B12R1.125 C=C(F)CNc1ccccc1Cl 34a_100000185783_100009893438 [0,2,0,0,0,0|1,0,0]=3 6478 B12R1.125 C=C(F)CNc1ccccc1F 34a_100000210422_100009893438 [0,2,0,0,0,0|1,0,0]=3 6479 B12R1.125 C=C(F)CNc1ccccc1I 34a_100000210053_100009893438 [0,2,0,0,0,0|1,0,0]=3 6480 B12R1.125 C=C(F)CNc1ccccc1O 34a_100000185747_100009893438 [0,2,0,0,0,0|0,0,0]=2 6481 B12R1.125 C=C(F)COc1cccc[n+]1[O-] 7a_100000211761_100000042424 [0,2,0,0,0,0|1,0,1]=4 6482 B12R1.125 C=C(F)COc1ccccc1Br 34a_100000181306_100009893438 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.125 C=C(F)COc1ccccc1Br 7a_100000181306_100000042424 [0,2,0,0,0,0|1,0,0]=3 6484 B12R1.125 C=C(F)COc1ccccc1C 34a_100000210338_100009893438 [0,2,0,0,0,0|1,0,0]=3 6485 B12R1.125 C=C(F)COc1ccccc1C 7a_100000210338_100000042424 [0,2,0,0,0,0|1,0,0]=3 6486 B12R1.125 C=C(F)COc1ccccc1Cl 34a_100000210172_100009893438 [0,2,0,0,0,0|1,0,0]=3 6487 B12R1.125 C=C(F)COc1ccccc1Cl 7a_100000210172_100000042424 [0,2,0,0,0,0|1,0,0]=3 6488 B12R1.125 C=C(F)COc1ccccc1F 34a_100000210171_100009893438 [0,2,0,0,0,0|1,0,0]=3 6489 B12R1.125 C=C(F)COc1ccccc1F 7a_100000210171_100000042424 [0,2,0,0,0,0|1,0,0]=3 6490 B12R1.125 C=C(F)COc1ccccc1I 34a_100000739446_100009893438 [0,2,0,0,0,0|1,0,0]=3 6491 B12R1.125 C=C(F)COc1ccccc1I 7a_100000739446_100000042424 [0,2,0,0,0,0|1,0,0]=3 6492 B12R1.125 C=C(F)COc1ccccc1N 34a_100000185747_100009893438 [0,2,0,0,0,0|1,0,0]=3 6493 B12R1.125 C=C(F)COc1ccccc1N 7a_100000185747_100000042424 [0,2,0,0,0,0|1,0,0]=3 6494 B12R1.125 C=C(F)COc1cccnc1Br 34a_100000744436_100009893438 [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.125 C=C(F)COc1cccnc1Br 7a_100000744436_100000042424 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.125 C=C(F)COc1cccnc1C 34a_100000745507_100009893438 [0,2,0,0,0,0|2,0,0]=4 6497 B12R1.125 C=C(F)COc1cccnc1C 7a_100000745507_100000042424 [0,2,0,0,0,0|2,0,0]=4 6498 B12R1.125 C=C(F)COc1cccnc1Cl 34a_100000757616_100009893438 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.125 C=C(F)COc1cccnc1Cl 7a_100000757616_100000042424 [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.125 C=C(F)COc1cccnc1F 34a_100000061740_100009893438 [0,2,0,0,0,0|2,0,0]=4 6501 B12R1.125 C=C(F)COc1cccnc1F 7a_100000061740_100000042424 [0,2,0,0,0,0|2,0,0]=4 6502 B12R1.125 C=C(F)COc1cccnc1I 34a_100000034122_100009893438 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.125 C=C(F)COc1cccnc1I 7a_100000034122_100000042424 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.125 C=C(F)COc1cccnc1N 34a_100000211975_100009893438 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.125 C=C(F)COc1cccnc1N 7a_100000211975_100000042424 [0,2,0,0,0,0|2,0,0]=4 6506 B12R1.125 C=C(F)COc1cccoc1=O 34a_100000077404_100009893438 [0,2,0,0,0,0|1,0,1]=4 6507 B12R1.125 C=C(F)COc1cccoc1=O 7a_100000077404_100000042424 [0,2,0,0,0,0|1,0,1]=4 6508 B12R1.125 C=C(F)COc1ccncc1Br 34a_100011996408_100009893438 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.125 C=C(F)COc1ccncc1C 34a_100000694293_100009893438 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.125 C=C(F)COc1ccncc1Cl 34a_100011997054_100009893438 [0,2,0,0,0,0|2,0,0]=4 6511 B12R1.125 C=C(F)COc1ccncc1F 34a_200000081243_100009893438 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.125 C=C(F)COc1cnccc1C 34a_100011997053_100009893438 [0,2,0,0,0,0|2,0,0]=4 6513 B12R1.125 C=C(F)COc1cnccc1C 7a_100011997053_100000042424 [0,2,0,0,0,0|2,0,0]=4 6514 B12R1.125 C=C(F)COc1cnccc1Cl 34a_100011996695_100009893438 [0,2,0,0,0,0|2,0,0]=4 6515 B12R1.125 C=C(F)COc1cnccc1I 34a_100000050107_100009893438 [0,2,0,0,0,0|2,0,0]=4 6516 B12R1.125 C=C(F)COc1cnccc1N 34a_100000753702_100009893438 [0,2,0,0,0,0|2,0,0]=4 6517 B12R1.125 C=C(F)COc1coccc1=O 34a_100000060831_100009893438 [0,2,0,0,0,0|1,0,1]=4 6518 B12R1.125 C=C(F)COc1ncccc1Cl 34a_100011290957_100009893438 [0,2,0,0,0,0|2,0,0]=4 6519 B12R1.125 C=C(F)COc1ncccc1F 34a_100011219419_100009893438 [0,2,0,0,0,0|2,0,0]=4 6520 B12R1.125 C=C(F)COc1ncccc1N 34a_100000746358_100009893438 [0,2,0,0,0,0|2,0,0]=4 6521 B12R1.125 C=C(F)CSc1c[nH]ccc1=O 62a_100000042424_100009998708 [0,2,0,0,0,0|1,0,1]=4 6522 B12R1.125 C=C(F)CSc1c[nH]ccc1=O 62a_100009998708_100000042424 [0,2,0,0,0,0|1,0,1]=4 6523 B12R1.125 C=C(F)CSc1c[nH]ccc1=S 62a_100000042424_200012280681 [0,2,0,0,0,0|1,1,0]=4 6524 B12R1.125 C=C(F)CSc1c[nH]ccc1=S 62a_200012280681_100000042424 [0,2,0,0,0,0|1,1,0]=4 6525 B12R1.125 C=C(F)CSc1cccc[n+]1C 62a_100000042424_100000212160 [0,2,0,0,0,0|2,0,0]=4 6526 B12R1.125 C=C(F)CSc1cccc[n+]1[O-] 62a_100000042424_200000042595 [0,2,0,0,0,0|1,0,1]=4 6527 B12R1.125 C=C(F)CSc1ccccc1Br 62a_100000042424_100000695589 [0,2,0,0,0,0|1,0,0]=3 6528 B12R1.125 C=C(F)CSc1ccccc1Br 62a_100000695589_100000042424 [0,2,0,0,0,0|1,0,0]=3 6529 B12R1.125 C=C(F)CSc1ccccc1C 62a_100000042424_100000210755 [0,2,0,0,0,0|1,0,0]=3 6530 B12R1.125 C=C(F)CSc1ccccc1C 62a_100000210755_100000042424 [0,2,0,0,0,0|1,0,0]=3 6531 B12R1.125 C=C(F)CSc1ccccc1Cl 62a_100000042424_100000764095 [0,2,0,0,0,0|1,0,0]=3 6532 B12R1.125 C=C(F)CSc1ccccc1Cl 62a_100000764095_100000042424 [0,2,0,0,0,0|1,0,0]=3 6533 B12R1.125 C=C(F)CSc1ccccc1F 62a_100000042424_100011215700 [0,2,0,0,0,0|1,0,0]=3 6534 B12R1.125 C=C(F)CSc1ccccc1F 62a_100011215700_100000042424 [0,2,0,0,0,0|1,0,0]=3 6535 B12R1.125 C=C(F)CSc1ccccc1N 62a_100000042424_100000210017 [0,2,0,0,0,0|1,0,0]=3 6536 B12R1.125 C=C(F)CSc1ccccc1N 62a_100000210017_100000042424 [0,2,0,0,0,0|1,0,0]=3 6537 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000042424_100000739446 [0,2,0,0,0,0|0,0,0]=2 6538 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000739446_100000042424 [0,2,0,0,0,0|0,0,0]=2 6539 B12R1.125 C=C(F)CSc1cccnc1Br 62a_100000042424_100010202626 [0,2,0,0,0,0|2,0,0]=4 6540 B12R1.125 C=C(F)CSc1cccnc1Br 62a_100010202626_100000042424 [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.125 C=C(F)CSc1cccnc1C 62a_100000042424_100000751574 [0,2,0,0,0,0|2,0,0]=4 6542 B12R1.125 C=C(F)CSc1cccnc1C 62a_100000751574_100000042424 [0,2,0,0,0,0|2,0,0]=4 6543 B12R1.125 C=C(F)CSc1cccnc1Cl 62a_100000036424_100000042424 [0,2,0,0,0,0|2,0,0]=4 6544 B12R1.125 C=C(F)CSc1cccnc1Cl 62a_100000042424_100000036424 [0,2,0,0,0,0|2,0,0]=4 6545 B12R1.125 C=C(F)CSc1cccnc1F 62a_100000042424_100009816115 [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.125 C=C(F)CSc1cccnc1F 62a_100009816115_100000042424 [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.125 C=C(F)CSc1cccnc1N 62a_100000042424_100000045569 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.125 C=C(F)CSc1cccnc1N 62a_100000045569_100000042424 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.125 C=C(F)CSc1cccnc1O 62a_100000042424_100000760158 [0,2,0,0,0,0|1,0,0]=3 6550 B12R1.125 C=C(F)CSc1cccnc1O 62a_100000760158_100000042424 [0,2,0,0,0,0|1,0,0]=3 6551 B12R1.125 C=C(F)CSc1ccncc1Br 62a_100000042424_100000726257 [0,2,0,0,0,0|2,0,0]=4 6552 B12R1.125 C=C(F)CSc1ccncc1Br 62a_100000726257_100000042424 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.125 C=C(F)CSc1ccncc1C 62a_100000042424_100000765111 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.125 C=C(F)CSc1ccncc1C 62a_100000765111_100000042424 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.125 C=C(F)CSc1ccncc1Cl 62a_100000042424_100000708259 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.125 C=C(F)CSc1ccncc1Cl 62a_100000708259_100000042424 [0,2,0,0,0,0|2,0,0]=4 6557 B12R1.125 C=C(F)CSc1ccncc1F 62a_100000042424_100000047030 [0,2,0,0,0,0|2,0,0]=4 6558 B12R1.125 C=C(F)CSc1ccncc1F 62a_100000047030_100000042424 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.125 C=C(F)CSc1ccncc1N 62a_100000042424_100000756074 [0,2,0,0,0,0|2,0,0]=4 6560 B12R1.125 C=C(F)CSc1ccncc1N 62a_100000756074_100000042424 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.125 C=C(F)CSc1ccncc1O 62a_100000042424_100009817591 [0,2,0,0,0,0|1,0,0]=3 6562 B12R1.125 C=C(F)CSc1ccncc1O 62a_100009817591_100000042424 [0,2,0,0,0,0|1,0,0]=3 6563 B12R1.125 C=C(F)CSc1cnccc1Br 62a_100000042424_100010138639 [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.125 C=C(F)CSc1cnccc1Br 62a_100010138639_100000042424 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.125 C=C(F)CSc1cnccc1C 62a_100000042424_100000761580 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.125 C=C(F)CSc1cnccc1C 62a_100000761580_100000042424 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.125 C=C(F)CSc1cnccc1Cl 62a_100000042424_100009995489 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.125 C=C(F)CSc1cnccc1Cl 62a_100009995489_100000042424 [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.125 C=C(F)CSc1cnccc1F 62a_100000042424_100009820683 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.125 C=C(F)CSc1cnccc1F 62a_100009820683_100000042424 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.125 C=C(F)CSc1cnccc1N 62a_100000042424_100000047001 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.125 C=C(F)CSc1cnccc1N 62a_100000047001_100000042424 [0,2,0,0,0,0|2,0,0]=4 6573 B12R1.125 C=C(F)CSc1cncnc1O 62a_100000042424_100000751107 [0,2,0,0,0,0|2,0,0]=4 6574 B12R1.125 C=C(F)CSc1cncnc1O 62a_100000751107_100000042424 [0,2,0,0,0,0|2,0,0]=4 6575 B12R1.125 C=C(F)CSc1ncccc1Br 62a_100000042424_100000696092 [0,2,0,0,0,0|2,0,0]=4 6576 B12R1.125 C=C(F)CSc1ncccc1Br 62a_100000696092_100000042424 [0,2,0,0,0,0|2,0,0]=4 6577 B12R1.125 C=C(F)CSc1ncccc1C 62a_100000042424_100000751373 [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.125 C=C(F)CSc1ncccc1C 62a_100000751373_100000042424 [0,2,0,0,0,0|2,0,0]=4 6579 B12R1.125 C=C(F)CSc1ncccc1Cl 62a_100000042424_100011356963 [0,2,0,0,0,0|2,0,0]=4 6580 B12R1.125 C=C(F)CSc1ncccc1Cl 62a_100011356963_100000042424 [0,2,0,0,0,0|2,0,0]=4 6581 B12R1.125 C=C(F)CSc1ncccc1F 62a_100000042424_100000685392 [0,2,0,0,0,0|2,0,0]=4 6582 B12R1.125 C=C(F)CSc1ncccc1F 62a_100000685392_100000042424 [0,2,0,0,0,0|2,0,0]=4 6583 B12R1.125 C=C(F)CSc1ncccc1N 62a_100000042424_100000688686 [0,2,0,0,0,0|2,0,0]=4 6584 B12R1.125 C=C(F)CSc1ncccc1N 62a_100000688686_100000042424 [0,2,0,0,0,0|2,0,0]=4 6585 B12R1.125 C=C(F)CSc1ncccc1O 62a_100000034122_100000042424 [0,2,0,0,0,0|1,0,0]=3 6586 B12R1.125 C=C(F)CSc1ncccc1O 62a_100000042424_100000034122 [0,2,0,0,0,0|1,0,0]=3 6587 B12R1.125 CC(=O)C=Cc1ccccc1Br 1458a_100000719032_200000210301 [0,2,0,0,0,0|1,0,1]=4 6588 B12R1.125 CC(=O)C=Cc1ccccc1Cl 1458a_100000720304_200000210301 [0,2,0,0,0,0|1,0,1]=4 6589 B12R1.125 CC(=O)C=Cc1ccccc1F 1458a_100016256065_200000210301 [0,2,0,0,0,0|1,0,1]=4 6590 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [0,2,0,0,0,0|0,0,1]=3 6591 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000070787_100012161201 [0,2,0,0,0,0|1,0,1]=4 6592 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000740810_200000210301 [0,2,0,0,0,0|1,0,1]=4 6593 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000070787_100011713688 [0,2,0,0,0,0|1,0,1]=4 6594 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000748742_200000210301 [0,2,0,0,0,0|1,0,1]=4 6595 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000070787_100011713703 [0,2,0,0,0,0|1,0,1]=4 6596 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000184300_200000210301 [0,2,0,0,0,0|1,0,1]=4 6597 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000070787_100000720011 [0,2,0,0,0,0|1,0,1]=4 6598 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000189703_200000210301 [0,2,0,0,0,0|1,0,1]=4 6599 B12R1.125 CC(=O)CCc1ccccc1I 1458a_100000037306_200000210301 [0,2,0,0,0,0|1,0,1]=4 6600 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000070787_100000722297 [0,2,0,0,0,0|0,0,1]=3 6601 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000181328_200000210301 [0,2,0,0,0,0|0,0,1]=3 6602 B12R1.125 CC(=O)COc1ccccc1Br 1458a_100000216496_200000210301 [0,2,0,0,0,0|1,0,1]=4 6603 B12R1.125 CC(=O)COc1ccccc1C 1458a_100000182418_200000210301 [0,2,0,0,0,0|1,0,1]=4 6604 B12R1.125 CC(=O)COc1ccccc1Cl 1458a_100000185159_200000210301 [0,2,0,0,0,0|1,0,1]=4 6605 B12R1.125 CC(=O)COc1ccccc1F 1458a_100000182486_200000210301 [0,2,0,0,0,0|1,0,1]=4 6606 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [0,2,0,0,0,0|0,0,1]=3 6607 B12R1.125 CC(=O)CSc1ccccc1C 1458a_100000183026_200000210301 [0,2,0,0,0,0|1,0,1]=4 6608 B12R1.125 CC(=O)CSc1ccccc1F 1458a_100000179528_200000210301 [0,2,0,0,0,0|1,0,1]=4 6609 B12R1.125 CC(=O)CSc1ccccc1O 1458a_100000695322_200000210301 [0,2,0,0,0,0|0,0,1]=3 6610 B12R1.125 CC(=O)NCc1ccccc1Br 11a_100000689332_100015343762 [0,2,0,0,0,0|1,0,1]=4 6611 B12R1.125 CC(=O)NCc1ccccc1Br 1626a_100000689332_100015343762 [0,2,0,0,0,0|1,0,1]=4 6612 B12R1.125 CC(=O)NCc1ccccc1Br 240690a_100000689332_100015343762 [0,2,0,0,0,0|1,0,1]=4 6613 B12R1.125 CC(=O)NCc1ccccc1Br 527a_100000689332_100103153847 [0,2,0,0,0,0|1,0,1]=4 6614 B12R1.125 CC(=O)NCc1ccccc1C 11a_100000174972_100015343762 [0,2,0,0,0,0|1,0,1]=4 6615 B12R1.125 CC(=O)NCc1ccccc1C 1626a_100000174972_100015343762 [0,2,0,0,0,0|1,0,1]=4 6616 B12R1.125 CC(=O)NCc1ccccc1C 240690a_100000174972_100015343762 [0,2,0,0,0,0|1,0,1]=4 6617 B12R1.125 CC(=O)NCc1ccccc1C 527a_100000174972_100103153847 [0,2,0,0,0,0|1,0,1]=4 6618 B12R1.125 CC(=O)NCc1ccccc1Cl 11a_100000174879_100015343762 [0,2,0,0,0,0|1,0,1]=4 6619 B12R1.125 CC(=O)NCc1ccccc1Cl 1626a_100000174879_100015343762 [0,2,0,0,0,0|1,0,1]=4 6620 B12R1.125 CC(=O)NCc1ccccc1Cl 240690a_100000174879_100015343762 [0,2,0,0,0,0|1,0,1]=4 6621 B12R1.125 CC(=O)NCc1ccccc1Cl 527a_100000174879_100103153847 [0,2,0,0,0,0|1,0,1]=4 6622 B12R1.125 CC(=O)NCc1ccccc1F 11a_100000174869_100015343762 [0,2,0,0,0,0|1,0,1]=4 6623 B12R1.125 CC(=O)NCc1ccccc1F 1626a_100000174869_100015343762 [0,2,0,0,0,0|1,0,1]=4 6624 B12R1.125 CC(=O)NCc1ccccc1F 240690a_100000174869_100015343762 [0,2,0,0,0,0|1,0,1]=4 6625 B12R1.125 CC(=O)NCc1ccccc1F 527a_100000174869_100103153847 [0,2,0,0,0,0|1,0,1]=4 6626 B12R1.125 CC(=O)NCc1ccccc1I 11a_100015347259_100015343762 [0,2,0,0,0,0|1,0,1]=4 6627 B12R1.125 CC(=O)NCc1ccccc1I 1626a_100015347259_100015343762 [0,2,0,0,0,0|1,0,1]=4 6628 B12R1.125 CC(=O)NCc1ccccc1I 240690a_100015347259_100015343762 [0,2,0,0,0,0|1,0,1]=4 6629 B12R1.125 CC(=O)NCc1ccccc1I 527a_100015347259_100103153847 [0,2,0,0,0,0|1,0,1]=4 6630 B12R1.125 CC(=O)NCc1ccccc1O 240690a_100000185550_100015343762 [0,2,0,0,0,0|0,0,1]=3 6631 B12R1.125 CC(=O)NCc1ccccc1O 271570a_203496583355_100011237613 [0,2,0,0,0,0|0,0,1]=3 6632 B12R1.125 CC(=O)NCc1ccccc1O 527a_100000185550_100103153847 [0,2,0,0,0,0|0,0,1]=3 6633 B12R1.125 CC(C)C=Cc1ccccc1O 271570a_100016257149_100000739446 [0,2,0,0,0,0|0,0,2]=4 6634 B12R1.125 CC(C)CNc1ccccc1O 34a_100000185747_100000210624 [0,2,0,0,0,0|0,0,2]=4 6635 B12R1.125 CC(C)CSc1ccccc1O 62a_100000210624_100000739446 [0,2,0,0,0,0|0,0,2]=4 6636 B12R1.125 CC(C)CSc1ccccc1O 62a_100000739446_100000210760 [0,2,0,0,0,0|0,0,2]=4 6637 B12R1.125 CC(C)NCc1ccccc1O 271570a_203496583355_100000195800 [0,2,0,0,0,0|0,0,2]=4 6638 B12R1.125 CC(C)NCc1ccccc1O 34a_100000185550_100000210206 [0,2,0,0,0,0|0,0,2]=4 6639 B12R1.125 CC(C)SCc1ccccc1O 271570a_203496583355_200000173093 [0,2,0,0,0,0|0,0,2]=4 6640 B12R1.125 CC(O)C=Cc1ccccc1O 271570a_200011019289_100000739446 [0,2,0,0,0,0|0,0,2]=4 6641 B12R1.125 CC(O)CNc1ccccc1O 34a_100000185747_100011218427 [0,2,0,0,0,0|0,0,2]=4 6642 B12R1.125 CC(O)CSc1ccccc1O 62a_100000739446_100011218427 [0,2,0,0,0,0|0,0,2]=4 6643 B12R1.125 CC(O)CSc1ccccc1O 62a_100011218427_100000739446 [0,2,0,0,0,0|0,0,2]=4 6644 B12R1.125 CN(C)CCc1ccccc1O 269982a_100102631434_100000722297 [0,2,0,0,0,0|0,0,2]=4 6645 B12R1.125 C[C@@H](O)CNc1ccccc1O 34a_100000185747_100009817552 [0,2,0,0,0,0|0,0,2]=4 6646 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100000739446_100009817552 [0,2,0,0,0,0|0,0,2]=4 6647 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100009817552_100000739446 [0,2,0,0,0,0|0,0,2]=4 6648 B12R1.125 Cc1ccccc1CCC(=O)[13CH3] 1458a_100000748742_200025704644 [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.125 Cc1ccccc1NCC(=O)N 34a_100015192222_100000187820 [0,2,0,0,0,0|2,0,0]=4 6650 B12R1.125 Cc1ccccc1NCC(=O)[O-] 34a_100015192222_100020667443 [0,2,0,0,0,0|2,0,0]=4 6651 B12R1.125 Cc1ccccc1OCC(=O)N 34a_100000210338_100000187820 [0,2,0,0,0,0|2,0,0]=4 6652 B12R1.125 Cc1ccccc1OCC(=O)N 7a_100000210338_100000187820 [0,2,0,0,0,0|2,0,0]=4 6653 B12R1.125 Cc1ccccc1OCC(=O)[13CH3] 1458a_100000182418_200025704644 [0,2,0,0,0,0|1,0,1]=4 6654 B12R1.125 Cc1ccccc1OCC(=O)[O-] 34a_100000210338_100020667443 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000210755_100000747473 [0,2,0,0,0,0|2,0,0]=4 6656 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000747473_100000210755 [0,2,0,0,0,0|2,0,0]=4 6657 B12R1.125 Cc1ccccc1SCC(=O)[13CH3] 1458a_100000183026_200025704644 [0,2,0,0,0,0|1,0,1]=4 6658 B12R1.125 Cc1ccccc1SCC(=O)[O-] 62a_100000210755_100020667443 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.125 Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210755 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.125 NC(=O)CCc1ccccc1O 271570a_203496583355_100009814947 [0,2,0,0,0,0|0,0,1]=3 6661 B12R1.125 NC(=O)CNc1ccccc1Br 34a_100000210017_100000187820 [0,2,0,0,0,0|2,0,0]=4 6662 B12R1.125 NC(=O)CNc1ccccc1Cl 34a_100000185783_100000187820 [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.125 NC(=O)CNc1ccccc1F 34a_100000210422_100000187820 [0,2,0,0,0,0|2,0,0]=4 6664 B12R1.125 NC(=O)CNc1ccccc1I 34a_100000210053_100000187820 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.125 NC(=O)CNc1ccccc1O 34a_100000185747_100000187820 [0,2,0,0,0,0|1,0,0]=3 6666 B12R1.125 NC(=O)COc1ccccc1Br 34a_100000181306_100000187820 [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.125 NC(=O)COc1ccccc1Br 7a_100000181306_100000187820 [0,2,0,0,0,0|2,0,0]=4 6668 B12R1.125 NC(=O)COc1ccccc1Cl 34a_100000210172_100000187820 [0,2,0,0,0,0|2,0,0]=4 6669 B12R1.125 NC(=O)COc1ccccc1Cl 7a_100000210172_100000187820 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.125 NC(=O)COc1ccccc1F 34a_100000210171_100000187820 [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.125 NC(=O)COc1ccccc1F 7a_100000210171_100000187820 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.125 NC(=O)COc1ccccc1I 34a_100000739446_100000187820 [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.125 NC(=O)COc1ccccc1I 7a_100000739446_100000187820 [0,2,0,0,0,0|2,0,0]=4 6674 B12R1.125 NC(=O)COc1ccccc1N 34a_100000185747_100000187820 [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.125 NC(=O)COc1ccccc1N 7a_100000185747_100000187820 [0,2,0,0,0,0|2,0,0]=4 6676 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [0,2,0,0,0,0|1,0,0]=3 6677 B12R1.125 NC(=O)CSc1ccccc1Br 62a_100000695589_100000747473 [0,2,0,0,0,0|2,0,0]=4 6678 B12R1.125 NC(=O)CSc1ccccc1Br 62a_100000747473_100000695589 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.125 NC(=O)CSc1ccccc1Cl 62a_100000747473_100000764095 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.125 NC(=O)CSc1ccccc1Cl 62a_100000764095_100000747473 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.125 NC(=O)CSc1ccccc1F 62a_100000747473_100011215700 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.125 NC(=O)CSc1ccccc1F 62a_100011215700_100000747473 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000210017_100000747473 [0,2,0,0,0,0|2,0,0]=4 6684 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000747473_100000210017 [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000739446_100000747473 [0,2,0,0,0,0|1,0,0]=3 6686 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000747473_100000739446 [0,2,0,0,0,0|1,0,0]=3 6687 B12R1.125 NC(=O)CSc1cccnc1O 62a_100000747473_100000760158 [0,2,0,0,0,0|2,0,0]=4 6688 B12R1.125 NC(=O)CSc1cccnc1O 62a_100000760158_100000747473 [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.125 NC(=O)CSc1ccncc1O 62a_100000747473_100009817591 [0,2,0,0,0,0|2,0,0]=4 6690 B12R1.125 NC(=O)CSc1ccncc1O 62a_100009817591_100000747473 [0,2,0,0,0,0|2,0,0]=4 6691 B12R1.125 NC(=O)CSc1ncccc1O 62a_100000034122_100000747473 [0,2,0,0,0,0|2,0,0]=4 6692 B12R1.125 NC(=O)CSc1ncccc1O 62a_100000747473_100000034122 [0,2,0,0,0,0|2,0,0]=4 6693 B12R1.125 Nc1ccccc1OCC(=O)[O-] 34a_100000185747_100020667443 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100000210017_100020667443 [0,2,0,0,0,0|2,0,0]=4 6695 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210017 [0,2,0,0,0,0|2,0,0]=4 6696 B12R1.125 O=C([O-])CNc1ccccc1Br 34a_100000210017_100020667443 [0,2,0,0,0,0|2,0,0]=4 6697 B12R1.125 O=C([O-])CNc1ccccc1Cl 34a_100000185783_100020667443 [0,2,0,0,0,0|2,0,0]=4 6698 B12R1.125 O=C([O-])CNc1ccccc1F 34a_100000210422_100020667443 [0,2,0,0,0,0|2,0,0]=4 6699 B12R1.125 O=C([O-])CNc1ccccc1I 34a_100000210053_100020667443 [0,2,0,0,0,0|2,0,0]=4 6700 B12R1.125 O=C([O-])CNc1ccccc1O 34a_100000185747_100020667443 [0,2,0,0,0,0|1,0,0]=3 6701 B12R1.125 O=C([O-])COc1ccccc1Br 34a_100000181306_100020667443 [0,2,0,0,0,0|2,0,0]=4 6702 B12R1.125 O=C([O-])COc1ccccc1Cl 34a_100000210172_100020667443 [0,2,0,0,0,0|2,0,0]=4 6703 B12R1.125 O=C([O-])COc1ccccc1F 34a_100000210171_100020667443 [0,2,0,0,0,0|2,0,0]=4 6704 B12R1.125 O=C([O-])COc1ccccc1I 34a_100000739446_100020667443 [0,2,0,0,0,0|2,0,0]=4 6705 B12R1.125 O=C([O-])CSc1ccccc1Br 62a_100000695589_100020667443 [0,2,0,0,0,0|2,0,0]=4 6706 B12R1.125 O=C([O-])CSc1ccccc1Br 62a_100020667443_100000695589 [0,2,0,0,0,0|2,0,0]=4 6707 B12R1.125 O=C([O-])CSc1ccccc1Cl 62a_100000764095_100020667443 [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.125 O=C([O-])CSc1ccccc1Cl 62a_100020667443_100000764095 [0,2,0,0,0,0|2,0,0]=4 6709 B12R1.125 O=C([O-])CSc1ccccc1F 62a_100011215700_100020667443 [0,2,0,0,0,0|2,0,0]=4 6710 B12R1.125 O=C([O-])CSc1ccccc1F 62a_100020667443_100011215700 [0,2,0,0,0,0|2,0,0]=4 6711 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100000739446_100020667443 [0,2,0,0,0,0|1,0,0]=3 6712 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100020667443_100000739446 [0,2,0,0,0,0|1,0,0]=3 6713 B12R1.125 O=C([O-])CSc1cccnc1O 62a_100000760158_100020667443 [0,2,0,0,0,0|2,0,0]=4 6714 B12R1.125 O=C([O-])CSc1cccnc1O 62a_100020667443_100000760158 [0,2,0,0,0,0|2,0,0]=4 6715 B12R1.125 O=C([O-])CSc1ccncc1O 62a_100009817591_100020667443 [0,2,0,0,0,0|2,0,0]=4 6716 B12R1.125 O=C([O-])CSc1ccncc1O 62a_100020667443_100009817591 [0,2,0,0,0,0|2,0,0]=4 6717 B12R1.125 O=C([O-])CSc1ncccc1O 62a_100000034122_100020667443 [0,2,0,0,0,0|2,0,0]=4 6718 B12R1.125 O=C([O-])CSc1ncccc1O 62a_100020667443_100000034122 [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.125 O=[N+]([O-])CNc1ccccc1O 34a_100000185747_100000761209 [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.125 O=[N+]([O-])CSc1ccccc1O 62a_100000739446_100000761209 [0,2,0,0,0,0|2,0,0]=4 6721 B12R1.125 Oc1ccccc1NCC(F)F 34a_100000185747_100011934356 [0,2,0,0,0,0|1,0,1]=4 6722 B12R1.125 Oc1ccccc1OCC(F)F 271570a_203496583355_100000692002 [0,2,0,0,0,0|1,0,1]=4 6723 B12R1.125 Oc1ccccc1SCC(F)F 62a_100000739446_100011934356 [0,2,0,0,0,0|1,0,1]=4 6724 B12R1.125 Oc1ccccc1SCC(F)F 62a_100011934356_100000739446 [0,2,0,0,0,0|1,0,1]=4 6725 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Br 1458a_100000719032_200025704644 [0,2,0,0,0,0|1,0,1]=4 6726 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Cl 1458a_100000720304_200025704644 [0,2,0,0,0,0|1,0,1]=4 6727 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1F 1458a_100016256065_200025704644 [0,2,0,0,0,0|1,0,1]=4 6728 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [0,2,0,0,0,0|0,0,1]=3 6729 B12R1.125 [13CH3]C(=O)CCc1ccccc1Br 1458a_100000740810_200025704644 [0,2,0,0,0,0|1,0,1]=4 6730 B12R1.125 [13CH3]C(=O)CCc1ccccc1Cl 1458a_100000184300_200025704644 [0,2,0,0,0,0|1,0,1]=4 6731 B12R1.125 [13CH3]C(=O)CCc1ccccc1F 1458a_100000189703_200025704644 [0,2,0,0,0,0|1,0,1]=4 6732 B12R1.125 [13CH3]C(=O)CCc1ccccc1I 1458a_100000037306_200025704644 [0,2,0,0,0,0|1,0,1]=4 6733 B12R1.125 [13CH3]C(=O)CCc1ccccc1O 1458a_100000181328_200025704644 [0,2,0,0,0,0|0,0,1]=3 6734 B12R1.125 [13CH3]C(=O)COc1ccccc1Br 1458a_100000216496_200025704644 [0,2,0,0,0,0|1,0,1]=4 6735 B12R1.125 [13CH3]C(=O)COc1ccccc1Cl 1458a_100000185159_200025704644 [0,2,0,0,0,0|1,0,1]=4 6736 B12R1.125 [13CH3]C(=O)COc1ccccc1F 1458a_100000182486_200025704644 [0,2,0,0,0,0|1,0,1]=4 6737 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [0,2,0,0,0,0|0,0,1]=3 6738 B12R1.125 [13CH3]C(=O)CSc1ccccc1F 1458a_100000179528_200025704644 [0,2,0,0,0,0|1,0,1]=4 6739 B12R1.125 [13CH3]C(=O)CSc1ccccc1O 1458a_100000695322_200025704644 [0,2,0,0,0,0|0,0,1]=3 6740 B12R1.267 C#CCCNc1ccccc1O 34a_100000185747_100000688953 [0,2,0,0,0,0|0,0,2]=4 6741 B12R1.267 C#CCCSc1ccccc1O 62a_100000688953_100000739446 [0,2,0,0,0,0|0,0,2]=4 6742 B12R1.267 C#CCCSc1ccccc1O 62a_100000739446_100000688953 [0,2,0,0,0,0|0,0,2]=4 6743 B12R1.267 C#CCNCc1ccccc1O 34a_100000185550_100000184674 [0,2,0,0,0,0|0,0,2]=4 6744 B12R1.267 C/C=C/CNc1ccccc1Br 34a_100000210017_100102629194 [0,2,0,0,0,0|1,0,0]=3 6745 B12R1.267 C/C=C/CNc1ccccc1C 34a_100015192222_100102629194 [0,2,0,0,0,0|1,0,0]=3 6746 B12R1.267 C/C=C/CNc1ccccc1Cl 34a_100000185783_100102629194 [0,2,0,0,0,0|1,0,0]=3 6747 B12R1.267 C/C=C/CNc1ccccc1F 34a_100000210422_100102629194 [0,2,0,0,0,0|1,0,0]=3 6748 B12R1.267 C/C=C/CNc1ccccc1I 34a_100000210053_100102629194 [0,2,0,0,0,0|1,0,0]=3 6749 B12R1.267 C/C=C/CNc1ccccc1O 34a_100000185747_100102629194 [0,2,0,0,0,0|0,0,0]=2 6750 B12R1.267 C/C=C/COc1cccc[n+]1[O-] 7a_100000211761_100102629194 [0,2,0,0,0,0|1,0,1]=4 6751 B12R1.267 C/C=C/COc1ccccc1Br 34a_100000181306_100102629194 [0,2,0,0,0,0|1,0,0]=3 6752 B12R1.267 C/C=C/COc1ccccc1Br 7a_100000181306_100102629194 [0,2,0,0,0,0|1,0,0]=3 6753 B12R1.267 C/C=C/COc1ccccc1C 34a_100000210338_100102629194 [0,2,0,0,0,0|1,0,0]=3 6754 B12R1.267 C/C=C/COc1ccccc1C 7a_100000210338_100102629194 [0,2,0,0,0,0|1,0,0]=3 6755 B12R1.267 C/C=C/COc1ccccc1Cl 34a_100000210172_100102629194 [0,2,0,0,0,0|1,0,0]=3 6756 B12R1.267 C/C=C/COc1ccccc1Cl 7a_100000210172_100102629194 [0,2,0,0,0,0|1,0,0]=3 6757 B12R1.267 C/C=C/COc1ccccc1F 34a_100000210171_100102629194 [0,2,0,0,0,0|1,0,0]=3 6758 B12R1.267 C/C=C/COc1ccccc1F 7a_100000210171_100102629194 [0,2,0,0,0,0|1,0,0]=3 6759 B12R1.267 C/C=C/COc1ccccc1I 34a_100000739446_100102629194 [0,2,0,0,0,0|1,0,0]=3 6760 B12R1.267 C/C=C/COc1ccccc1I 7a_100000739446_100102629194 [0,2,0,0,0,0|1,0,0]=3 6761 B12R1.267 C/C=C/COc1ccccc1N 34a_100000185747_100102629194 [0,2,0,0,0,0|1,0,0]=3 6762 B12R1.267 C/C=C/COc1ccccc1N 7a_100000185747_100102629194 [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.267 C/C=C/COc1cccnc1Br 34a_100000744436_100102629194 [0,2,0,0,0,0|2,0,0]=4 6764 B12R1.267 C/C=C/COc1cccnc1Br 7a_100000744436_100102629194 [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.267 C/C=C/COc1cccnc1C 34a_100000745507_100102629194 [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.267 C/C=C/COc1cccnc1C 7a_100000745507_100102629194 [0,2,0,0,0,0|2,0,0]=4 6767 B12R1.267 C/C=C/COc1cccnc1Cl 34a_100000757616_100102629194 [0,2,0,0,0,0|2,0,0]=4 6768 B12R1.267 C/C=C/COc1cccnc1Cl 7a_100000757616_100102629194 [0,2,0,0,0,0|2,0,0]=4 6769 B12R1.267 C/C=C/COc1cccnc1F 34a_100000061740_100102629194 [0,2,0,0,0,0|2,0,0]=4 6770 B12R1.267 C/C=C/COc1cccnc1F 7a_100000061740_100102629194 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.267 C/C=C/COc1cccnc1I 34a_100000034122_100102629194 [0,2,0,0,0,0|2,0,0]=4 6772 B12R1.267 C/C=C/COc1cccnc1I 7a_100000034122_100102629194 [0,2,0,0,0,0|2,0,0]=4 6773 B12R1.267 C/C=C/COc1cccnc1N 34a_100000211975_100102629194 [0,2,0,0,0,0|2,0,0]=4 6774 B12R1.267 C/C=C/COc1cccnc1N 7a_100000211975_100102629194 [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.267 C/C=C/COc1cccoc1=O 34a_100000077404_100102629194 [0,2,0,0,0,0|1,0,1]=4 6776 B12R1.267 C/C=C/COc1cccoc1=O 7a_100000077404_100102629194 [0,2,0,0,0,0|1,0,1]=4 6777 B12R1.267 C/C=C/COc1ccncc1Br 34a_100011996408_100102629194 [0,2,0,0,0,0|2,0,0]=4 6778 B12R1.267 C/C=C/COc1ccncc1C 34a_100000694293_100102629194 [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.267 C/C=C/COc1ccncc1Cl 34a_100011997054_100102629194 [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.267 C/C=C/COc1ccncc1F 34a_200000081243_100102629194 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.267 C/C=C/COc1cnccc1C 34a_100011997053_100102629194 [0,2,0,0,0,0|2,0,0]=4 6782 B12R1.267 C/C=C/COc1cnccc1C 7a_100011997053_100102629194 [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.267 C/C=C/COc1cnccc1Cl 34a_100011996695_100102629194 [0,2,0,0,0,0|2,0,0]=4 6784 B12R1.267 C/C=C/COc1cnccc1I 34a_100000050107_100102629194 [0,2,0,0,0,0|2,0,0]=4 6785 B12R1.267 C/C=C/COc1cnccc1N 34a_100000753702_100102629194 [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.267 C/C=C/COc1coccc1=O 34a_100000060831_100102629194 [0,2,0,0,0,0|1,0,1]=4 6787 B12R1.267 C/C=C/COc1ncccc1Cl 34a_100011290957_100102629194 [0,2,0,0,0,0|2,0,0]=4 6788 B12R1.267 C/C=C/COc1ncccc1F 34a_100011219419_100102629194 [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.267 C/C=C/COc1ncccc1N 34a_100000746358_100102629194 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.267 C/C=C/CSc1c[nH]ccc1=O 62a_100009998708_100102629194 [0,2,0,0,0,0|1,0,1]=4 6791 B12R1.267 C/C=C/CSc1c[nH]ccc1=O 62a_100102629194_100009998708 [0,2,0,0,0,0|1,0,1]=4 6792 B12R1.267 C/C=C/CSc1c[nH]ccc1=S 62a_100102629194_200012280681 [0,2,0,0,0,0|1,1,0]=4 6793 B12R1.267 C/C=C/CSc1c[nH]ccc1=S 62a_200012280681_100102629194 [0,2,0,0,0,0|1,1,0]=4 6794 B12R1.267 C/C=C/CSc1cccc[n+]1C 62a_100102629194_100000212160 [0,2,0,0,0,0|2,0,0]=4 6795 B12R1.267 C/C=C/CSc1cccc[n+]1[O-] 62a_100102629194_200000042595 [0,2,0,0,0,0|1,0,1]=4 6796 B12R1.267 C/C=C/CSc1ccccc1Br 62a_100000695589_100102629194 [0,2,0,0,0,0|1,0,0]=3 6797 B12R1.267 C/C=C/CSc1ccccc1Br 62a_100102629194_100000695589 [0,2,0,0,0,0|1,0,0]=3 6798 B12R1.267 C/C=C/CSc1ccccc1C 62a_100000210755_100102629194 [0,2,0,0,0,0|1,0,0]=3 6799 B12R1.267 C/C=C/CSc1ccccc1C 62a_100102629194_100000210755 [0,2,0,0,0,0|1,0,0]=3 6800 B12R1.267 C/C=C/CSc1ccccc1Cl 62a_100000764095_100102629194 [0,2,0,0,0,0|1,0,0]=3 6801 B12R1.267 C/C=C/CSc1ccccc1Cl 62a_100102629194_100000764095 [0,2,0,0,0,0|1,0,0]=3 6802 B12R1.267 C/C=C/CSc1ccccc1F 62a_100011215700_100102629194 [0,2,0,0,0,0|1,0,0]=3 6803 B12R1.267 C/C=C/CSc1ccccc1F 62a_100102629194_100011215700 [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.267 C/C=C/CSc1ccccc1N 62a_100000210017_100102629194 [0,2,0,0,0,0|1,0,0]=3 6805 B12R1.267 C/C=C/CSc1ccccc1N 62a_100102629194_100000210017 [0,2,0,0,0,0|1,0,0]=3 6806 B12R1.267 C/C=C/CSc1ccccc1O 62a_100000739446_100102629194 [0,2,0,0,0,0|0,0,0]=2 6807 B12R1.267 C/C=C/CSc1ccccc1O 62a_100102629194_100000739446 [0,2,0,0,0,0|0,0,0]=2 6808 B12R1.267 C/C=C/CSc1cccnc1Br 62a_100010202626_100102629194 [0,2,0,0,0,0|2,0,0]=4 6809 B12R1.267 C/C=C/CSc1cccnc1Br 62a_100102629194_100010202626 [0,2,0,0,0,0|2,0,0]=4 6810 B12R1.267 C/C=C/CSc1cccnc1C 62a_100000751574_100102629194 [0,2,0,0,0,0|2,0,0]=4 6811 B12R1.267 C/C=C/CSc1cccnc1C 62a_100102629194_100000751574 [0,2,0,0,0,0|2,0,0]=4 6812 B12R1.267 C/C=C/CSc1cccnc1Cl 62a_100000036424_100102629194 [0,2,0,0,0,0|2,0,0]=4 6813 B12R1.267 C/C=C/CSc1cccnc1Cl 62a_100102629194_100000036424 [0,2,0,0,0,0|2,0,0]=4 6814 B12R1.267 C/C=C/CSc1cccnc1F 62a_100009816115_100102629194 [0,2,0,0,0,0|2,0,0]=4 6815 B12R1.267 C/C=C/CSc1cccnc1F 62a_100102629194_100009816115 [0,2,0,0,0,0|2,0,0]=4 6816 B12R1.267 C/C=C/CSc1cccnc1N 62a_100000045569_100102629194 [0,2,0,0,0,0|2,0,0]=4 6817 B12R1.267 C/C=C/CSc1cccnc1N 62a_100102629194_100000045569 [0,2,0,0,0,0|2,0,0]=4 6818 B12R1.267 C/C=C/CSc1cccnc1O 62a_100000760158_100102629194 [0,2,0,0,0,0|1,0,0]=3 6819 B12R1.267 C/C=C/CSc1cccnc1O 62a_100102629194_100000760158 [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.267 C/C=C/CSc1ccncc1Br 62a_100000726257_100102629194 [0,2,0,0,0,0|2,0,0]=4 6821 B12R1.267 C/C=C/CSc1ccncc1Br 62a_100102629194_100000726257 [0,2,0,0,0,0|2,0,0]=4 6822 B12R1.267 C/C=C/CSc1ccncc1C 62a_100000765111_100102629194 [0,2,0,0,0,0|2,0,0]=4 6823 B12R1.267 C/C=C/CSc1ccncc1C 62a_100102629194_100000765111 [0,2,0,0,0,0|2,0,0]=4 6824 B12R1.267 C/C=C/CSc1ccncc1Cl 62a_100000708259_100102629194 [0,2,0,0,0,0|2,0,0]=4 6825 B12R1.267 C/C=C/CSc1ccncc1Cl 62a_100102629194_100000708259 [0,2,0,0,0,0|2,0,0]=4 6826 B12R1.267 C/C=C/CSc1ccncc1F 62a_100000047030_100102629194 [0,2,0,0,0,0|2,0,0]=4 6827 B12R1.267 C/C=C/CSc1ccncc1F 62a_100102629194_100000047030 [0,2,0,0,0,0|2,0,0]=4 6828 B12R1.267 C/C=C/CSc1ccncc1N 62a_100000756074_100102629194 [0,2,0,0,0,0|2,0,0]=4 6829 B12R1.267 C/C=C/CSc1ccncc1N 62a_100102629194_100000756074 [0,2,0,0,0,0|2,0,0]=4 6830 B12R1.267 C/C=C/CSc1ccncc1O 62a_100009817591_100102629194 [0,2,0,0,0,0|1,0,0]=3 6831 B12R1.267 C/C=C/CSc1ccncc1O 62a_100102629194_100009817591 [0,2,0,0,0,0|1,0,0]=3 6832 B12R1.267 C/C=C/CSc1cnccc1Br 62a_100010138639_100102629194 [0,2,0,0,0,0|2,0,0]=4 6833 B12R1.267 C/C=C/CSc1cnccc1Br 62a_100102629194_100010138639 [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.267 C/C=C/CSc1cnccc1C 62a_100000761580_100102629194 [0,2,0,0,0,0|2,0,0]=4 6835 B12R1.267 C/C=C/CSc1cnccc1C 62a_100102629194_100000761580 [0,2,0,0,0,0|2,0,0]=4 6836 B12R1.267 C/C=C/CSc1cnccc1Cl 62a_100009995489_100102629194 [0,2,0,0,0,0|2,0,0]=4 6837 B12R1.267 C/C=C/CSc1cnccc1Cl 62a_100102629194_100009995489 [0,2,0,0,0,0|2,0,0]=4 6838 B12R1.267 C/C=C/CSc1cnccc1F 62a_100009820683_100102629194 [0,2,0,0,0,0|2,0,0]=4 6839 B12R1.267 C/C=C/CSc1cnccc1F 62a_100102629194_100009820683 [0,2,0,0,0,0|2,0,0]=4 6840 B12R1.267 C/C=C/CSc1cnccc1N 62a_100000047001_100102629194 [0,2,0,0,0,0|2,0,0]=4 6841 B12R1.267 C/C=C/CSc1cnccc1N 62a_100102629194_100000047001 [0,2,0,0,0,0|2,0,0]=4 6842 B12R1.267 C/C=C/CSc1cncnc1O 62a_100000751107_100102629194 [0,2,0,0,0,0|2,0,0]=4 6843 B12R1.267 C/C=C/CSc1cncnc1O 62a_100102629194_100000751107 [0,2,0,0,0,0|2,0,0]=4 6844 B12R1.267 C/C=C/CSc1ncccc1Br 62a_100000696092_100102629194 [0,2,0,0,0,0|2,0,0]=4 6845 B12R1.267 C/C=C/CSc1ncccc1Br 62a_100102629194_100000696092 [0,2,0,0,0,0|2,0,0]=4 6846 B12R1.267 C/C=C/CSc1ncccc1C 62a_100000751373_100102629194 [0,2,0,0,0,0|2,0,0]=4 6847 B12R1.267 C/C=C/CSc1ncccc1C 62a_100102629194_100000751373 [0,2,0,0,0,0|2,0,0]=4 6848 B12R1.267 C/C=C/CSc1ncccc1Cl 62a_100011356963_100102629194 [0,2,0,0,0,0|2,0,0]=4 6849 B12R1.267 C/C=C/CSc1ncccc1Cl 62a_100102629194_100011356963 [0,2,0,0,0,0|2,0,0]=4 6850 B12R1.267 C/C=C/CSc1ncccc1F 62a_100000685392_100102629194 [0,2,0,0,0,0|2,0,0]=4 6851 B12R1.267 C/C=C/CSc1ncccc1F 62a_100102629194_100000685392 [0,2,0,0,0,0|2,0,0]=4 6852 B12R1.267 C/C=C/CSc1ncccc1N 62a_100000688686_100102629194 [0,2,0,0,0,0|2,0,0]=4 6853 B12R1.267 C/C=C/CSc1ncccc1N 62a_100102629194_100000688686 [0,2,0,0,0,0|2,0,0]=4 6854 B12R1.267 C/C=C/CSc1ncccc1O 62a_100000034122_100102629194 [0,2,0,0,0,0|1,0,0]=3 6855 B12R1.267 C/C=C/CSc1ncccc1O 62a_100102629194_100000034122 [0,2,0,0,0,0|1,0,0]=3 6856 B12R1.267 C=CCCNc1ccccc1Br 34a_100000210017_100000754431 [0,2,0,0,0,0|1,0,0]=3 6857 B12R1.267 C=CCCNc1ccccc1C 34a_100015192222_100000754431 [0,2,0,0,0,0|1,0,0]=3 6858 B12R1.267 C=CCCNc1ccccc1Cl 34a_100000185783_100000754431 [0,2,0,0,0,0|1,0,0]=3 6859 B12R1.267 C=CCCNc1ccccc1F 34a_100000210422_100000754431 [0,2,0,0,0,0|1,0,0]=3 6860 B12R1.267 C=CCCNc1ccccc1I 34a_100000210053_100000754431 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.267 C=CCCNc1ccccc1O 34a_100000185747_100000754431 [0,2,0,0,0,0|0,0,0]=2 6862 B12R1.267 C=CCCNc1ccncc1Br 27a_100015191253_100000726257 [0,2,0,0,0,0|2,0,0]=4 6863 B12R1.267 C=CCCNc1ccncc1C 27a_100015191253_100000765111 [0,2,0,0,0,0|2,0,0]=4 6864 B12R1.267 C=CCCNc1ccncc1F 27a_100015191253_100000035921 [0,2,0,0,0,0|2,0,0]=4 6865 B12R1.267 C=CCCNc1ncccc1Br 27a_100015191253_100000696092 [0,2,0,0,0,0|2,0,0]=4 6866 B12R1.267 C=CCCOc1cccc[n+]1[O-] 7a_100000211761_100000754431 [0,2,0,0,0,0|1,0,1]=4 6867 B12R1.267 C=CCCOc1ccccc1Br 34a_100000181306_100000754431 [0,2,0,0,0,0|1,0,0]=3 6868 B12R1.267 C=CCCOc1ccccc1Br 7a_100000181306_100000754431 [0,2,0,0,0,0|1,0,0]=3 6869 B12R1.267 C=CCCOc1ccccc1C 34a_100000210338_100000754431 [0,2,0,0,0,0|1,0,0]=3 6870 B12R1.267 C=CCCOc1ccccc1C 7a_100000210338_100000754431 [0,2,0,0,0,0|1,0,0]=3 6871 B12R1.267 C=CCCOc1ccccc1Cl 34a_100000210172_100000754431 [0,2,0,0,0,0|1,0,0]=3 6872 B12R1.267 C=CCCOc1ccccc1Cl 7a_100000210172_100000754431 [0,2,0,0,0,0|1,0,0]=3 6873 B12R1.267 C=CCCOc1ccccc1F 34a_100000210171_100000754431 [0,2,0,0,0,0|1,0,0]=3 6874 B12R1.267 C=CCCOc1ccccc1F 7a_100000210171_100000754431 [0,2,0,0,0,0|1,0,0]=3 6875 B12R1.267 C=CCCOc1ccccc1I 34a_100000739446_100000754431 [0,2,0,0,0,0|1,0,0]=3 6876 B12R1.267 C=CCCOc1ccccc1I 7a_100000739446_100000754431 [0,2,0,0,0,0|1,0,0]=3 6877 B12R1.267 C=CCCOc1ccccc1N 34a_100000185747_100000754431 [0,2,0,0,0,0|1,0,0]=3 6878 B12R1.267 C=CCCOc1ccccc1N 7a_100000185747_100000754431 [0,2,0,0,0,0|1,0,0]=3 6879 B12R1.267 C=CCCOc1cccnc1Br 34a_100000744436_100000754431 [0,2,0,0,0,0|2,0,0]=4 6880 B12R1.267 C=CCCOc1cccnc1Br 7a_100000744436_100000754431 [0,2,0,0,0,0|2,0,0]=4 6881 B12R1.267 C=CCCOc1cccnc1C 34a_100000745507_100000754431 [0,2,0,0,0,0|2,0,0]=4 6882 B12R1.267 C=CCCOc1cccnc1C 7a_100000745507_100000754431 [0,2,0,0,0,0|2,0,0]=4 6883 B12R1.267 C=CCCOc1cccnc1Cl 34a_100000757616_100000754431 [0,2,0,0,0,0|2,0,0]=4 6884 B12R1.267 C=CCCOc1cccnc1Cl 7a_100000757616_100000754431 [0,2,0,0,0,0|2,0,0]=4 6885 B12R1.267 C=CCCOc1cccnc1F 34a_100000061740_100000754431 [0,2,0,0,0,0|2,0,0]=4 6886 B12R1.267 C=CCCOc1cccnc1F 7a_100000061740_100000754431 [0,2,0,0,0,0|2,0,0]=4 6887 B12R1.267 C=CCCOc1cccnc1I 34a_100000034122_100000754431 [0,2,0,0,0,0|2,0,0]=4 6888 B12R1.267 C=CCCOc1cccnc1I 7a_100000034122_100000754431 [0,2,0,0,0,0|2,0,0]=4 6889 B12R1.267 C=CCCOc1cccnc1N 34a_100000211975_100000754431 [0,2,0,0,0,0|2,0,0]=4 6890 B12R1.267 C=CCCOc1cccnc1N 7a_100000211975_100000754431 [0,2,0,0,0,0|2,0,0]=4 6891 B12R1.267 C=CCCOc1cccoc1=O 34a_100000077404_100000754431 [0,2,0,0,0,0|1,0,1]=4 6892 B12R1.267 C=CCCOc1cccoc1=O 7a_100000077404_100000754431 [0,2,0,0,0,0|1,0,1]=4 6893 B12R1.267 C=CCCOc1ccncc1Br 34a_100011996408_100000754431 [0,2,0,0,0,0|2,0,0]=4 6894 B12R1.267 C=CCCOc1ccncc1C 34a_100000694293_100000754431 [0,2,0,0,0,0|2,0,0]=4 6895 B12R1.267 C=CCCOc1ccncc1Cl 34a_100011997054_100000754431 [0,2,0,0,0,0|2,0,0]=4 6896 B12R1.267 C=CCCOc1ccncc1F 34a_200000081243_100000754431 [0,2,0,0,0,0|2,0,0]=4 6897 B12R1.267 C=CCCOc1cnccc1C 34a_100011997053_100000754431 [0,2,0,0,0,0|2,0,0]=4 6898 B12R1.267 C=CCCOc1cnccc1C 7a_100011997053_100000754431 [0,2,0,0,0,0|2,0,0]=4 6899 B12R1.267 C=CCCOc1cnccc1Cl 34a_100011996695_100000754431 [0,2,0,0,0,0|2,0,0]=4 6900 B12R1.267 C=CCCOc1cnccc1I 34a_100000050107_100000754431 [0,2,0,0,0,0|2,0,0]=4 6901 B12R1.267 C=CCCOc1cnccc1N 34a_100000753702_100000754431 [0,2,0,0,0,0|2,0,0]=4 6902 B12R1.267 C=CCCOc1coccc1=O 34a_100000060831_100000754431 [0,2,0,0,0,0|1,0,1]=4 6903 B12R1.267 C=CCCOc1ncccc1Cl 34a_100011290957_100000754431 [0,2,0,0,0,0|2,0,0]=4 6904 B12R1.267 C=CCCOc1ncccc1F 34a_100011219419_100000754431 [0,2,0,0,0,0|2,0,0]=4 6905 B12R1.267 C=CCCOc1ncccc1N 34a_100000746358_100000754431 [0,2,0,0,0,0|2,0,0]=4 6906 B12R1.267 C=CCCSc1c[nH]ccc1=O 62a_100000754431_100009998708 [0,2,0,0,0,0|1,0,1]=4 6907 B12R1.267 C=CCCSc1c[nH]ccc1=O 62a_100009998708_100000754431 [0,2,0,0,0,0|1,0,1]=4 6908 B12R1.267 C=CCCSc1c[nH]ccc1=S 62a_100000754431_200012280681 [0,2,0,0,0,0|1,1,0]=4 6909 B12R1.267 C=CCCSc1c[nH]ccc1=S 62a_200012280681_100000754431 [0,2,0,0,0,0|1,1,0]=4 6910 B12R1.267 C=CCCSc1cccc[n+]1C 62a_100000754431_100000212160 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.267 C=CCCSc1cccc[n+]1[O-] 62a_100000754431_200000042595 [0,2,0,0,0,0|1,0,1]=4 6912 B12R1.267 C=CCCSc1ccccc1Br 62a_100000695589_100000754431 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.267 C=CCCSc1ccccc1Br 62a_100000754431_100000695589 [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.267 C=CCCSc1ccccc1C 62a_100000210755_100000754431 [0,2,0,0,0,0|1,0,0]=3 6915 B12R1.267 C=CCCSc1ccccc1C 62a_100000754431_100000210755 [0,2,0,0,0,0|1,0,0]=3 6916 B12R1.267 C=CCCSc1ccccc1Cl 62a_100000754431_100000764095 [0,2,0,0,0,0|1,0,0]=3 6917 B12R1.267 C=CCCSc1ccccc1Cl 62a_100000764095_100000754431 [0,2,0,0,0,0|1,0,0]=3 6918 B12R1.267 C=CCCSc1ccccc1F 62a_100000754431_100011215700 [0,2,0,0,0,0|1,0,0]=3 6919 B12R1.267 C=CCCSc1ccccc1F 62a_100011215700_100000754431 [0,2,0,0,0,0|1,0,0]=3 6920 B12R1.267 C=CCCSc1ccccc1N 62a_100000210017_100000754431 [0,2,0,0,0,0|1,0,0]=3 6921 B12R1.267 C=CCCSc1ccccc1N 62a_100000754431_100000210017 [0,2,0,0,0,0|1,0,0]=3 6922 B12R1.267 C=CCCSc1ccccc1O 62a_100000739446_100000754431 [0,2,0,0,0,0|0,0,0]=2 6923 B12R1.267 C=CCCSc1ccccc1O 62a_100000754431_100000739446 [0,2,0,0,0,0|0,0,0]=2 6924 B12R1.267 C=CCCSc1cccnc1Br 62a_100000754431_100010202626 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.267 C=CCCSc1cccnc1Br 62a_100010202626_100000754431 [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.267 C=CCCSc1cccnc1C 62a_100000751574_100000754431 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.267 C=CCCSc1cccnc1C 62a_100000754431_100000751574 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.267 C=CCCSc1cccnc1Cl 62a_100000036424_100000754431 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.267 C=CCCSc1cccnc1Cl 62a_100000754431_100000036424 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.267 C=CCCSc1cccnc1F 62a_100000754431_100009816115 [0,2,0,0,0,0|2,0,0]=4 6931 B12R1.267 C=CCCSc1cccnc1F 62a_100009816115_100000754431 [0,2,0,0,0,0|2,0,0]=4 6932 B12R1.267 C=CCCSc1cccnc1N 62a_100000045569_100000754431 [0,2,0,0,0,0|2,0,0]=4 6933 B12R1.267 C=CCCSc1cccnc1N 62a_100000754431_100000045569 [0,2,0,0,0,0|2,0,0]=4 6934 B12R1.267 C=CCCSc1cccnc1O 62a_100000754431_100000760158 [0,2,0,0,0,0|1,0,0]=3 6935 B12R1.267 C=CCCSc1cccnc1O 62a_100000760158_100000754431 [0,2,0,0,0,0|1,0,0]=3 6936 B12R1.267 C=CCCSc1ccncc1Br 62a_100000726257_100000754431 [0,2,0,0,0,0|2,0,0]=4 6937 B12R1.267 C=CCCSc1ccncc1Br 62a_100000754431_100000726257 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.267 C=CCCSc1ccncc1C 62a_100000754431_100000765111 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.267 C=CCCSc1ccncc1C 62a_100000765111_100000754431 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.267 C=CCCSc1ccncc1Cl 62a_100000708259_100000754431 [0,2,0,0,0,0|2,0,0]=4 6941 B12R1.267 C=CCCSc1ccncc1Cl 62a_100000754431_100000708259 [0,2,0,0,0,0|2,0,0]=4 6942 B12R1.267 C=CCCSc1ccncc1F 62a_100000047030_100000754431 [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.267 C=CCCSc1ccncc1F 62a_100000754431_100000047030 [0,2,0,0,0,0|2,0,0]=4 6944 B12R1.267 C=CCCSc1ccncc1N 62a_100000754431_100000756074 [0,2,0,0,0,0|2,0,0]=4 6945 B12R1.267 C=CCCSc1ccncc1N 62a_100000756074_100000754431 [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.267 C=CCCSc1ccncc1O 62a_100000754431_100009817591 [0,2,0,0,0,0|1,0,0]=3 6947 B12R1.267 C=CCCSc1ccncc1O 62a_100009817591_100000754431 [0,2,0,0,0,0|1,0,0]=3 6948 B12R1.267 C=CCCSc1cnccc1Br 62a_100000754431_100010138639 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.267 C=CCCSc1cnccc1Br 62a_100010138639_100000754431 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.267 C=CCCSc1cnccc1C 62a_100000754431_100000761580 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.267 C=CCCSc1cnccc1C 62a_100000761580_100000754431 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.267 C=CCCSc1cnccc1Cl 62a_100000754431_100009995489 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.267 C=CCCSc1cnccc1Cl 62a_100009995489_100000754431 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.267 C=CCCSc1cnccc1F 62a_100000754431_100009820683 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.267 C=CCCSc1cnccc1F 62a_100009820683_100000754431 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.267 C=CCCSc1cnccc1N 62a_100000047001_100000754431 [0,2,0,0,0,0|2,0,0]=4 6957 B12R1.267 C=CCCSc1cnccc1N 62a_100000754431_100000047001 [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.267 C=CCCSc1cncnc1O 62a_100000751107_100000754431 [0,2,0,0,0,0|2,0,0]=4 6959 B12R1.267 C=CCCSc1cncnc1O 62a_100000754431_100000751107 [0,2,0,0,0,0|2,0,0]=4 6960 B12R1.267 C=CCCSc1ncccc1Br 62a_100000696092_100000754431 [0,2,0,0,0,0|2,0,0]=4 6961 B12R1.267 C=CCCSc1ncccc1Br 62a_100000754431_100000696092 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.267 C=CCCSc1ncccc1C 62a_100000751373_100000754431 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.267 C=CCCSc1ncccc1C 62a_100000754431_100000751373 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.267 C=CCCSc1ncccc1Cl 62a_100000754431_100011356963 [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.267 C=CCCSc1ncccc1Cl 62a_100011356963_100000754431 [0,2,0,0,0,0|2,0,0]=4 6966 B12R1.267 C=CCCSc1ncccc1F 62a_100000685392_100000754431 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.267 C=CCCSc1ncccc1F 62a_100000754431_100000685392 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.267 C=CCCSc1ncccc1N 62a_100000688686_100000754431 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.267 C=CCCSc1ncccc1N 62a_100000754431_100000688686 [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.267 C=CCCSc1ncccc1O 62a_100000034122_100000754431 [0,2,0,0,0,0|1,0,0]=3 6971 B12R1.267 C=CCCSc1ncccc1O 62a_100000754431_100000034122 [0,2,0,0,0,0|1,0,0]=3 6972 B12R1.267 C=CCNCc1ccccc1Br 2230a_100000689332_100000210623 [0,2,0,0,0,0|1,0,0]=3 6973 B12R1.267 C=CCNCc1ccccc1Br 2230a_100020586998_100000184730 [0,2,0,0,0,0|1,0,0]=3 6974 B12R1.267 C=CCNCc1ccccc1Br 270004a_100020586998_100000211189 [0,2,0,0,0,0|1,0,0]=3 6975 B12R1.267 C=CCNCc1ccccc1Br 34a_100000689332_100015514636 [0,2,0,0,0,0|1,0,0]=3 6976 B12R1.267 C=CCNCc1ccccc1C 2230a_100020586998_100000211839 [0,2,0,0,0,0|1,0,0]=3 6977 B12R1.267 C=CCNCc1ccccc1C 270004a_100020586998_100000211143 [0,2,0,0,0,0|1,0,0]=3 6978 B12R1.267 C=CCNCc1ccccc1C 34a_100000174972_100015514636 [0,2,0,0,0,0|1,0,0]=3 6979 B12R1.267 C=CCNCc1ccccc1Cl 2230a_100000174879_100000210623 [0,2,0,0,0,0|1,0,0]=3 6980 B12R1.267 C=CCNCc1ccccc1Cl 2230a_100020586998_100000187162 [0,2,0,0,0,0|1,0,0]=3 6981 B12R1.267 C=CCNCc1ccccc1Cl 270004a_100020586998_100000210073 [0,2,0,0,0,0|1,0,0]=3 6982 B12R1.267 C=CCNCc1ccccc1Cl 34a_100000174879_100015514636 [0,2,0,0,0,0|1,0,0]=3 6983 B12R1.267 C=CCNCc1ccccc1F 2230a_100020586998_100000211605 [0,2,0,0,0,0|1,0,0]=3 6984 B12R1.267 C=CCNCc1ccccc1F 270004a_100020586998_100000210811 [0,2,0,0,0,0|1,0,0]=3 6985 B12R1.267 C=CCNCc1ccccc1F 34a_100000174869_100015514636 [0,2,0,0,0,0|1,0,0]=3 6986 B12R1.267 C=CCNCc1ccccc1I 2230a_100020586998_100011215278 [0,2,0,0,0,0|1,0,0]=3 6987 B12R1.267 C=CCNCc1ccccc1I 270004a_100020586998_100000010305 [0,2,0,0,0,0|1,0,0]=3 6988 B12R1.267 C=CCNCc1ccccc1O 34a_100000185550_100015514636 [0,2,0,0,0,0|0,0,0]=2 6989 B12R1.267 C=CCNCc1cccnc1Br 2230a_100009818023_100000210623 [0,2,0,0,0,0|2,0,0]=4 6990 B12R1.267 C=CCNCc1cccnc1Br 2230a_100020586998_100010140945 [0,2,0,0,0,0|2,0,0]=4 6991 B12R1.267 C=CCNCc1cccnc1Br 34a_100009818023_100015514636 [0,2,0,0,0,0|2,0,0]=4 6992 B12R1.267 C=CCNCc1cccnc1C 2230a_100020586998_100000732876 [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.267 C=CCNCc1cccnc1C 270004a_100020586998_100000751968 [0,2,0,0,0,0|2,0,0]=4 6994 B12R1.267 C=CCNCc1cccnc1Cl 2230a_100015189234_100000210623 [0,2,0,0,0,0|2,0,0]=4 6995 B12R1.267 C=CCNCc1cccnc1Cl 2230a_100020586998_100000045678 [0,2,0,0,0,0|2,0,0]=4 6996 B12R1.267 C=CCNCc1cccnc1Cl 34a_100015189234_100015514636 [0,2,0,0,0,0|2,0,0]=4 6997 B12R1.267 C=CCNCc1cccnc1F 2230a_100020586998_100000099810 [0,2,0,0,0,0|2,0,0]=4 6998 B12R1.267 C=CCNCc1cccnc1F 34a_100000724633_100015514636 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.267 C=CCNCc1cccnc1O 270004a_100020586998_100011998315 [0,2,0,0,0,0|1,0,0]=3 7000 B12R1.267 C=CCNCc1ccncc1Br 270004a_100020586998_100000755692 [0,2,0,0,0,0|2,0,0]=4 7001 B12R1.267 C=CCNCc1ccncc1C 2230a_100020586998_100020672808 [0,2,0,0,0,0|2,0,0]=4 7002 B12R1.267 C=CCNCc1ccncc1Cl 2230a_100020586998_100000763264 [0,2,0,0,0,0|2,0,0]=4 7003 B12R1.267 C=CCNCc1ccncc1Cl 270004a_100020586998_100011934409 [0,2,0,0,0,0|2,0,0]=4 7004 B12R1.267 C=CCNCc1ccncc1F 34a_100011935246_100015514636 [0,2,0,0,0,0|2,0,0]=4 7005 B12R1.267 C=CCNCc1cnccc1Br 270004a_100020586998_100009816821 [0,2,0,0,0,0|2,0,0]=4 7006 B12R1.267 C=CCNCc1cnccc1C 2230a_100020586998_100000690890 [0,2,0,0,0,0|2,0,0]=4 7007 B12R1.267 C=CCNCc1cnccc1C 270004a_100020586998_100000685662 [0,2,0,0,0,0|2,0,0]=4 7008 B12R1.267 C=CCNCc1cnccc1Cl 270004a_100020586998_100000050567 [0,2,0,0,0,0|2,0,0]=4 7009 B12R1.267 C=CCNCc1ncccc1Br 2230a_100020586998_100025702911 [0,2,0,0,0,0|2,0,0]=4 7010 B12R1.267 C=CCNCc1ncccc1Br 270004a_100020586998_100011934733 [0,2,0,0,0,0|2,0,0]=4 7011 B12R1.267 C=CCNCc1ncccc1C 2230a_100020586998_100000696600 [0,2,0,0,0,0|2,0,0]=4 7012 B12R1.267 C=CCNCc1ncccc1C 270004a_100020586998_100000698913 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.267 C=CCNCc1ncccc1C 34a_100011223789_100015514636 [0,2,0,0,0,0|2,0,0]=4 7014 B12R1.267 C=CCNCc1ncccc1Cl 2230a_100015189233_100000210623 [0,2,0,0,0,0|2,0,0]=4 7015 B12R1.267 C=CCNCc1ncccc1Cl 2230a_100020586998_100000099807 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.267 C=CCNCc1ncccc1Cl 270004a_100020586998_100012001307 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.267 C=CCNCc1ncccc1F 2230a_100020586998_100000104219 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.267 C=CCNCc1ncccc1F 270004a_100020586998_100011934734 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.267 C=CCNCc1ncccc1F 34a_100000690088_100015514636 [0,2,0,0,0,0|2,0,0]=4 7020 B12R1.267 C=CCOCc1ccccc1Br 34a_100000756307_100015514636 [0,2,0,0,0,0|1,0,0]=3 7021 B12R1.267 C=CCOCc1ccccc1Br 34a_200000210373_100000184730 [0,2,0,0,0,0|1,0,0]=3 7022 B12R1.267 C=CCOCc1ccccc1Br 7a_100000756307_100015514636 [0,2,0,0,0,0|1,0,0]=3 7023 B12R1.267 C=CCOCc1ccccc1C 34a_100000698903_100015514636 [0,2,0,0,0,0|1,0,0]=3 7024 B12R1.267 C=CCOCc1ccccc1C 34a_200000210373_100000211839 [0,2,0,0,0,0|1,0,0]=3 7025 B12R1.267 C=CCOCc1ccccc1C 7a_100000698903_100015514636 [0,2,0,0,0,0|1,0,0]=3 7026 B12R1.267 C=CCOCc1ccccc1Cl 34a_100000210847_100015514636 [0,2,0,0,0,0|1,0,0]=3 7027 B12R1.267 C=CCOCc1ccccc1Cl 34a_200000210373_100000187162 [0,2,0,0,0,0|1,0,0]=3 7028 B12R1.267 C=CCOCc1ccccc1Cl 7a_100000210847_100015514636 [0,2,0,0,0,0|1,0,0]=3 7029 B12R1.267 C=CCOCc1ccccc1F 34a_100000211962_100015514636 [0,2,0,0,0,0|1,0,0]=3 7030 B12R1.267 C=CCOCc1ccccc1F 34a_200000210373_100000211605 [0,2,0,0,0,0|1,0,0]=3 7031 B12R1.267 C=CCOCc1ccccc1F 7a_100000211962_100015514636 [0,2,0,0,0,0|1,0,0]=3 7032 B12R1.267 C=CCOCc1ccccc1I 34a_100000187465_100015514636 [0,2,0,0,0,0|1,0,0]=3 7033 B12R1.267 C=CCOCc1ccccc1I 34a_200000210373_100011215278 [0,2,0,0,0,0|1,0,0]=3 7034 B12R1.267 C=CCOCc1ccccc1I 7a_100000187465_100015514636 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.267 C=CCOCc1ccccc1N 34a_100000212039_100015514636 [0,2,0,0,0,0|1,0,0]=3 7036 B12R1.267 C=CCOCc1cccnc1Br 34a_100000719692_100015514636 [0,2,0,0,0,0|2,0,0]=4 7037 B12R1.267 C=CCOCc1cccnc1Br 34a_200000210373_100010140945 [0,2,0,0,0,0|2,0,0]=4 7038 B12R1.267 C=CCOCc1cccnc1Br 7a_100000719692_100015514636 [0,2,0,0,0,0|2,0,0]=4 7039 B12R1.267 C=CCOCc1cccnc1C 34a_100000729262_100015514636 [0,2,0,0,0,0|2,0,0]=4 7040 B12R1.267 C=CCOCc1cccnc1C 34a_200000210373_100000732876 [0,2,0,0,0,0|2,0,0]=4 7041 B12R1.267 C=CCOCc1cccnc1C 7a_100000729262_100015514636 [0,2,0,0,0,0|2,0,0]=4 7042 B12R1.267 C=CCOCc1cccnc1Cl 34a_100000748726_100015514636 [0,2,0,0,0,0|2,0,0]=4 7043 B12R1.267 C=CCOCc1cccnc1Cl 34a_200000210373_100000045678 [0,2,0,0,0,0|2,0,0]=4 7044 B12R1.267 C=CCOCc1cccnc1Cl 7a_100000748726_100015514636 [0,2,0,0,0,0|2,0,0]=4 7045 B12R1.267 C=CCOCc1cccnc1F 34a_100000079888_100015514636 [0,2,0,0,0,0|2,0,0]=4 7046 B12R1.267 C=CCOCc1cccnc1F 34a_200000210373_100000099810 [0,2,0,0,0,0|2,0,0]=4 7047 B12R1.267 C=CCOCc1cccnc1F 7a_100000079888_100015514636 [0,2,0,0,0,0|2,0,0]=4 7048 B12R1.267 C=CCOCc1ccncc1C 34a_100011997032_100015514636 [0,2,0,0,0,0|2,0,0]=4 7049 B12R1.267 C=CCOCc1ccncc1C 34a_200000210373_100020672809 [0,2,0,0,0,0|2,0,0]=4 7050 B12R1.267 C=CCOCc1ccncc1F 34a_100012172863_100015514636 [0,2,0,0,0,0|2,0,0]=4 7051 B12R1.267 C=CCOCc1cnccc1C 34a_100011996381_100015514636 [0,2,0,0,0,0|2,0,0]=4 7052 B12R1.267 C=CCOCc1cnccc1C 34a_200000210373_100000690890 [0,2,0,0,0,0|2,0,0]=4 7053 B12R1.267 C=CCOCc1cnccc1Cl 34a_100000117392_100015514636 [0,2,0,0,0,0|2,0,0]=4 7054 B12R1.267 C=CCOCc1ncccc1Br 34a_100011996772_100015514636 [0,2,0,0,0,0|2,0,0]=4 7055 B12R1.267 C=CCOCc1ncccc1Br 34a_200000210373_100025702911 [0,2,0,0,0,0|2,0,0]=4 7056 B12R1.267 C=CCOCc1ncccc1C 34a_100000698912_100015514636 [0,2,0,0,0,0|2,0,0]=4 7057 B12R1.267 C=CCOCc1ncccc1C 34a_200000210373_100000696600 [0,2,0,0,0,0|2,0,0]=4 7058 B12R1.267 C=CCOCc1ncccc1Cl 34a_100012002383_100015514636 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.267 C=CCOCc1ncccc1F 34a_100011934865_100015514636 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.267 C=CCOCc1ncccc1F 34a_200000210373_100000104219 [0,2,0,0,0,0|2,0,0]=4 7061 B12R1.267 C=CCOCc1ncccc1N 34a_114873767017_100015514636 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.267 C=CCOCc1ncccc1O 34a_200000210373_200020655725 [0,2,0,0,0,0|1,0,0]=3 7063 B12R1.267 C=CCSCc1ccccc1Br 62a_100000184730_100000210623 [0,2,0,0,0,0|1,0,0]=3 7064 B12R1.267 C=CCSCc1ccccc1Br 62a_100000210623_100000184730 [0,2,0,0,0,0|1,0,0]=3 7065 B12R1.267 C=CCSCc1ccccc1C 62a_100000210623_100000211839 [0,2,0,0,0,0|1,0,0]=3 7066 B12R1.267 C=CCSCc1ccccc1C 62a_100000211839_100000210623 [0,2,0,0,0,0|1,0,0]=3 7067 B12R1.267 C=CCSCc1ccccc1Cl 62a_100000187162_100000210623 [0,2,0,0,0,0|1,0,0]=3 7068 B12R1.267 C=CCSCc1ccccc1Cl 62a_100000210623_100000187162 [0,2,0,0,0,0|1,0,0]=3 7069 B12R1.267 C=CCSCc1ccccc1F 62a_100000210623_100000211605 [0,2,0,0,0,0|1,0,0]=3 7070 B12R1.267 C=CCSCc1ccccc1F 62a_100000211605_100000210623 [0,2,0,0,0,0|1,0,0]=3 7071 B12R1.267 C=CCSCc1ccccc1I 62a_100000210623_100011216222 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.267 C=CCSCc1ccccc1I 62a_100011216222_100000210623 [0,2,0,0,0,0|1,0,0]=3 7073 B12R1.267 C=CCSCc1cccnc1Br 62a_100000210623_100010140945 [0,2,0,0,0,0|2,0,0]=4 7074 B12R1.267 C=CCSCc1cccnc1Br 62a_100010140945_100000210623 [0,2,0,0,0,0|2,0,0]=4 7075 B12R1.267 C=CCSCc1cccnc1C 62a_100000210623_100000732876 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.267 C=CCSCc1cccnc1C 62a_100000732876_100000210623 [0,2,0,0,0,0|2,0,0]=4 7077 B12R1.267 C=CCSCc1cccnc1Cl 62a_100000045678_100000210623 [0,2,0,0,0,0|2,0,0]=4 7078 B12R1.267 C=CCSCc1cccnc1Cl 62a_100000210623_100000045678 [0,2,0,0,0,0|2,0,0]=4 7079 B12R1.267 C=CCSCc1cccnc1F 62a_100000099810_100000210623 [0,2,0,0,0,0|2,0,0]=4 7080 B12R1.267 C=CCSCc1cccnc1F 62a_100000210623_100000099810 [0,2,0,0,0,0|2,0,0]=4 7081 B12R1.267 C=CCSCc1ccncc1C 62a_100000210623_100020672808 [0,2,0,0,0,0|2,0,0]=4 7082 B12R1.267 C=CCSCc1ccncc1C 62a_100020672808_100000210623 [0,2,0,0,0,0|2,0,0]=4 7083 B12R1.267 C=CCSCc1ccncc1Cl 62a_100000210623_100000763264 [0,2,0,0,0,0|2,0,0]=4 7084 B12R1.267 C=CCSCc1ccncc1Cl 62a_100000763264_100000210623 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.267 C=CCSCc1cnccc1C 62a_100000210623_100000690890 [0,2,0,0,0,0|2,0,0]=4 7086 B12R1.267 C=CCSCc1cnccc1C 62a_100000690890_100000210623 [0,2,0,0,0,0|2,0,0]=4 7087 B12R1.267 C=CCSCc1ncccc1Br 62a_100000210623_100025702911 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.267 C=CCSCc1ncccc1Br 62a_100025702911_100000210623 [0,2,0,0,0,0|2,0,0]=4 7089 B12R1.267 C=CCSCc1ncccc1C 62a_100000210623_100000696600 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.267 C=CCSCc1ncccc1C 62a_100000696600_100000210623 [0,2,0,0,0,0|2,0,0]=4 7091 B12R1.267 C=CCSCc1ncccc1Cl 62a_100000099807_100000210623 [0,2,0,0,0,0|2,0,0]=4 7092 B12R1.267 C=CCSCc1ncccc1Cl 62a_100000210623_100000099807 [0,2,0,0,0,0|2,0,0]=4 7093 B12R1.267 C=CCSCc1ncccc1F 62a_100000104219_100000210623 [0,2,0,0,0,0|2,0,0]=4 7094 B12R1.267 C=CCSCc1ncccc1F 62a_100000210623_100000104219 [0,2,0,0,0,0|2,0,0]=4 7095 B12R1.267 C=CCSCc1ncccc1O 62a_100000210623_200020655725 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.267 C=CCSCc1ncccc1O 62a_200020655725_100000210623 [0,2,0,0,0,0|1,0,0]=3 7097 B12R1.267 CC#CCNc1ccccc1O 34a_100000185747_100000748600 [0,2,0,0,0,0|0,0,2]=4 7098 B12R1.267 CC#CCSc1ccccc1O 62a_100000739446_100000748600 [0,2,0,0,0,0|0,0,2]=4 7099 B12R1.267 CC#CCSc1ccccc1O 62a_100000748600_100000739446 [0,2,0,0,0,0|0,0,2]=4 7100 B12R1.267 CC=CCNc1ccccc1Br 34a_100000210017_100000070051 [0,2,0,0,0,0|1,0,0]=3 7101 B12R1.267 CC=CCNc1ccccc1C 34a_100015192222_100000070051 [0,2,0,0,0,0|1,0,0]=3 7102 B12R1.267 CC=CCNc1ccccc1Cl 34a_100000185783_100000070051 [0,2,0,0,0,0|1,0,0]=3 7103 B12R1.267 CC=CCNc1ccccc1F 34a_100000210422_100000070051 [0,2,0,0,0,0|1,0,0]=3 7104 B12R1.267 CC=CCNc1ccccc1I 34a_100000210053_100000070051 [0,2,0,0,0,0|1,0,0]=3 7105 B12R1.267 CC=CCNc1ccccc1O 34a_100000185747_100000070051 [0,2,0,0,0,0|0,0,0]=2 7106 B12R1.267 CC=CCOc1cccc[n+]1[O-] 7a_100000211761_100000070051 [0,2,0,0,0,0|1,0,1]=4 7107 B12R1.267 CC=CCOc1ccccc1Br 34a_100000181306_100000070051 [0,2,0,0,0,0|1,0,0]=3 7108 B12R1.267 CC=CCOc1ccccc1Br 7a_100000181306_100000070051 [0,2,0,0,0,0|1,0,0]=3 7109 B12R1.267 CC=CCOc1ccccc1C 34a_100000210338_100000070051 [0,2,0,0,0,0|1,0,0]=3 7110 B12R1.267 CC=CCOc1ccccc1C 7a_100000210338_100000070051 [0,2,0,0,0,0|1,0,0]=3 7111 B12R1.267 CC=CCOc1ccccc1Cl 34a_100000210172_100000070051 [0,2,0,0,0,0|1,0,0]=3 7112 B12R1.267 CC=CCOc1ccccc1Cl 7a_100000210172_100000070051 [0,2,0,0,0,0|1,0,0]=3 7113 B12R1.267 CC=CCOc1ccccc1F 34a_100000210171_100000070051 [0,2,0,0,0,0|1,0,0]=3 7114 B12R1.267 CC=CCOc1ccccc1F 7a_100000210171_100000070051 [0,2,0,0,0,0|1,0,0]=3 7115 B12R1.267 CC=CCOc1ccccc1I 34a_100000739446_100000070051 [0,2,0,0,0,0|1,0,0]=3 7116 B12R1.267 CC=CCOc1ccccc1I 7a_100000739446_100000070051 [0,2,0,0,0,0|1,0,0]=3 7117 B12R1.267 CC=CCOc1ccccc1N 34a_100000185747_100000070051 [0,2,0,0,0,0|1,0,0]=3 7118 B12R1.267 CC=CCOc1ccccc1N 7a_100000185747_100000070051 [0,2,0,0,0,0|1,0,0]=3 7119 B12R1.267 CC=CCOc1cccnc1Br 34a_100000744436_100000070051 [0,2,0,0,0,0|2,0,0]=4 7120 B12R1.267 CC=CCOc1cccnc1Br 7a_100000744436_100000070051 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.267 CC=CCOc1cccnc1C 34a_100000745507_100000070051 [0,2,0,0,0,0|2,0,0]=4 7122 B12R1.267 CC=CCOc1cccnc1C 7a_100000745507_100000070051 [0,2,0,0,0,0|2,0,0]=4 7123 B12R1.267 CC=CCOc1cccnc1Cl 34a_100000757616_100000070051 [0,2,0,0,0,0|2,0,0]=4 7124 B12R1.267 CC=CCOc1cccnc1Cl 7a_100000757616_100000070051 [0,2,0,0,0,0|2,0,0]=4 7125 B12R1.267 CC=CCOc1cccnc1F 34a_100000061740_100000070051 [0,2,0,0,0,0|2,0,0]=4 7126 B12R1.267 CC=CCOc1cccnc1F 7a_100000061740_100000070051 [0,2,0,0,0,0|2,0,0]=4 7127 B12R1.267 CC=CCOc1cccnc1I 34a_100000034122_100000070051 [0,2,0,0,0,0|2,0,0]=4 7128 B12R1.267 CC=CCOc1cccnc1I 7a_100000034122_100000070051 [0,2,0,0,0,0|2,0,0]=4 7129 B12R1.267 CC=CCOc1cccnc1N 34a_100000211975_100000070051 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.267 CC=CCOc1cccnc1N 7a_100000211975_100000070051 [0,2,0,0,0,0|2,0,0]=4 7131 B12R1.267 CC=CCOc1cccoc1=O 34a_100000077404_100000070051 [0,2,0,0,0,0|1,0,1]=4 7132 B12R1.267 CC=CCOc1cccoc1=O 7a_100000077404_100000070051 [0,2,0,0,0,0|1,0,1]=4 7133 B12R1.267 CC=CCOc1ccncc1Br 34a_100011996408_100000070051 [0,2,0,0,0,0|2,0,0]=4 7134 B12R1.267 CC=CCOc1ccncc1C 34a_100000694293_100000070051 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.267 CC=CCOc1ccncc1Cl 34a_100011997054_100000070051 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.267 CC=CCOc1ccncc1F 34a_200000081243_100000070051 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.267 CC=CCOc1cnccc1C 34a_100011997053_100000070051 [0,2,0,0,0,0|2,0,0]=4 7138 B12R1.267 CC=CCOc1cnccc1C 7a_100011997053_100000070051 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.267 CC=CCOc1cnccc1Cl 34a_100011996695_100000070051 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.267 CC=CCOc1cnccc1I 34a_100000050107_100000070051 [0,2,0,0,0,0|2,0,0]=4 7141 B12R1.267 CC=CCOc1cnccc1N 34a_100000753702_100000070051 [0,2,0,0,0,0|2,0,0]=4 7142 B12R1.267 CC=CCOc1coccc1=O 34a_100000060831_100000070051 [0,2,0,0,0,0|1,0,1]=4 7143 B12R1.267 CC=CCOc1ncccc1Cl 34a_100011290957_100000070051 [0,2,0,0,0,0|2,0,0]=4 7144 B12R1.267 CC=CCOc1ncccc1F 34a_100011219419_100000070051 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.267 CC=CCOc1ncccc1N 34a_100000746358_100000070051 [0,2,0,0,0,0|2,0,0]=4 7146 B12R1.267 CC=CCSc1c[nH]ccc1=O 62a_100000070051_100009998708 [0,2,0,0,0,0|1,0,1]=4 7147 B12R1.267 CC=CCSc1c[nH]ccc1=O 62a_100009998708_100000070051 [0,2,0,0,0,0|1,0,1]=4 7148 B12R1.267 CC=CCSc1c[nH]ccc1=S 62a_100000070051_200012280681 [0,2,0,0,0,0|1,1,0]=4 7149 B12R1.267 CC=CCSc1c[nH]ccc1=S 62a_200012280681_100000070051 [0,2,0,0,0,0|1,1,0]=4 7150 B12R1.267 CC=CCSc1cccc[n+]1C 62a_100000070051_100000212160 [0,2,0,0,0,0|2,0,0]=4 7151 B12R1.267 CC=CCSc1cccc[n+]1[O-] 62a_100000070051_200000042595 [0,2,0,0,0,0|1,0,1]=4 7152 B12R1.267 CC=CCSc1ccccc1Br 62a_100000070051_100000695589 [0,2,0,0,0,0|1,0,0]=3 7153 B12R1.267 CC=CCSc1ccccc1Br 62a_100000695589_100000070051 [0,2,0,0,0,0|1,0,0]=3 7154 B12R1.267 CC=CCSc1ccccc1C 62a_100000070051_100000210755 [0,2,0,0,0,0|1,0,0]=3 7155 B12R1.267 CC=CCSc1ccccc1C 62a_100000210755_100000070051 [0,2,0,0,0,0|1,0,0]=3 7156 B12R1.267 CC=CCSc1ccccc1Cl 62a_100000070051_100000764095 [0,2,0,0,0,0|1,0,0]=3 7157 B12R1.267 CC=CCSc1ccccc1Cl 62a_100000764095_100000070051 [0,2,0,0,0,0|1,0,0]=3 7158 B12R1.267 CC=CCSc1ccccc1F 62a_100000070051_100011215700 [0,2,0,0,0,0|1,0,0]=3 7159 B12R1.267 CC=CCSc1ccccc1F 62a_100011215700_100000070051 [0,2,0,0,0,0|1,0,0]=3 7160 B12R1.267 CC=CCSc1ccccc1N 62a_100000070051_100000210017 [0,2,0,0,0,0|1,0,0]=3 7161 B12R1.267 CC=CCSc1ccccc1N 62a_100000210017_100000070051 [0,2,0,0,0,0|1,0,0]=3 7162 B12R1.267 CC=CCSc1ccccc1O 62a_100000070051_100000739446 [0,2,0,0,0,0|0,0,0]=2 7163 B12R1.267 CC=CCSc1ccccc1O 62a_100000739446_100000070051 [0,2,0,0,0,0|0,0,0]=2 7164 B12R1.267 CC=CCSc1cccnc1Br 62a_100000070051_100010202626 [0,2,0,0,0,0|2,0,0]=4 7165 B12R1.267 CC=CCSc1cccnc1Br 62a_100010202626_100000070051 [0,2,0,0,0,0|2,0,0]=4 7166 B12R1.267 CC=CCSc1cccnc1C 62a_100000070051_100000751574 [0,2,0,0,0,0|2,0,0]=4 7167 B12R1.267 CC=CCSc1cccnc1C 62a_100000751574_100000070051 [0,2,0,0,0,0|2,0,0]=4 7168 B12R1.267 CC=CCSc1cccnc1Cl 62a_100000036424_100000070051 [0,2,0,0,0,0|2,0,0]=4 7169 B12R1.267 CC=CCSc1cccnc1Cl 62a_100000070051_100000036424 [0,2,0,0,0,0|2,0,0]=4 7170 B12R1.267 CC=CCSc1cccnc1F 62a_100000070051_100009816115 [0,2,0,0,0,0|2,0,0]=4 7171 B12R1.267 CC=CCSc1cccnc1F 62a_100009816115_100000070051 [0,2,0,0,0,0|2,0,0]=4 7172 B12R1.267 CC=CCSc1cccnc1N 62a_100000045569_100000070051 [0,2,0,0,0,0|2,0,0]=4 7173 B12R1.267 CC=CCSc1cccnc1N 62a_100000070051_100000045569 [0,2,0,0,0,0|2,0,0]=4 7174 B12R1.267 CC=CCSc1cccnc1O 62a_100000070051_100000760158 [0,2,0,0,0,0|1,0,0]=3 7175 B12R1.267 CC=CCSc1cccnc1O 62a_100000760158_100000070051 [0,2,0,0,0,0|1,0,0]=3 7176 B12R1.267 CC=CCSc1ccncc1Br 62a_100000070051_100000726257 [0,2,0,0,0,0|2,0,0]=4 7177 B12R1.267 CC=CCSc1ccncc1Br 62a_100000726257_100000070051 [0,2,0,0,0,0|2,0,0]=4 7178 B12R1.267 CC=CCSc1ccncc1C 62a_100000070051_100000765111 [0,2,0,0,0,0|2,0,0]=4 7179 B12R1.267 CC=CCSc1ccncc1C 62a_100000765111_100000070051 [0,2,0,0,0,0|2,0,0]=4 7180 B12R1.267 CC=CCSc1ccncc1Cl 62a_100000070051_100000708259 [0,2,0,0,0,0|2,0,0]=4 7181 B12R1.267 CC=CCSc1ccncc1Cl 62a_100000708259_100000070051 [0,2,0,0,0,0|2,0,0]=4 7182 B12R1.267 CC=CCSc1ccncc1F 62a_100000047030_100000070051 [0,2,0,0,0,0|2,0,0]=4 7183 B12R1.267 CC=CCSc1ccncc1F 62a_100000070051_100000047030 [0,2,0,0,0,0|2,0,0]=4 7184 B12R1.267 CC=CCSc1ccncc1N 62a_100000070051_100000756074 [0,2,0,0,0,0|2,0,0]=4 7185 B12R1.267 CC=CCSc1ccncc1N 62a_100000756074_100000070051 [0,2,0,0,0,0|2,0,0]=4 7186 B12R1.267 CC=CCSc1ccncc1O 62a_100000070051_100009817591 [0,2,0,0,0,0|1,0,0]=3 7187 B12R1.267 CC=CCSc1ccncc1O 62a_100009817591_100000070051 [0,2,0,0,0,0|1,0,0]=3 7188 B12R1.267 CC=CCSc1cnccc1Br 62a_100000070051_100010138639 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.267 CC=CCSc1cnccc1Br 62a_100010138639_100000070051 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.267 CC=CCSc1cnccc1C 62a_100000070051_100000761580 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.267 CC=CCSc1cnccc1C 62a_100000761580_100000070051 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.267 CC=CCSc1cnccc1Cl 62a_100000070051_100009995489 [0,2,0,0,0,0|2,0,0]=4 7193 B12R1.267 CC=CCSc1cnccc1Cl 62a_100009995489_100000070051 [0,2,0,0,0,0|2,0,0]=4 7194 B12R1.267 CC=CCSc1cnccc1F 62a_100000070051_100009820683 [0,2,0,0,0,0|2,0,0]=4 7195 B12R1.267 CC=CCSc1cnccc1F 62a_100009820683_100000070051 [0,2,0,0,0,0|2,0,0]=4 7196 B12R1.267 CC=CCSc1cnccc1N 62a_100000047001_100000070051 [0,2,0,0,0,0|2,0,0]=4 7197 B12R1.267 CC=CCSc1cnccc1N 62a_100000070051_100000047001 [0,2,0,0,0,0|2,0,0]=4 7198 B12R1.267 CC=CCSc1cncnc1O 62a_100000070051_100000751107 [0,2,0,0,0,0|2,0,0]=4 7199 B12R1.267 CC=CCSc1cncnc1O 62a_100000751107_100000070051 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.267 CC=CCSc1ncccc1Br 62a_100000070051_100000696092 [0,2,0,0,0,0|2,0,0]=4 7201 B12R1.267 CC=CCSc1ncccc1Br 62a_100000696092_100000070051 [0,2,0,0,0,0|2,0,0]=4 7202 B12R1.267 CC=CCSc1ncccc1C 62a_100000070051_100000751373 [0,2,0,0,0,0|2,0,0]=4 7203 B12R1.267 CC=CCSc1ncccc1C 62a_100000751373_100000070051 [0,2,0,0,0,0|2,0,0]=4 7204 B12R1.267 CC=CCSc1ncccc1Cl 62a_100000070051_100011356963 [0,2,0,0,0,0|2,0,0]=4 7205 B12R1.267 CC=CCSc1ncccc1Cl 62a_100011356963_100000070051 [0,2,0,0,0,0|2,0,0]=4 7206 B12R1.267 CC=CCSc1ncccc1F 62a_100000070051_100000685392 [0,2,0,0,0,0|2,0,0]=4 7207 B12R1.267 CC=CCSc1ncccc1F 62a_100000685392_100000070051 [0,2,0,0,0,0|2,0,0]=4 7208 B12R1.267 CC=CCSc1ncccc1N 62a_100000070051_100000688686 [0,2,0,0,0,0|2,0,0]=4 7209 B12R1.267 CC=CCSc1ncccc1N 62a_100000688686_100000070051 [0,2,0,0,0,0|2,0,0]=4 7210 B12R1.267 CC=CCSc1ncccc1O 62a_100000034122_100000070051 [0,2,0,0,0,0|1,0,0]=3 7211 B12R1.267 CC=CCSc1ncccc1O 62a_100000070051_100000034122 [0,2,0,0,0,0|1,0,0]=3 7212 B12R1.267 CC=NNCc1ccccc1Br 4a_200016993956_200000210099 [0,2,0,0,0,0|1,0,1]=4 7213 B12R1.267 CC=NNCc1ccccc1C 4a_100000737298_200000210099 [0,2,0,0,0,0|1,0,1]=4 7214 B12R1.267 CC=NNCc1ccccc1Cl 4a_100015187261_200000210099 [0,2,0,0,0,0|1,0,1]=4 7215 B12R1.267 CC=NNCc1ccccc1F 4a_100015200773_200000210099 [0,2,0,0,0,0|1,0,1]=4 7216 B12R1.267 CCCC=Cc1ccccc1O 271570a_100016258520_100000739446 [0,2,0,0,0,0|0,0,2]=4 7217 B12R1.267 CCCCNc1ccccc1O 34a_100000185747_100000210210 [0,2,0,0,0,0|0,0,2]=4 7218 B12R1.267 CCCCOc1ccccc1O 271570a_203496583355_100000230755 [0,2,0,0,0,0|0,0,2]=4 7219 B12R1.267 CCCCSc1ccccc1O 62a_100000210211_100000739446 [0,2,0,0,0,0|0,0,2]=4 7220 B12R1.267 CCCCSc1ccccc1O 62a_100000739446_100000210210 [0,2,0,0,0,0|0,0,2]=4 7221 B12R1.267 CCCNCc1ccccc1O 271570a_203496583355_100000196483 [0,2,0,0,0,0|0,0,2]=4 7222 B12R1.267 CCCNCc1ccccc1O 34a_100000185550_100000210303 [0,2,0,0,0,0|0,0,2]=4 7223 B12R1.267 CCCSCc1ccccc1O 271570a_203496583355_200000173363 [0,2,0,0,0,0|0,0,2]=4 7224 B12R1.267 CCNCCc1ccccc1O 34a_100011207237_100000210202 [0,2,0,0,0,0|0,0,2]=4 7225 B12R1.267 CCOC=Cc1ccccc1O 271570a_100016256518_100000739446 [0,2,0,0,0,0|0,0,2]=4 7226 B12R1.267 CCOCCc1ccccc1O 34a_100121572206_100000722297 [0,2,0,0,0,0|0,0,2]=4 7227 B12R1.267 CCOCSc1ccccc1O 62a_100000739092_100000739446 [0,2,0,0,0,0|0,0,2]=4 7228 B12R1.267 CCOCSc1ccccc1O 62a_100000739446_100000739092 [0,2,0,0,0,0|0,0,2]=4 7229 B12R1.267 CCSCCc1ccccc1O 62a_100000210202_100000722297 [0,2,0,0,0,0|0,0,2]=4 7230 B12R1.267 CCSCCc1ccccc1O 62a_100000722297_100000210202 [0,2,0,0,0,0|0,0,2]=4 7231 B12R1.267 COCC=Cc1ccccc1O 271570a_100016286323_100000739446 [0,2,0,0,0,0|0,0,2]=4 7232 B12R1.267 COCCNc1ccccc1O 34a_100000185747_100011201679 [0,2,0,0,0,0|0,0,2]=4 7233 B12R1.267 COCCOc1ccccc1O 271570a_203496583355_100000234100 [0,2,0,0,0,0|0,0,2]=4 7234 B12R1.267 COCCSc1ccccc1O 271570a_203496583355_200016336083 [0,2,0,0,0,0|0,0,2]=4 7235 B12R1.267 COCCSc1ccccc1O 62a_100000233755_100000739446 [0,2,0,0,0,0|0,0,2]=4 7236 B12R1.267 COCCSc1ccccc1O 62a_100000739446_100000233755 [0,2,0,0,0,0|0,0,2]=4 7237 B12R1.267 CSCCNc1ccccc1O 34a_100000185747_100000212216 [0,2,0,0,0,0|0,0,2]=4 7238 B12R1.267 CSCCSc1ccccc1O 62a_100000212216_100000739446 [0,2,0,0,0,0|0,0,2]=4 7239 B12R1.267 CSCCSc1ccccc1O 62a_100000739446_100000751147 [0,2,0,0,0,0|0,0,2]=4 7240 B12R1.267 CSCNCc1ccccc1O 34a_100000185550_100011218213 [0,2,0,0,0,0|0,0,2]=4 7241 B12R1.267 Cc1ccccc1CNCC=O 34a_100000174972_200009817547 [0,2,0,0,0,0|1,0,1]=4 7242 B12R1.267 Cc1ccccc1COCC=O 34a_100000698903_200009817547 [0,2,0,0,0,0|1,0,1]=4 7243 B12R1.267 Cc1ccccc1COCC=O 7a_100000698903_200015260668 [0,2,0,0,0,0|1,0,1]=4 7244 B12R1.267 Cc1ccccc1CSCC=O 62a_100000211839_200015260668 [0,2,0,0,0,0|1,0,1]=4 7245 B12R1.267 Cc1ccccc1CSCC=O 62a_200015260668_100000211839 [0,2,0,0,0,0|1,0,1]=4 7246 B12R1.267 N#CCCSc1ccccc1O 62a_100000739446_100011215226 [0,2,0,0,0,0|0,0,2]=4 7247 B12R1.267 N#CCCSc1ccccc1O 62a_100011215226_100000739446 [0,2,0,0,0,0|0,0,2]=4 7248 B12R1.267 N#CSCSc1ccccc1O 62a_100000211825_100000739446 [0,2,0,0,0,0|1,0,1]=4 7249 B12R1.267 N#CSCSc1ccccc1O 62a_100000739446_100000211825 [0,2,0,0,0,0|1,0,1]=4 7250 B12R1.267 Nc1ccccc1COCC=O 34a_100000212039_200009817547 [0,2,0,0,0,0|1,0,1]=4 7251 B12R1.267 O=CCNCc1ccccc1Br 2230a_100000689332_200015260668 [0,2,0,0,0,0|1,0,1]=4 7252 B12R1.267 O=CCNCc1ccccc1Br 34a_100000689332_200009817547 [0,2,0,0,0,0|1,0,1]=4 7253 B12R1.267 O=CCNCc1ccccc1Cl 2230a_100000174879_200015260668 [0,2,0,0,0,0|1,0,1]=4 7254 B12R1.267 O=CCNCc1ccccc1Cl 34a_100000174879_200009817547 [0,2,0,0,0,0|1,0,1]=4 7255 B12R1.267 O=CCNCc1ccccc1F 34a_100000174869_200009817547 [0,2,0,0,0,0|1,0,1]=4 7256 B12R1.267 O=CCNCc1ccccc1O 34a_100000185550_200009817547 [0,2,0,0,0,0|0,0,1]=3 7257 B12R1.267 O=CCOCc1ccccc1Br 34a_100000756307_200009817547 [0,2,0,0,0,0|1,0,1]=4 7258 B12R1.267 O=CCOCc1ccccc1Br 7a_100000756307_200015260668 [0,2,0,0,0,0|1,0,1]=4 7259 B12R1.267 O=CCOCc1ccccc1Cl 34a_100000210847_200009817547 [0,2,0,0,0,0|1,0,1]=4 7260 B12R1.267 O=CCOCc1ccccc1Cl 7a_100000210847_200015260668 [0,2,0,0,0,0|1,0,1]=4 7261 B12R1.267 O=CCOCc1ccccc1F 34a_100000211962_200009817547 [0,2,0,0,0,0|1,0,1]=4 7262 B12R1.267 O=CCOCc1ccccc1F 7a_100000211962_200015260668 [0,2,0,0,0,0|1,0,1]=4 7263 B12R1.267 O=CCOCc1ccccc1I 34a_100000187465_200009817547 [0,2,0,0,0,0|1,0,1]=4 7264 B12R1.267 O=CCOCc1ccccc1I 7a_100000187465_200015260668 [0,2,0,0,0,0|1,0,1]=4 7265 B12R1.267 O=CCSCc1ccccc1Br 62a_100000184730_200015260668 [0,2,0,0,0,0|1,0,1]=4 7266 B12R1.267 O=CCSCc1ccccc1Br 62a_200015260668_100000184730 [0,2,0,0,0,0|1,0,1]=4 7267 B12R1.267 O=CCSCc1ccccc1Cl 62a_100000187162_200015260668 [0,2,0,0,0,0|1,0,1]=4 7268 B12R1.267 O=CCSCc1ccccc1Cl 62a_200015260668_100000187162 [0,2,0,0,0,0|1,0,1]=4 7269 B12R1.267 O=CCSCc1ccccc1F 62a_100000211605_200015260668 [0,2,0,0,0,0|1,0,1]=4 7270 B12R1.267 O=CCSCc1ccccc1F 62a_200015260668_100000211605 [0,2,0,0,0,0|1,0,1]=4 7271 B12R1.267 O=CCSCc1ccccc1I 62a_100011216222_200015260668 [0,2,0,0,0,0|1,0,1]=4 7272 B12R1.267 O=CCSCc1ccccc1I 62a_200015260668_100011216222 [0,2,0,0,0,0|1,0,1]=4 7273 B12R1.267 O=CCSCc1ncccc1O 62a_200015260668_200020655725 [0,2,0,0,0,0|1,0,1]=4 7274 B12R1.267 O=CCSCc1ncccc1O 62a_200020655725_200015260668 [0,2,0,0,0,0|1,0,1]=4 7275 B12R1.267 OCCCCc1ccccc1O 271570a_203496583355_100012092669 [0,2,0,0,0,0|0,0,2]=4 7276 B12R1.267 OCCCNc1ccccc1O 34a_100000185747_100000230001 [0,2,0,0,0,0|0,0,2]=4 7277 B12R1.267 OCCCSc1ccccc1O 62a_100000739446_100011215043 [0,2,0,0,0,0|0,0,2]=4 7278 B12R1.267 OCCCSc1ccccc1O 62a_100011215043_100000739446 [0,2,0,0,0,0|0,0,2]=4 7279 B12R1.267 OCCNCc1ccccc1O 271570a_203496583355_106744479749 [0,2,0,0,0,0|0,0,2]=4 7280 B12R1.267 OCCNCc1ccccc1O 34a_100000185550_100000211926 [0,2,0,0,0,0|0,0,2]=4 7281 B12R1.267 Oc1ccccc1CCNCF 34a_100011207237_100015361967 [0,2,0,0,0,0|0,0,2]=4 7282 B12R1.267 Oc1ccccc1CCSCF 62a_100000722297_100015361967 [0,2,0,0,0,0|0,0,2]=4 7283 B12R1.267 Oc1ccccc1CCSCF 62a_100015361967_100000722297 [0,2,0,0,0,0|0,0,2]=4 7284 B12R1.267 Oc1ccccc1CNCCF 34a_100000185550_100011217306 [0,2,0,0,0,0|0,0,2]=4 7285 B12R1.267 Oc1ccccc1NCCCF 34a_100000185747_100011934791 [0,2,0,0,0,0|0,0,2]=4 7286 B12R1.267 Oc1ccccc1SCCCF 62a_100000739446_100011934791 [0,2,0,0,0,0|0,0,2]=4 7287 B12R1.267 Oc1ccccc1SCCCF 62a_100011934791_100000739446 [0,2,0,0,0,0|0,0,2]=4 7288 B12R1.308 C#CCC(=O)c1ccccc1O 1458a_100015234032_100000184674 [0,2,0,0,0,0|0,0,2]=4 7289 B12R1.308 C=CCC(=O)c1ccccc1Br 1458a_100000188424_100000210623 [0,2,0,0,0,0|1,0,0]=3 7290 B12R1.308 C=CCC(=O)c1ccccc1C 1458a_100000212026_100000210623 [0,2,0,0,0,0|1,0,0]=3 7291 B12R1.308 C=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210623 [0,2,0,0,0,0|1,0,0]=3 7292 B12R1.308 C=CCC(=O)c1ccccc1F 1458a_100000188656_100000210623 [0,2,0,0,0,0|1,0,0]=3 7293 B12R1.308 C=CCC(=O)c1ccccc1I 1458a_100000187884_100000210623 [0,2,0,0,0,0|1,0,0]=3 7294 B12R1.308 C=CCC(=O)c1ccccc1O 1458a_100015234032_100000210623 [0,2,0,0,0,0|0,0,0]=2 7295 B12R1.308 C=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210623 [0,2,0,0,0,0|0,0,1]=3 7296 B12R1.308 C=CCN(C)c1ccccc1Br 2230a_100020606079_100000210623 [0,2,0,0,0,0|1,0,0]=3 7297 B12R1.308 C=CCN(C)c1ccccc1Br 269982a_100020606079_100000210623 [0,2,0,0,0,0|1,0,0]=3 7298 B12R1.308 C=CCN(C)c1ccccc1Br 34a_100020606079_100015514636 [0,2,0,0,0,0|1,0,0]=3 7299 B12R1.308 C=CCN(C)c1ccccc1C 2230a_100000219699_100000210623 [0,2,0,0,0,0|1,0,0]=3 7300 B12R1.308 C=CCN(C)c1ccccc1C 269982a_100000219699_100000210623 [0,2,0,0,0,0|1,0,0]=3 7301 B12R1.308 C=CCN(C)c1ccccc1C 34a_100000219699_100015514636 [0,2,0,0,0,0|1,0,0]=3 7302 B12R1.308 C=CCN(C)c1ccccc1Cl 2230a_100000219374_100000210623 [0,2,0,0,0,0|1,0,0]=3 7303 B12R1.308 C=CCN(C)c1ccccc1Cl 269982a_100000219374_100000210623 [0,2,0,0,0,0|1,0,0]=3 7304 B12R1.308 C=CCN(C)c1ccccc1Cl 34a_100000219374_100015514636 [0,2,0,0,0,0|1,0,0]=3 7305 B12R1.308 C=CCN(C)c1ccccc1F 2230a_100000220357_100000210623 [0,2,0,0,0,0|1,0,0]=3 7306 B12R1.308 C=CCN(C)c1ccccc1F 269982a_100000220357_100000210623 [0,2,0,0,0,0|1,0,0]=3 7307 B12R1.308 C=CCN(C)c1ccccc1F 34a_100000220357_100015514636 [0,2,0,0,0,0|1,0,0]=3 7308 B12R1.308 C=CCN(C)c1ccccc1F 38a_100000220357_100000210623 [0,2,0,0,0,0|1,0,0]=3 7309 B12R1.308 C=CCN(C)c1ccccc1O 269982a_100000033821_100000210623 [0,2,0,0,0,0|0,0,0]=2 7310 B12R1.308 CCCC(=O)c1ccccc1O 1458a_100015234032_100000210303 [0,2,0,0,0,0|0,0,2]=4 7311 B12R1.308 CCCN(C)c1ccccc1O 269982a_100000033821_100000210303 [0,2,0,0,0,0|0,0,2]=4 7312 B12R1.308 CCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210202 [0,2,0,0,0,0|0,0,2]=4 7313 B12R1.308 CN(CC#N)c1ccccc1O 269982a_100000033821_100011214920 [0,2,0,0,0,0|1,0,1]=4 7314 B12R1.308 CN(CC=O)c1ccccc1Br 2230a_100020606079_200015260668 [0,2,0,0,0,0|2,0,0]=4 7315 B12R1.308 CN(CC=O)c1ccccc1Br 269982a_100020606079_200015260668 [0,2,0,0,0,0|2,0,0]=4 7316 B12R1.308 CN(CC=O)c1ccccc1Br 34a_100020606079_200009817547 [0,2,0,0,0,0|2,0,0]=4 7317 B12R1.308 CN(CC=O)c1ccccc1Cl 2230a_100000219374_200015260668 [0,2,0,0,0,0|2,0,0]=4 7318 B12R1.308 CN(CC=O)c1ccccc1Cl 269982a_100000219374_200015260668 [0,2,0,0,0,0|2,0,0]=4 7319 B12R1.308 CN(CC=O)c1ccccc1Cl 34a_100000219374_200009817547 [0,2,0,0,0,0|2,0,0]=4 7320 B12R1.308 CN(CC=O)c1ccccc1F 2230a_100000220357_200015260668 [0,2,0,0,0,0|2,0,0]=4 7321 B12R1.308 CN(CC=O)c1ccccc1F 269982a_100000220357_200015260668 [0,2,0,0,0,0|2,0,0]=4 7322 B12R1.308 CN(CC=O)c1ccccc1F 34a_100000220357_200009817547 [0,2,0,0,0,0|2,0,0]=4 7323 B12R1.308 CN(CC=O)c1ccccc1O 269982a_100000033821_200015260668 [0,2,0,0,0,0|1,0,0]=3 7324 B12R1.308 CN(CCF)c1ccccc1O 269982a_100000033821_100011217306 [0,2,0,0,0,0|1,0,1]=4 7325 B12R1.308 CN(CCO)c1ccccc1O 269982a_100000033821_100000211926 [0,2,0,0,0,0|1,0,1]=4 7326 B12R1.308 CNCC(=O)c1ccccc1O 7a_106832991635_100000188908 [0,2,0,0,0,0|1,0,1]=4 7327 B12R1.308 COCN(C)c1ccccc1O 269982a_100000033821_100000766300 [0,2,0,0,0,0|1,0,1]=4 7328 B12R1.308 CSCC(=O)c1ccccc1O 62a_100000188908_200000210301 [0,2,0,0,0,0|1,0,1]=4 7329 B12R1.308 CSCC(=O)c1ccccc1O 62a_200000210301_100000188908 [0,2,0,0,0,0|1,0,1]=4 7330 B12R1.308 CSCN(C)c1ccccc1O 269982a_100000033821_100011218213 [0,2,0,0,0,0|1,0,1]=4 7331 B12R1.308 Cc1ccccc1N(C)CC=O 2230a_100000219699_200015260668 [0,2,0,0,0,0|2,0,0]=4 7332 B12R1.308 Cc1ccccc1N(C)CC=O 269982a_100000219699_200015260668 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.308 Cc1ccccc1N(C)CC=O 34a_100000219699_200009817547 [0,2,0,0,0,0|2,0,0]=4 7334 B12R1.308 N#CCC(=O)c1ccccc1O 1458a_100015234032_100011214920 [0,2,0,0,0,0|1,0,1]=4 7335 B12R1.308 N#CCC(=O)c1ccccc1O 271570a_203496583355_100011225204 [0,2,0,0,0,0|1,0,1]=4 7336 B12R1.308 O=C(CCF)c1ccccc1O 1458a_100015234032_100011217306 [0,2,0,0,0,0|1,0,1]=4 7337 B12R1.308 O=C(CCO)c1ccccc1O 1458a_100015234032_100000211926 [0,2,0,0,0,0|1,0,1]=4 7338 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_100000188908_200025704644 [0,2,0,0,0,0|1,0,1]=4 7339 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_200025704644_100000188908 [0,2,0,0,0,0|1,0,1]=4 7340 B12R1.371 C#CC(=O)Cc1ccccc1Br 1458a_100000211873_100000184730 [0,2,0,0,0,0|1,0,1]=4 7341 B12R1.371 C#CC(=O)Cc1ccccc1C 1458a_100000211873_100000211839 [0,2,0,0,0,0|1,0,1]=4 7342 B12R1.371 C#CC(=O)Cc1ccccc1Cl 1458a_100000211873_100000187162 [0,2,0,0,0,0|1,0,1]=4 7343 B12R1.371 C#CC(=O)Cc1ccccc1F 1458a_100000211873_100000187165 [0,2,0,0,0,0|1,0,1]=4 7344 B12R1.371 C#CC(=O)Cc1ccccc1I 1458a_100000211873_100011216222 [0,2,0,0,0,0|1,0,1]=4 7345 B12R1.371 C#CC(=O)Cc1ncccc1O 1458a_100000211873_200020655725 [0,2,0,0,0,0|1,0,1]=4 7346 B12R1.371 C#CC(C)Nc1ccccc1O 34a_100000185747_200000035995 [0,2,0,0,0,0|0,0,2]=4 7347 B12R1.371 C#CC(C)Sc1ccccc1O 62a_200000035995_100000739446 [0,2,0,0,0,0|0,0,2]=4 7348 B12R1.371 C=CC(=O)Cc1ccccc1Br 1458a_100000185746_100000184730 [0,2,0,0,0,0|1,0,0]=3 7349 B12R1.371 C=CC(=O)Cc1ccccc1C 1458a_100000185746_100000211839 [0,2,0,0,0,0|1,0,0]=3 7350 B12R1.371 C=CC(=O)Cc1ccccc1Cl 1458a_100000185746_100000187162 [0,2,0,0,0,0|1,0,0]=3 7351 B12R1.371 C=CC(=O)Cc1ccccc1F 1458a_100000185746_100000187165 [0,2,0,0,0,0|1,0,0]=3 7352 B12R1.371 C=CC(=O)Cc1ccccc1I 1458a_100000185746_100011216222 [0,2,0,0,0,0|1,0,0]=3 7353 B12R1.371 C=CC(=O)Cc1cccnc1Br 1458a_100000185746_100010140945 [0,2,0,0,0,0|2,0,0]=4 7354 B12R1.371 C=CC(=O)Cc1cccnc1C 1458a_100000185746_100000732876 [0,2,0,0,0,0|2,0,0]=4 7355 B12R1.371 C=CC(=O)Cc1cccnc1Cl 1458a_100000185746_100000045678 [0,2,0,0,0,0|2,0,0]=4 7356 B12R1.371 C=CC(=O)Cc1cccnc1F 1458a_100000185746_100000099810 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.371 C=CC(=O)Cc1ccncc1C 1458a_100000185746_100020672808 [0,2,0,0,0,0|2,0,0]=4 7358 B12R1.371 C=CC(=O)Cc1ccncc1Cl 1458a_100000185746_100000763264 [0,2,0,0,0,0|2,0,0]=4 7359 B12R1.371 C=CC(=O)Cc1cnccc1C 1458a_100000185746_100000690890 [0,2,0,0,0,0|2,0,0]=4 7360 B12R1.371 C=CC(=O)Cc1ncccc1Br 1458a_100000185746_100025702911 [0,2,0,0,0,0|2,0,0]=4 7361 B12R1.371 C=CC(=O)Cc1ncccc1C 1458a_100000185746_100000696600 [0,2,0,0,0,0|2,0,0]=4 7362 B12R1.371 C=CC(=O)Cc1ncccc1Cl 1458a_100000185746_100000099807 [0,2,0,0,0,0|2,0,0]=4 7363 B12R1.371 C=CC(=O)Cc1ncccc1F 1458a_100000185746_100000104219 [0,2,0,0,0,0|2,0,0]=4 7364 B12R1.371 C=CC(=O)Cc1ncccc1O 1458a_100000185746_200020655725 [0,2,0,0,0,0|1,0,0]=3 7365 B12R1.371 C=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000185746 [0,2,0,0,0,0|1,0,1]=4 7366 B12R1.371 C=CC(=O)Nc1ccccc1C 1626a_100015192222_100000185746 [0,2,0,0,0,0|1,0,1]=4 7367 B12R1.371 C=CC(=O)Nc1ccccc1C 22a_100015192222_100000185746 [0,2,0,0,0,0|1,0,1]=4 7368 B12R1.371 C=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000185746 [0,2,0,0,0,0|1,0,1]=4 7369 B12R1.371 C=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000185746 [0,2,0,0,0,0|1,0,1]=4 7370 B12R1.371 C=CC(=O)Nc1ccccc1F 1626a_100000210422_100000185746 [0,2,0,0,0,0|1,0,1]=4 7371 B12R1.371 C=CC(=O)Nc1ccccc1F 22a_100000210422_100000185746 [0,2,0,0,0,0|1,0,1]=4 7372 B12R1.371 C=CC(=O)Nc1ccccc1I 1626a_100000210053_100000185746 [0,2,0,0,0,0|1,0,1]=4 7373 B12R1.371 C=CC(=O)Nc1ccccc1O 22a_100000185747_100000185746 [0,2,0,0,0,0|0,0,1]=3 7374 B12R1.371 C=CC(C)Sc1c[nH]ccc1=O 62a_100011215867_100009998708 [0,2,0,0,0,0|1,0,1]=4 7375 B12R1.371 C=CC(C)Sc1c[nH]ccc1=S 62a_100011215867_200012280681 [0,2,0,0,0,0|1,1,0]=4 7376 B12R1.371 C=CC(C)Sc1cccc[n+]1C 62a_100011215867_100000212160 [0,2,0,0,0,0|2,0,0]=4 7377 B12R1.371 C=CC(C)Sc1cccc[n+]1[O-] 62a_100011215867_200000042595 [0,2,0,0,0,0|1,0,1]=4 7378 B12R1.371 C=CC(C)Sc1ccccc1Br 62a_100011215867_100000695589 [0,2,0,0,0,0|1,0,0]=3 7379 B12R1.371 C=CC(C)Sc1ccccc1C 62a_100011215867_100000210755 [0,2,0,0,0,0|1,0,0]=3 7380 B12R1.371 C=CC(C)Sc1ccccc1Cl 62a_100011215867_100000764095 [0,2,0,0,0,0|1,0,0]=3 7381 B12R1.371 C=CC(C)Sc1ccccc1F 62a_100011215867_100011215700 [0,2,0,0,0,0|1,0,0]=3 7382 B12R1.371 C=CC(C)Sc1ccccc1N 62a_100011215867_100000210017 [0,2,0,0,0,0|1,0,0]=3 7383 B12R1.371 C=CC(C)Sc1ccccc1O 62a_100011215867_100000739446 [0,2,0,0,0,0|0,0,0]=2 7384 B12R1.371 C=CC(C)Sc1cccnc1Br 62a_100011215867_100010202626 [0,2,0,0,0,0|2,0,0]=4 7385 B12R1.371 C=CC(C)Sc1cccnc1C 62a_100011215867_100000751574 [0,2,0,0,0,0|2,0,0]=4 7386 B12R1.371 C=CC(C)Sc1cccnc1Cl 62a_100011215867_100000036424 [0,2,0,0,0,0|2,0,0]=4 7387 B12R1.371 C=CC(C)Sc1cccnc1F 62a_100011215867_100009816115 [0,2,0,0,0,0|2,0,0]=4 7388 B12R1.371 C=CC(C)Sc1cccnc1N 62a_100011215867_100000045569 [0,2,0,0,0,0|2,0,0]=4 7389 B12R1.371 C=CC(C)Sc1cccnc1O 62a_100011215867_100000760158 [0,2,0,0,0,0|1,0,0]=3 7390 B12R1.371 C=CC(C)Sc1ccncc1Br 62a_100011215867_100000726257 [0,2,0,0,0,0|2,0,0]=4 7391 B12R1.371 C=CC(C)Sc1ccncc1C 62a_100011215867_100000765111 [0,2,0,0,0,0|2,0,0]=4 7392 B12R1.371 C=CC(C)Sc1ccncc1Cl 62a_100011215867_100000708259 [0,2,0,0,0,0|2,0,0]=4 7393 B12R1.371 C=CC(C)Sc1ccncc1F 62a_100011215867_100000047030 [0,2,0,0,0,0|2,0,0]=4 7394 B12R1.371 C=CC(C)Sc1ccncc1N 62a_100011215867_100000756074 [0,2,0,0,0,0|2,0,0]=4 7395 B12R1.371 C=CC(C)Sc1ccncc1O 62a_100011215867_100009817591 [0,2,0,0,0,0|1,0,0]=3 7396 B12R1.371 C=CC(C)Sc1cnccc1Br 62a_100011215867_100010138639 [0,2,0,0,0,0|2,0,0]=4 7397 B12R1.371 C=CC(C)Sc1cnccc1C 62a_100011215867_100000761580 [0,2,0,0,0,0|2,0,0]=4 7398 B12R1.371 C=CC(C)Sc1cnccc1Cl 62a_100011215867_100009995489 [0,2,0,0,0,0|2,0,0]=4 7399 B12R1.371 C=CC(C)Sc1cnccc1F 62a_100011215867_100009820683 [0,2,0,0,0,0|2,0,0]=4 7400 B12R1.371 C=CC(C)Sc1cnccc1N 62a_100011215867_100000047001 [0,2,0,0,0,0|2,0,0]=4 7401 B12R1.371 C=CC(C)Sc1cncnc1O 62a_100011215867_100000751107 [0,2,0,0,0,0|2,0,0]=4 7402 B12R1.371 C=CC(C)Sc1ncccc1Br 62a_100011215867_100000696092 [0,2,0,0,0,0|2,0,0]=4 7403 B12R1.371 C=CC(C)Sc1ncccc1C 62a_100011215867_100000751373 [0,2,0,0,0,0|2,0,0]=4 7404 B12R1.371 C=CC(C)Sc1ncccc1Cl 62a_100011215867_100011356963 [0,2,0,0,0,0|2,0,0]=4 7405 B12R1.371 C=CC(C)Sc1ncccc1F 62a_100011215867_100000685392 [0,2,0,0,0,0|2,0,0]=4 7406 B12R1.371 C=CC(C)Sc1ncccc1N 62a_100011215867_100000688686 [0,2,0,0,0,0|2,0,0]=4 7407 B12R1.371 C=CC(C)Sc1ncccc1O 62a_100011215867_100000034122 [0,2,0,0,0,0|1,0,0]=3 7408 B12R1.371 CC(C#N)Sc1ccccc1O 62a_100000703298_100000739446 [0,2,0,0,0,0|1,0,1]=4 7409 B12R1.371 CC(C#N)Sc1ccccc1O 62a_100000739446_100000703298 [0,2,0,0,0,0|1,0,1]=4 7410 B12R1.371 CC(CO)Nc1ccccc1O 34a_100000185747_100012180447 [0,2,0,0,0,0|1,0,1]=4 7411 B12R1.371 CC(CO)Sc1ccccc1O 62a_100012180447_100000739446 [0,2,0,0,0,0|1,0,1]=4 7412 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000210414_100000184730 [0,2,0,0,0,0|1,0,1]=4 7413 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210202 [0,2,0,0,0,0|1,0,1]=4 7414 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000210414_100000211839 [0,2,0,0,0,0|1,0,1]=4 7415 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000212180_100000210202 [0,2,0,0,0,0|1,0,1]=4 7416 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210202 [0,2,0,0,0,0|1,0,1]=4 7417 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000210414_100000187162 [0,2,0,0,0,0|1,0,1]=4 7418 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000210414_100000187165 [0,2,0,0,0,0|1,0,1]=4 7419 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000212012_100000210202 [0,2,0,0,0,0|1,0,1]=4 7420 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000036491_100000210202 [0,2,0,0,0,0|1,0,1]=4 7421 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000210414_100011216222 [0,2,0,0,0,0|1,0,1]=4 7422 B12R1.371 CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210202 [0,2,0,0,0,0|0,0,1]=3 7423 B12R1.371 CCC(=O)Cc1ncccc1O 1458a_100000210414_200020655725 [0,2,0,0,0,0|1,0,1]=4 7424 B12R1.371 CCC(=O)Nc1ccccc1O 22a_100000185747_100000210414 [0,2,0,0,0,0|1,0,1]=4 7425 B12R1.371 CCC(=O)Nc1ccccc1O 271570a_203496583355_100000153536 [0,2,0,0,0,0|1,0,1]=4 7426 B12R1.371 CCC(=O)Nc1ccccc1O 527a_100000185747_100000210414 [0,2,0,0,0,0|1,0,1]=4 7427 B12R1.371 CCC(C)Nc1ccccc1O 34a_100000185747_100011215416 [0,2,0,0,0,0|0,0,2]=4 7428 B12R1.371 CCC(C)Sc1ccccc1O 62a_100000739446_100000758301 [0,2,0,0,0,0|0,0,2]=4 7429 B12R1.371 CCC(C)Sc1ccccc1O 62a_100000758301_100000739446 [0,2,0,0,0,0|0,0,2]=4 7430 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100011223546_200000210301 [0,2,0,0,0,0|0,0,2]=4 7431 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100015189988_100000210202 [0,2,0,0,0,0|0,0,2]=4 7432 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100011223546_200000210301 [0,2,0,0,0,0|0,0,2]=4 7433 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100015189988_100000204670 [0,2,0,0,0,0|0,0,2]=4 7434 B12R1.371 CCN([13CH3])Cc1ccccc1O 2230a_100011223546_200025704644 [0,2,0,0,0,0|0,0,2]=4 7435 B12R1.371 CCN([13CH3])Cc1ccccc1O 269982a_100011223546_200025704644 [0,2,0,0,0,0|0,0,2]=4 7436 B12R1.371 CN(CF)Cc1ccccc1O 269982a_100015189988_100015361967 [0,2,0,0,0,0|1,0,1]=4 7437 B12R1.371 CNC(=O)Cc1ccccc1Br 11a_106832991635_100000751119 [0,2,0,0,0,0|1,0,1]=4 7438 B12R1.371 CNC(=O)Cc1ccccc1Br 240690a_100102657272_100000751119 [0,2,0,0,0,0|1,0,1]=4 7439 B12R1.371 CNC(=O)Cc1ccccc1Br 527a_100102657272_100000751119 [0,2,0,0,0,0|1,0,1]=4 7440 B12R1.371 CNC(=O)Cc1ccccc1C 11a_106832991635_100000212180 [0,2,0,0,0,0|1,0,1]=4 7441 B12R1.371 CNC(=O)Cc1ccccc1C 1626a_100102657272_100000212180 [0,2,0,0,0,0|1,0,1]=4 7442 B12R1.371 CNC(=O)Cc1ccccc1C 240690a_100102657272_100000212180 [0,2,0,0,0,0|1,0,1]=4 7443 B12R1.371 CNC(=O)Cc1ccccc1C 527a_100102657272_100000212180 [0,2,0,0,0,0|1,0,1]=4 7444 B12R1.371 CNC(=O)Cc1ccccc1Cl 11a_106832991635_100000183793 [0,2,0,0,0,0|1,0,1]=4 7445 B12R1.371 CNC(=O)Cc1ccccc1Cl 1626a_100102657272_100000183793 [0,2,0,0,0,0|1,0,1]=4 7446 B12R1.371 CNC(=O)Cc1ccccc1Cl 240690a_100102657272_100000183793 [0,2,0,0,0,0|1,0,1]=4 7447 B12R1.371 CNC(=O)Cc1ccccc1Cl 527a_100102657272_100000183793 [0,2,0,0,0,0|1,0,1]=4 7448 B12R1.371 CNC(=O)Cc1ccccc1F 11a_106832991635_100000212012 [0,2,0,0,0,0|1,0,1]=4 7449 B12R1.371 CNC(=O)Cc1ccccc1F 1626a_100102657272_100000212012 [0,2,0,0,0,0|1,0,1]=4 7450 B12R1.371 CNC(=O)Cc1ccccc1F 240690a_100102657272_100000212012 [0,2,0,0,0,0|1,0,1]=4 7451 B12R1.371 CNC(=O)Cc1ccccc1F 527a_100102657272_100000212012 [0,2,0,0,0,0|1,0,1]=4 7452 B12R1.371 CNC(=O)Cc1ccccc1I 11a_106832991635_100000036491 [0,2,0,0,0,0|1,0,1]=4 7453 B12R1.371 CNC(=O)Cc1ccccc1I 1626a_100102657272_100000036491 [0,2,0,0,0,0|1,0,1]=4 7454 B12R1.371 CNC(=O)Cc1ccccc1I 240690a_100102657272_100000036491 [0,2,0,0,0,0|1,0,1]=4 7455 B12R1.371 CNC(=O)Cc1ccccc1I 527a_100102657272_100000036491 [0,2,0,0,0,0|1,0,1]=4 7456 B12R1.371 CNC(=O)Cc1ccccc1O 240690a_100102657272_100000743006 [0,2,0,0,0,0|0,0,1]=3 7457 B12R1.371 CNC(=O)Cc1ccccc1O 271570a_203496583355_200009816160 [0,2,0,0,0,0|0,0,1]=3 7458 B12R1.371 CNC(=O)Cc1ccccc1O 527a_100102657272_100000743006 [0,2,0,0,0,0|0,0,1]=3 7459 B12R1.371 CNC(=O)Nc1ccccc1O 2430a_100000185747_100102657272 [0,2,0,0,0,0|1,0,1]=4 7460 B12R1.371 COC(=O)Cc1ccccc1O 271570a_203496583355_100000699816 [0,2,0,0,0,0|0,0,1]=3 7461 B12R1.371 COC(=O)Cc1cccnc1O 271570a_203496583355_100010293180 [0,2,0,0,0,0|1,0,1]=4 7462 B12R1.371 COC(=O)Cc1ncccc1O 271570a_203496583355_100012347948 [0,2,0,0,0,0|1,0,1]=4 7463 B12R1.371 COC(=O)Nc1ccccc1O 271570a_203496583355_100000216184 [0,2,0,0,0,0|1,0,1]=4 7464 B12R1.371 COC(C)Sc1ccccc1O 62a_100000739446_100009879195 [0,2,0,0,0,0|1,0,1]=4 7465 B12R1.371 COC(C)Sc1ccccc1O 62a_100009879195_100000739446 [0,2,0,0,0,0|1,0,1]=4 7466 B12R1.371 C[C@H](CO)Sc1ccccc1O 62a_100000739446_100016084084 [0,2,0,0,0,0|1,0,1]=4 7467 B12R1.371 C[C@H](CO)Sc1ccccc1O 62a_100016084084_100000739446 [0,2,0,0,0,0|1,0,1]=4 7468 B12R1.371 Cc1ccccc1CC(=O)CF 1458a_100000212180_100015361967 [0,2,0,0,0,0|1,0,1]=4 7469 B12R1.371 Cc1ccccc1CC(=O)CO 1458a_100000210174_100000211839 [0,2,0,0,0,0|1,0,1]=4 7470 B12R1.371 N#CC(F)Sc1ccccc1O 62a_100000739446_200000117898 [0,2,0,0,0,0|1,0,1]=4 7471 B12R1.371 N#CC(F)Sc1ccccc1O 62a_200000117898_100000739446 [0,2,0,0,0,0|1,0,1]=4 7472 B12R1.371 NNC(=O)Cc1ccccc1O 271570a_203496583355_200010210069 [0,2,0,0,0,0|1,0,0]=3 7473 B12R1.371 O=C(CF)Cc1ccccc1Br 1458a_100000751119_100015361967 [0,2,0,0,0,0|1,0,1]=4 7474 B12R1.371 O=C(CF)Cc1ccccc1Cl 1458a_100000183793_100015361967 [0,2,0,0,0,0|1,0,1]=4 7475 B12R1.371 O=C(CF)Cc1ccccc1F 1458a_100000212012_100015361967 [0,2,0,0,0,0|1,0,1]=4 7476 B12R1.371 O=C(CF)Cc1ccccc1I 1458a_100000036491_100015361967 [0,2,0,0,0,0|1,0,1]=4 7477 B12R1.371 O=C(CF)Cc1ccccc1O 1458a_100000743006_100015361967 [0,2,0,0,0,0|0,0,1]=3 7478 B12R1.371 O=C(CO)Cc1ccccc1Br 1458a_100000210174_100000184730 [0,2,0,0,0,0|1,0,1]=4 7479 B12R1.371 O=C(CO)Cc1ccccc1Cl 1458a_100000210174_100000187162 [0,2,0,0,0,0|1,0,1]=4 7480 B12R1.371 O=C(CO)Cc1ccccc1F 1458a_100000210174_100000187165 [0,2,0,0,0,0|1,0,1]=4 7481 B12R1.371 O=C(CO)Cc1ccccc1I 1458a_100000210174_100011216222 [0,2,0,0,0,0|1,0,1]=4 7482 B12R1.371 O=C(CO)Cc1ncccc1O 1458a_100000210174_200020655725 [0,2,0,0,0,0|1,0,1]=4 7483 B12R1.371 O=C(CO)Nc1ccccc1O 22a_100000185747_100000210174 [0,2,0,0,0,0|1,0,1]=4 7484 B12R1.371 O=C(CO)Nc1ccccc1O 527a_100000185747_100000210174 [0,2,0,0,0,0|1,0,1]=4 7485 B12R1.374 C#CCNc1cc(ccc1O)Br 34a_100000752626_100000184674 [0,2,0,0,0,0|0,0,2]=4 7486 B12R1.374 C#CCNc1cc(ccc1O)C 34a_100011215204_100000184674 [0,2,0,0,0,0|0,0,2]=4 7487 B12R1.374 C#CCNc1cc(ccc1O)Cl 34a_100000210500_100000184674 [0,2,0,0,0,0|0,0,2]=4 7488 B12R1.374 C#CCNc1cc(ccc1O)F 34a_100000759472_100000184674 [0,2,0,0,0,0|0,0,2]=4 7489 B12R1.374 C#CCSc1cc(ccc1O)Br 62a_100000038162_100012355227 [0,2,0,0,0,0|0,0,2]=4 7490 B12R1.374 C#CCSc1cc(ccc1O)C 62a_100000038162_100000765521 [0,2,0,0,0,0|0,0,2]=4 7491 B12R1.374 C#CCSc1cc(ccc1O)Cl 62a_100000038162_100011356953 [0,2,0,0,0,0|0,0,2]=4 7492 B12R1.374 C#CCSc1cc(ccc1O)F 62a_100000038162_100000211999 [0,2,0,0,0,0|0,0,2]=4 7493 B12R1.374 C#CCSc1cc(ccc1O)N 62a_100000038162_100011534360 [0,2,0,0,0,0|0,0,2]=4 7494 B12R1.374 C#CCSc1cc(ccc1O)O 62a_100000038162_100009813629 [0,2,0,0,0,0|0,0,2]=4 7495 B12R1.374 C=CCNc1cc(ccc1Br)Br 34a_100000737762_100015514636 [0,2,0,0,0,0|1,0,0]=3 7496 B12R1.374 C=CCNc1cc(ccc1Br)C 34a_100000745044_100015514636 [0,2,0,0,0,0|1,0,0]=3 7497 B12R1.374 C=CCNc1cc(ccc1Br)Cl 34a_100000687073_100015514636 [0,2,0,0,0,0|1,0,0]=3 7498 B12R1.374 C=CCNc1cc(ccc1Br)F 34a_100000687223_100015514636 [0,2,0,0,0,0|1,0,0]=3 7499 B12R1.374 C=CCNc1cc(ccc1Br)O 34a_100011999798_100015514636 [0,2,0,0,0,0|1,0,0]=3 7500 B12R1.374 C=CCNc1cc(ccc1C)Br 34a_100000741167_100015514636 [0,2,0,0,0,0|1,0,0]=3 7501 B12R1.374 C=CCNc1cc(ccc1C)Br 7a_100000741167_100015514636 [0,2,0,0,0,0|1,0,0]=3 7502 B12R1.374 C=CCNc1cc(ccc1C)C 2230a_100000185781_100000210623 [0,2,0,0,0,0|1,0,0]=3 7503 B12R1.374 C=CCNc1cc(ccc1C)C 34a_100000185781_100015514636 [0,2,0,0,0,0|1,0,0]=3 7504 B12R1.374 C=CCNc1cc(ccc1C)C 7a_100000185781_100015514636 [0,2,0,0,0,0|1,0,0]=3 7505 B12R1.374 C=CCNc1cc(ccc1C)Cl 34a_100000211374_100015514636 [0,2,0,0,0,0|1,0,0]=3 7506 B12R1.374 C=CCNc1cc(ccc1C)Cl 7a_100000211374_100015514636 [0,2,0,0,0,0|1,0,0]=3 7507 B12R1.374 C=CCNc1cc(ccc1C)F 34a_100000211107_100015514636 [0,2,0,0,0,0|1,0,0]=3 7508 B12R1.374 C=CCNc1cc(ccc1C)F 7a_100000211107_100015514636 [0,2,0,0,0,0|1,0,0]=3 7509 B12R1.374 C=CCNc1cc(ccc1C)I 7a_100000761890_100015514636 [0,2,0,0,0,0|1,0,0]=3 7510 B12R1.374 C=CCNc1cc(ccc1C)O 34a_100011216113_100015514636 [0,2,0,0,0,0|1,0,0]=3 7511 B12R1.374 C=CCNc1cc(ccc1Cl)Br 34a_100000750497_100015514636 [0,2,0,0,0,0|1,0,0]=3 7512 B12R1.374 C=CCNc1cc(ccc1Cl)C 34a_100011215360_100015514636 [0,2,0,0,0,0|1,0,0]=3 7513 B12R1.374 C=CCNc1cc(ccc1Cl)Cl 34a_100000184485_100015514636 [0,2,0,0,0,0|1,0,0]=3 7514 B12R1.374 C=CCNc1cc(ccc1Cl)F 34a_100000751338_100015514636 [0,2,0,0,0,0|1,0,0]=3 7515 B12R1.374 C=CCNc1cc(ccc1Cl)I 34a_200000761891_100015514636 [0,2,0,0,0,0|1,0,0]=3 7516 B12R1.374 C=CCNc1cc(ccc1Cl)O 34a_100011934297_100015514636 [0,2,0,0,0,0|1,0,0]=3 7517 B12R1.374 C=CCNc1cc(ccc1F)Br 34a_100000740924_100015514636 [0,2,0,0,0,0|1,0,0]=3 7518 B12R1.374 C=CCNc1cc(ccc1F)C 34a_100000211285_100015514636 [0,2,0,0,0,0|1,0,0]=3 7519 B12R1.374 C=CCNc1cc(ccc1F)Cl 34a_100000212115_100015514636 [0,2,0,0,0,0|1,0,0]=3 7520 B12R1.374 C=CCNc1cc(ccc1F)F 34a_100000210742_100015514636 [0,2,0,0,0,0|1,0,0]=3 7521 B12R1.374 C=CCNc1cc(ccc1F)I 34a_100011464823_100015514636 [0,2,0,0,0,0|1,0,0]=3 7522 B12R1.374 C=CCNc1cc(ccc1F)O 34a_100012017239_100015514636 [0,2,0,0,0,0|1,0,0]=3 7523 B12R1.374 C=CCNc1cc(ccc1I)Br 34a_100000743836_100015514636 [0,2,0,0,0,0|1,0,0]=3 7524 B12R1.374 C=CCNc1cc(ccc1I)C 34a_100011216686_100015514636 [0,2,0,0,0,0|1,0,0]=3 7525 B12R1.374 C=CCNc1cc(ccc1I)Cl 34a_100000761886_100015514636 [0,2,0,0,0,0|1,0,0]=3 7526 B12R1.374 C=CCNc1cc(ccc1I)F 34a_100011218093_100015514636 [0,2,0,0,0,0|1,0,0]=3 7527 B12R1.374 C=CCNc1cc(ccc1O)Br 34a_100000752626_100015514636 [0,2,0,0,0,0|0,0,0]=2 7528 B12R1.374 C=CCNc1cc(ccc1O)C 34a_100011215204_100015514636 [0,2,0,0,0,0|0,0,0]=2 7529 B12R1.374 C=CCNc1cc(ccc1O)Cl 34a_100000210500_100015514636 [0,2,0,0,0,0|0,0,0]=2 7530 B12R1.374 C=CCNc1cc(ccc1O)F 34a_100000759472_100015514636 [0,2,0,0,0,0|0,0,0]=2 7531 B12R1.374 C=CCNc1cc(cnc1F)Br 27a_100020586998_100010172738 [0,2,0,0,0,0|2,0,0]=4 7532 B12R1.374 C=CCNc1cc(cnc1F)C 27a_100020586998_100009820679 [0,2,0,0,0,0|2,0,0]=4 7533 B12R1.374 C=CCNc1cc(cnc1F)Cl 27a_100020586998_100010188783 [0,2,0,0,0,0|2,0,0]=4 7534 B12R1.374 C=CCNc1cc(ncc1Br)Br 27a_100020586998_100010171693 [0,2,0,0,0,0|2,0,0]=4 7535 B12R1.374 C=CCNc1cc(ncc1C)F 27a_100020586998_100000049870 [0,2,0,0,0,0|2,0,0]=4 7536 B12R1.374 C=CCNc1cc(ncc1Cl)F 27a_100020586998_100009892587 [0,2,0,0,0,0|2,0,0]=4 7537 B12R1.374 C=CCNc1cc(ncc1F)C 27a_100020586998_100009867690 [0,2,0,0,0,0|2,0,0]=4 7538 B12R1.374 C=CCNc1cc(ncc1F)F 27a_100020586998_100010233071 [0,2,0,0,0,0|2,0,0]=4 7539 B12R1.374 C=CCNc1nc(ccc1F)F 27a_100020586998_100010997973 [0,2,0,0,0,0|2,0,0]=4 7540 B12R1.374 C=CCNc1nc(ccc1N)F 27a_100020586998_100009879877 [0,2,0,0,0,0|2,0,0]=4 7541 B12R1.374 C=CCOc1cc(=O)[nH]cc1Cl 34a_100000069390_100015514636 [0,2,0,0,0,0|2,0,0]=4 7542 B12R1.374 C=CCOc1cc(ccc1Br)Br 34a_100011220040_100015514636 [0,2,0,0,0,0|1,0,0]=3 7543 B12R1.374 C=CCOc1cc(ccc1Br)Br 7a_100011220040_100015514636 [0,2,0,0,0,0|1,0,0]=3 7544 B12R1.374 C=CCOc1cc(ccc1Br)C 34a_100012002257_100015514636 [0,2,0,0,0,0|1,0,0]=3 7545 B12R1.374 C=CCOc1cc(ccc1Br)C 7a_100012002257_100015514636 [0,2,0,0,0,0|1,0,0]=3 7546 B12R1.374 C=CCOc1cc(ccc1Br)Cl 34a_100012339455_100015514636 [0,2,0,0,0,0|1,0,0]=3 7547 B12R1.374 C=CCOc1cc(ccc1Br)Cl 7a_100012339455_100015514636 [0,2,0,0,0,0|1,0,0]=3 7548 B12R1.374 C=CCOc1cc(ccc1Br)F 34a_100000690578_100015514636 [0,2,0,0,0,0|1,0,0]=3 7549 B12R1.374 C=CCOc1cc(ccc1Br)F 7a_100000690578_100015514636 [0,2,0,0,0,0|1,0,0]=3 7550 B12R1.374 C=CCOc1cc(ccc1Br)I 34a_100012356990_100015514636 [0,2,0,0,0,0|1,0,0]=3 7551 B12R1.374 C=CCOc1cc(ccc1Br)I 7a_100012356990_100015514636 [0,2,0,0,0,0|1,0,0]=3 7552 B12R1.374 C=CCOc1cc(ccc1C)Br 34a_100000685420_100015514636 [0,2,0,0,0,0|1,0,0]=3 7553 B12R1.374 C=CCOc1cc(ccc1C)Br 7a_100000685420_100015514636 [0,2,0,0,0,0|1,0,0]=3 7554 B12R1.374 C=CCOc1cc(ccc1C)C 34a_100000210931_100015514636 [0,2,0,0,0,0|1,0,0]=3 7555 B12R1.374 C=CCOc1cc(ccc1C)C 7a_100000210931_100015514636 [0,2,0,0,0,0|1,0,0]=3 7556 B12R1.374 C=CCOc1cc(ccc1C)Cl 34a_100000756515_100015514636 [0,2,0,0,0,0|1,0,0]=3 7557 B12R1.374 C=CCOc1cc(ccc1C)Cl 7a_100000756515_100015514636 [0,2,0,0,0,0|1,0,0]=3 7558 B12R1.374 C=CCOc1cc(ccc1C)F 34a_100000690566_100015514636 [0,2,0,0,0,0|1,0,0]=3 7559 B12R1.374 C=CCOc1cc(ccc1C)F 7a_100000690566_100015514636 [0,2,0,0,0,0|1,0,0]=3 7560 B12R1.374 C=CCOc1cc(ccc1C)I 7a_100000766334_100015514636 [0,2,0,0,0,0|1,0,0]=3 7561 B12R1.374 C=CCOc1cc(ccc1C)N 34a_100000759471_100015514636 [0,2,0,0,0,0|1,0,0]=3 7562 B12R1.374 C=CCOc1cc(ccc1C)N 7a_100000759471_100015514636 [0,2,0,0,0,0|1,0,0]=3 7563 B12R1.374 C=CCOc1cc(ccc1Cl)Br 34a_100000738945_100015514636 [0,2,0,0,0,0|1,0,0]=3 7564 B12R1.374 C=CCOc1cc(ccc1Cl)Br 7a_100000738945_100015514636 [0,2,0,0,0,0|1,0,0]=3 7565 B12R1.374 C=CCOc1cc(ccc1Cl)C 34a_100000211493_100015514636 [0,2,0,0,0,0|1,0,0]=3 7566 B12R1.374 C=CCOc1cc(ccc1Cl)C 7a_100000211493_100015514636 [0,2,0,0,0,0|1,0,0]=3 7567 B12R1.374 C=CCOc1cc(ccc1Cl)Cl 34a_100000211422_100015514636 [0,2,0,0,0,0|1,0,0]=3 7568 B12R1.374 C=CCOc1cc(ccc1Cl)Cl 7a_100000211422_100015514636 [0,2,0,0,0,0|1,0,0]=3 7569 B12R1.374 C=CCOc1cc(ccc1Cl)F 34a_100000692107_100015514636 [0,2,0,0,0,0|1,0,0]=3 7570 B12R1.374 C=CCOc1cc(ccc1Cl)F 7a_100000692107_100015514636 [0,2,0,0,0,0|1,0,0]=3 7571 B12R1.374 C=CCOc1cc(ccc1Cl)I 34a_100011356854_100015514636 [0,2,0,0,0,0|1,0,0]=3 7572 B12R1.374 C=CCOc1cc(ccc1Cl)I 7a_100011356854_100015514636 [0,2,0,0,0,0|1,0,0]=3 7573 B12R1.374 C=CCOc1cc(ccc1Cl)N 34a_100011934209_100015514636 [0,2,0,0,0,0|1,0,0]=3 7574 B12R1.374 C=CCOc1cc(ccc1F)Br 34a_100000686035_100015514636 [0,2,0,0,0,0|1,0,0]=3 7575 B12R1.374 C=CCOc1cc(ccc1F)Br 7a_100000686035_100015514636 [0,2,0,0,0,0|1,0,0]=3 7576 B12R1.374 C=CCOc1cc(ccc1F)C 34a_100000759540_100015514636 [0,2,0,0,0,0|1,0,0]=3 7577 B12R1.374 C=CCOc1cc(ccc1F)C 7a_100000759540_100015514636 [0,2,0,0,0,0|1,0,0]=3 7578 B12R1.374 C=CCOc1cc(ccc1F)Cl 34a_100000757397_100015514636 [0,2,0,0,0,0|1,0,0]=3 7579 B12R1.374 C=CCOc1cc(ccc1F)Cl 7a_100000757397_100015514636 [0,2,0,0,0,0|1,0,0]=3 7580 B12R1.374 C=CCOc1cc(ccc1F)F 34a_100000752141_100015514636 [0,2,0,0,0,0|1,0,0]=3 7581 B12R1.374 C=CCOc1cc(ccc1F)F 7a_100000752141_100015514636 [0,2,0,0,0,0|1,0,0]=3 7582 B12R1.374 C=CCOc1cc(ccc1F)I 34a_100009958187_100015514636 [0,2,0,0,0,0|1,0,0]=3 7583 B12R1.374 C=CCOc1cc(ccc1F)I 7a_100009958187_100015514636 [0,2,0,0,0,0|1,0,0]=3 7584 B12R1.374 C=CCOc1cc(ccc1F)N 34a_100012017398_100015514636 [0,2,0,0,0,0|1,0,0]=3 7585 B12R1.374 C=CCOc1cc(ccc1F)N 7a_100012017398_100015514636 [0,2,0,0,0,0|1,0,0]=3 7586 B12R1.374 C=CCOc1cc(ccc1I)Br 34a_100012344904_100015514636 [0,2,0,0,0,0|1,0,0]=3 7587 B12R1.374 C=CCOc1cc(ccc1I)Br 7a_100012344904_100015514636 [0,2,0,0,0,0|1,0,0]=3 7588 B12R1.374 C=CCOc1cc(ccc1I)Cl 34a_100000050036_100015514636 [0,2,0,0,0,0|1,0,0]=3 7589 B12R1.374 C=CCOc1cc(ccc1I)Cl 7a_100000050036_100015514636 [0,2,0,0,0,0|1,0,0]=3 7590 B12R1.374 C=CCOc1cc(ccc1I)F 34a_100010084537_100015514636 [0,2,0,0,0,0|1,0,0]=3 7591 B12R1.374 C=CCOc1cc(ccc1I)F 7a_100010084537_100015514636 [0,2,0,0,0,0|1,0,0]=3 7592 B12R1.374 C=CCOc1cc(ccc1N)Br 34a_100000739049_100015514636 [0,2,0,0,0,0|1,0,0]=3 7593 B12R1.374 C=CCOc1cc(ccc1N)Br 7a_100000739049_100015514636 [0,2,0,0,0,0|1,0,0]=3 7594 B12R1.374 C=CCOc1cc(ccc1N)C 34a_100000211527_100015514636 [0,2,0,0,0,0|1,0,0]=3 7595 B12R1.374 C=CCOc1cc(ccc1N)C 7a_100000211527_100015514636 [0,2,0,0,0,0|1,0,0]=3 7596 B12R1.374 C=CCOc1cc(ccc1N)Cl 34a_100000185728_100015514636 [0,2,0,0,0,0|1,0,0]=3 7597 B12R1.374 C=CCOc1cc(ccc1N)Cl 7a_100000185728_100015514636 [0,2,0,0,0,0|1,0,0]=3 7598 B12R1.374 C=CCOc1cc(ccc1N)F 34a_100000753323_100015514636 [0,2,0,0,0,0|1,0,0]=3 7599 B12R1.374 C=CCOc1cc(ccc1N)F 7a_100000753323_100015514636 [0,2,0,0,0,0|1,0,0]=3 7600 B12R1.374 C=CCOc1cc(ccc1N)I 34a_100000057187_100015514636 [0,2,0,0,0,0|1,0,0]=3 7601 B12R1.374 C=CCOc1cc(ccc1N)I 7a_100000057187_100015514636 [0,2,0,0,0,0|1,0,0]=3 7602 B12R1.374 C=CCOc1cc(ccc1N)N 34a_100025717382_100015514636 [0,2,0,0,0,0|1,0,0]=3 7603 B12R1.374 C=CCOc1cc(cnc1Br)Cl 34a_100000697010_100015514636 [0,2,0,0,0,0|2,0,0]=4 7604 B12R1.374 C=CCOc1cc(cnc1Br)Cl 7a_100000697010_100015514636 [0,2,0,0,0,0|2,0,0]=4 7605 B12R1.374 C=CCOc1cc(cnc1Br)F 34a_100009820119_100015514636 [0,2,0,0,0,0|2,0,0]=4 7606 B12R1.374 C=CCOc1cc(cnc1Br)F 7a_100009820119_100015514636 [0,2,0,0,0,0|2,0,0]=4 7607 B12R1.374 C=CCOc1cc(cnc1C)Br 34a_100009864810_100015514636 [0,2,0,0,0,0|2,0,0]=4 7608 B12R1.374 C=CCOc1cc(cnc1C)Br 7a_100009864810_100015514636 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.374 C=CCOc1cc(cnc1Cl)Br 34a_100012354860_100015514636 [0,2,0,0,0,0|2,0,0]=4 7610 B12R1.374 C=CCOc1cc(cnc1Cl)Br 7a_100012354860_100015514636 [0,2,0,0,0,0|2,0,0]=4 7611 B12R1.374 C=CCOc1cc(cnc1Cl)C 34a_100012000487_100015514636 [0,2,0,0,0,0|2,0,0]=4 7612 B12R1.374 C=CCOc1cc(cnc1Cl)C 7a_100012000487_100015514636 [0,2,0,0,0,0|2,0,0]=4 7613 B12R1.374 C=CCOc1cc(cnc1Cl)F 34a_100000079967_100015514636 [0,2,0,0,0,0|2,0,0]=4 7614 B12R1.374 C=CCOc1cc(cnc1Cl)F 7a_100000079967_100015514636 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.374 C=CCOc1cc(cnc1F)Br 34a_100009819871_100015514636 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.374 C=CCOc1cc(cnc1F)Br 7a_100009819871_100015514636 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.374 C=CCOc1cc(cnc1F)C 34a_100009849810_100015514636 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.374 C=CCOc1cc(cnc1F)C 7a_100009849810_100015514636 [0,2,0,0,0,0|2,0,0]=4 7619 B12R1.374 C=CCOc1cc(cnc1F)Cl 34a_100000094372_100015514636 [0,2,0,0,0,0|2,0,0]=4 7620 B12R1.374 C=CCOc1cc(cnc1F)Cl 7a_100000094372_100015514636 [0,2,0,0,0,0|2,0,0]=4 7621 B12R1.374 C=CCOc1cc(cnc1I)Br 34a_100010210634_100015514636 [0,2,0,0,0,0|2,0,0]=4 7622 B12R1.374 C=CCOc1cc(cnc1I)Br 7a_100010210634_100015514636 [0,2,0,0,0,0|2,0,0]=4 7623 B12R1.374 C=CCOc1cc(cnc1I)Cl 34a_100010233512_100015514636 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.374 C=CCOc1cc(cnc1I)Cl 7a_100010233512_100015514636 [0,2,0,0,0,0|2,0,0]=4 7625 B12R1.374 C=CCOc1cc(cnc1I)F 34a_100015624800_100015514636 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.374 C=CCOc1cc(cnc1I)F 7a_100015624800_100015514636 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.374 C=CCOc1cc(cnc1N)Br 34a_100009819042_100015514636 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.374 C=CCOc1cc(cnc1N)Br 7a_100009819042_100015514636 [0,2,0,0,0,0|2,0,0]=4 7629 B12R1.374 C=CCOc1cc(cnc1N)Cl 34a_100000123674_100015514636 [0,2,0,0,0,0|2,0,0]=4 7630 B12R1.374 C=CCOc1cc(cnc1N)Cl 7a_100000123674_100015514636 [0,2,0,0,0,0|2,0,0]=4 7631 B12R1.374 C=CCOc1cc(cnc1N)F 34a_100000094369_100015514636 [0,2,0,0,0,0|2,0,0]=4 7632 B12R1.374 C=CCOc1cc(cnc1N)F 7a_100000094369_100015514636 [0,2,0,0,0,0|2,0,0]=4 7633 B12R1.374 C=CCOc1cc(ncc1Br)Br 34a_100010235016_100015514636 [0,2,0,0,0,0|2,0,0]=4 7634 B12R1.374 C=CCOc1cc(ncc1Br)C 34a_100011016184_100015514636 [0,2,0,0,0,0|2,0,0]=4 7635 B12R1.374 C=CCOc1cc(ncc1Br)Cl 34a_100010173860_100015514636 [0,2,0,0,0,0|2,0,0]=4 7636 B12R1.374 C=CCOc1cc(ncc1C)Br 34a_100000704368_100015514636 [0,2,0,0,0,0|2,0,0]=4 7637 B12R1.374 C=CCOc1cc(ncc1C)Br 7a_100000704368_100015514636 [0,2,0,0,0,0|2,0,0]=4 7638 B12R1.374 C=CCOc1cc(ncc1Cl)Br 34a_100010173861_100015514636 [0,2,0,0,0,0|2,0,0]=4 7639 B12R1.374 C=CCOc1cc(ncc1F)Br 34a_100009854642_100015514636 [0,2,0,0,0,0|2,0,0]=4 7640 B12R1.374 C=CCOc1cc(ncc1F)Cl 34a_100009851168_100015514636 [0,2,0,0,0,0|2,0,0]=4 7641 B12R1.374 C=CCOc1nc(ccc1Br)C 34a_100009817604_100015514636 [0,2,0,0,0,0|2,0,0]=4 7642 B12R1.374 C=CCOc1nc(ccc1F)Cl 34a_100010729010_100015514636 [0,2,0,0,0,0|2,0,0]=4 7643 B12R1.374 C=CCOc1nc(ccc1N)C 34a_100000687486_100015514636 [0,2,0,0,0,0|2,0,0]=4 7644 B12R1.374 C=CCSc1cc(=O)[nH]cc1F 62a_100000210623_100009817642 [0,2,0,0,0,0|2,0,0]=4 7645 B12R1.374 C=CCSc1cc(=O)[nH]cc1F 62a_100009817642_100000210623 [0,2,0,0,0,0|2,0,0]=4 7646 B12R1.374 C=CCSc1cc(c[nH]c1=O)F 62a_100000210623_100009817720 [0,2,0,0,0,0|1,0,1]=4 7647 B12R1.374 C=CCSc1cc(c[nH]c1=O)F 62a_100009817720_100000210623 [0,2,0,0,0,0|1,0,1]=4 7648 B12R1.374 C=CCSc1cc(ccc1Br)Br 62a_100000210623_100011483371 [0,2,0,0,0,0|1,0,0]=3 7649 B12R1.374 C=CCSc1cc(ccc1Br)Br 62a_100011483371_100000210623 [0,2,0,0,0,0|1,0,0]=3 7650 B12R1.374 C=CCSc1cc(ccc1Br)C 62a_100000210623_100012353751 [0,2,0,0,0,0|1,0,0]=3 7651 B12R1.374 C=CCSc1cc(ccc1Br)C 62a_100012353751_100000210623 [0,2,0,0,0,0|1,0,0]=3 7652 B12R1.374 C=CCSc1cc(ccc1Br)Cl 62a_100000210623_100012339723 [0,2,0,0,0,0|1,0,0]=3 7653 B12R1.374 C=CCSc1cc(ccc1Br)Cl 62a_100012339723_100000210623 [0,2,0,0,0,0|1,0,0]=3 7654 B12R1.374 C=CCSc1cc(ccc1Br)F 62a_100000210623_100011217576 [0,2,0,0,0,0|1,0,0]=3 7655 B12R1.374 C=CCSc1cc(ccc1Br)F 62a_100011217576_100000210623 [0,2,0,0,0,0|1,0,0]=3 7656 B12R1.374 C=CCSc1cc(ccc1Br)N 62a_100000210623_100000750459 [0,2,0,0,0,0|1,0,0]=3 7657 B12R1.374 C=CCSc1cc(ccc1Br)N 62a_100000750459_100000210623 [0,2,0,0,0,0|1,0,0]=3 7658 B12R1.374 C=CCSc1cc(ccc1Br)O 62a_100000210623_100012339312 [0,2,0,0,0,0|1,0,0]=3 7659 B12R1.374 C=CCSc1cc(ccc1Br)O 62a_100012339312_100000210623 [0,2,0,0,0,0|1,0,0]=3 7660 B12R1.374 C=CCSc1cc(ccc1C)Br 62a_100000210623_100011344865 [0,2,0,0,0,0|1,0,0]=3 7661 B12R1.374 C=CCSc1cc(ccc1C)Br 62a_100011344865_100000210623 [0,2,0,0,0,0|1,0,0]=3 7662 B12R1.374 C=CCSc1cc(ccc1C)C 62a_100000210623_100000210833 [0,2,0,0,0,0|1,0,0]=3 7663 B12R1.374 C=CCSc1cc(ccc1C)C 62a_100000210833_100000210623 [0,2,0,0,0,0|1,0,0]=3 7664 B12R1.374 C=CCSc1cc(ccc1C)Cl 62a_100000210623_100011263213 [0,2,0,0,0,0|1,0,0]=3 7665 B12R1.374 C=CCSc1cc(ccc1C)Cl 62a_100011263213_100000210623 [0,2,0,0,0,0|1,0,0]=3 7666 B12R1.374 C=CCSc1cc(ccc1C)F 62a_100000210623_100011218078 [0,2,0,0,0,0|1,0,0]=3 7667 B12R1.374 C=CCSc1cc(ccc1C)F 62a_100011218078_100000210623 [0,2,0,0,0,0|1,0,0]=3 7668 B12R1.374 C=CCSc1cc(ccc1C)N 62a_100000210623_100000736455 [0,2,0,0,0,0|1,0,0]=3 7669 B12R1.374 C=CCSc1cc(ccc1C)N 62a_100000736455_100000210623 [0,2,0,0,0,0|1,0,0]=3 7670 B12R1.374 C=CCSc1cc(ccc1C)O 62a_100000210623_100011380479 [0,2,0,0,0,0|1,0,0]=3 7671 B12R1.374 C=CCSc1cc(ccc1C)O 62a_100011380479_100000210623 [0,2,0,0,0,0|1,0,0]=3 7672 B12R1.374 C=CCSc1cc(ccc1Cl)Br 62a_100000210623_100011772130 [0,2,0,0,0,0|1,0,0]=3 7673 B12R1.374 C=CCSc1cc(ccc1Cl)Br 62a_100011772130_100000210623 [0,2,0,0,0,0|1,0,0]=3 7674 B12R1.374 C=CCSc1cc(ccc1Cl)C 62a_100000210623_100012356289 [0,2,0,0,0,0|1,0,0]=3 7675 B12R1.374 C=CCSc1cc(ccc1Cl)C 62a_100012356289_100000210623 [0,2,0,0,0,0|1,0,0]=3 7676 B12R1.374 C=CCSc1cc(ccc1Cl)Cl 62a_100000210623_100000707729 [0,2,0,0,0,0|1,0,0]=3 7677 B12R1.374 C=CCSc1cc(ccc1Cl)Cl 62a_100000707729_100000210623 [0,2,0,0,0,0|1,0,0]=3 7678 B12R1.374 C=CCSc1cc(ccc1Cl)F 62a_100000210623_100011217299 [0,2,0,0,0,0|1,0,0]=3 7679 B12R1.374 C=CCSc1cc(ccc1Cl)F 62a_100011217299_100000210623 [0,2,0,0,0,0|1,0,0]=3 7680 B12R1.374 C=CCSc1cc(ccc1Cl)N 62a_100000210623_100012360549 [0,2,0,0,0,0|1,0,0]=3 7681 B12R1.374 C=CCSc1cc(ccc1Cl)N 62a_100012360549_100000210623 [0,2,0,0,0,0|1,0,0]=3 7682 B12R1.374 C=CCSc1cc(ccc1Cl)O 62a_100000049588_100000210623 [0,2,0,0,0,0|1,0,0]=3 7683 B12R1.374 C=CCSc1cc(ccc1Cl)O 62a_100000210623_100000049588 [0,2,0,0,0,0|1,0,0]=3 7684 B12R1.374 C=CCSc1cc(ccc1F)Br 62a_100000210623_100011217312 [0,2,0,0,0,0|1,0,0]=3 7685 B12R1.374 C=CCSc1cc(ccc1F)Br 62a_100011217312_100000210623 [0,2,0,0,0,0|1,0,0]=3 7686 B12R1.374 C=CCSc1cc(ccc1F)C 62a_100000210623_100000736223 [0,2,0,0,0,0|1,0,0]=3 7687 B12R1.374 C=CCSc1cc(ccc1F)C 62a_100000736223_100000210623 [0,2,0,0,0,0|1,0,0]=3 7688 B12R1.374 C=CCSc1cc(ccc1F)Cl 62a_100000210623_100011218116 [0,2,0,0,0,0|1,0,0]=3 7689 B12R1.374 C=CCSc1cc(ccc1F)Cl 62a_100011218116_100000210623 [0,2,0,0,0,0|1,0,0]=3 7690 B12R1.374 C=CCSc1cc(ccc1F)F 62a_100000210623_100011219198 [0,2,0,0,0,0|1,0,0]=3 7691 B12R1.374 C=CCSc1cc(ccc1F)F 62a_100011219198_100000210623 [0,2,0,0,0,0|1,0,0]=3 7692 B12R1.374 C=CCSc1cc(ccc1F)N 62a_100000210623_100000760356 [0,2,0,0,0,0|1,0,0]=3 7693 B12R1.374 C=CCSc1cc(ccc1F)N 62a_100000760356_100000210623 [0,2,0,0,0,0|1,0,0]=3 7694 B12R1.374 C=CCSc1cc(ccc1F)O 62a_100000210623_100000693481 [0,2,0,0,0,0|1,0,0]=3 7695 B12R1.374 C=CCSc1cc(ccc1F)O 62a_100000693481_100000210623 [0,2,0,0,0,0|1,0,0]=3 7696 B12R1.374 C=CCSc1cc(ccc1N)Br 62a_100000187925_100000210623 [0,2,0,0,0,0|1,0,0]=3 7697 B12R1.374 C=CCSc1cc(ccc1N)Br 62a_100000210623_100000187925 [0,2,0,0,0,0|1,0,0]=3 7698 B12R1.374 C=CCSc1cc(ccc1N)C 62a_100000210623_100011356834 [0,2,0,0,0,0|1,0,0]=3 7699 B12R1.374 C=CCSc1cc(ccc1N)C 62a_100011356834_100000210623 [0,2,0,0,0,0|1,0,0]=3 7700 B12R1.374 C=CCSc1cc(ccc1N)Cl 62a_100000210623_100000761889 [0,2,0,0,0,0|1,0,0]=3 7701 B12R1.374 C=CCSc1cc(ccc1N)Cl 62a_100000761889_100000210623 [0,2,0,0,0,0|1,0,0]=3 7702 B12R1.374 C=CCSc1cc(ccc1N)F 62a_100000210623_100000760547 [0,2,0,0,0,0|1,0,0]=3 7703 B12R1.374 C=CCSc1cc(ccc1N)F 62a_100000760547_100000210623 [0,2,0,0,0,0|1,0,0]=3 7704 B12R1.374 C=CCSc1cc(ccc1N)N 62a_100000210623_100011534242 [0,2,0,0,0,0|1,0,0]=3 7705 B12R1.374 C=CCSc1cc(ccc1N)N 62a_100011534242_100000210623 [0,2,0,0,0,0|1,0,0]=3 7706 B12R1.374 C=CCSc1cc(ccc1N)O 62a_100000210623_100012001276 [0,2,0,0,0,0|1,0,0]=3 7707 B12R1.374 C=CCSc1cc(ccc1N)O 62a_100012001276_100000210623 [0,2,0,0,0,0|1,0,0]=3 7708 B12R1.374 C=CCSc1cc(ccc1O)Br 62a_100000210623_100012355227 [0,2,0,0,0,0|0,0,0]=2 7709 B12R1.374 C=CCSc1cc(ccc1O)Br 62a_100012355227_100000210623 [0,2,0,0,0,0|0,0,0]=2 7710 B12R1.374 C=CCSc1cc(ccc1O)C 62a_100000210623_100000765521 [0,2,0,0,0,0|0,0,0]=2 7711 B12R1.374 C=CCSc1cc(ccc1O)C 62a_100000765521_100000210623 [0,2,0,0,0,0|0,0,0]=2 7712 B12R1.374 C=CCSc1cc(ccc1O)Cl 62a_100000210623_100011356953 [0,2,0,0,0,0|0,0,0]=2 7713 B12R1.374 C=CCSc1cc(ccc1O)Cl 62a_100011356953_100000210623 [0,2,0,0,0,0|0,0,0]=2 7714 B12R1.374 C=CCSc1cc(ccc1O)F 62a_100000210623_100000211999 [0,2,0,0,0,0|0,0,0]=2 7715 B12R1.374 C=CCSc1cc(ccc1O)F 62a_100000211999_100000210623 [0,2,0,0,0,0|0,0,0]=2 7716 B12R1.374 C=CCSc1cc(ccc1O)N 62a_100000210623_100011534360 [0,2,0,0,0,0|0,0,0]=2 7717 B12R1.374 C=CCSc1cc(ccc1O)N 62a_100011534360_100000210623 [0,2,0,0,0,0|0,0,0]=2 7718 B12R1.374 C=CCSc1cc(ccc1O)O 62a_100000210623_100009813629 [0,2,0,0,0,0|0,0,0]=2 7719 B12R1.374 C=CCSc1cc(cnc1Br)N 62a_100000210623_100010201102 [0,2,0,0,0,0|2,0,0]=4 7720 B12R1.374 C=CCSc1cc(cnc1Br)N 62a_100010201102_100000210623 [0,2,0,0,0,0|2,0,0]=4 7721 B12R1.374 C=CCSc1cc(cnc1C)Br 62a_100000210623_200010090566 [0,2,0,0,0,0|2,0,0]=4 7722 B12R1.374 C=CCSc1cc(cnc1C)Br 62a_200010090566_100000210623 [0,2,0,0,0,0|2,0,0]=4 7723 B12R1.374 C=CCSc1cc(cnc1C)C 62a_100000210623_100009817436 [0,2,0,0,0,0|2,0,0]=4 7724 B12R1.374 C=CCSc1cc(cnc1C)C 62a_100009817436_100000210623 [0,2,0,0,0,0|2,0,0]=4 7725 B12R1.374 C=CCSc1cc(cnc1C)F 62a_100000210623_100009860710 [0,2,0,0,0,0|2,0,0]=4 7726 B12R1.374 C=CCSc1cc(cnc1C)F 62a_100009860710_100000210623 [0,2,0,0,0,0|2,0,0]=4 7727 B12R1.374 C=CCSc1cc(cnc1C)N 62a_100000210623_100011998591 [0,2,0,0,0,0|2,0,0]=4 7728 B12R1.374 C=CCSc1cc(cnc1C)N 62a_100011998591_100000210623 [0,2,0,0,0,0|2,0,0]=4 7729 B12R1.374 C=CCSc1cc(cnc1C)O 62a_100000210623_100009819603 [0,2,0,0,0,0|2,0,0]=4 7730 B12R1.374 C=CCSc1cc(cnc1C)O 62a_100009819603_100000210623 [0,2,0,0,0,0|2,0,0]=4 7731 B12R1.374 C=CCSc1cc(cnc1Cl)Br 62a_100000210623_100009814771 [0,2,0,0,0,0|2,0,0]=4 7732 B12R1.374 C=CCSc1cc(cnc1Cl)Br 62a_100009814771_100000210623 [0,2,0,0,0,0|2,0,0]=4 7733 B12R1.374 C=CCSc1cc(cnc1Cl)C 62a_100000210623_100010210167 [0,2,0,0,0,0|2,0,0]=4 7734 B12R1.374 C=CCSc1cc(cnc1Cl)C 62a_100010210167_100000210623 [0,2,0,0,0,0|2,0,0]=4 7735 B12R1.374 C=CCSc1cc(cnc1Cl)Cl 62a_100000210623_200000062399 [0,2,0,0,0,0|2,0,0]=4 7736 B12R1.374 C=CCSc1cc(cnc1Cl)Cl 62a_200000062399_100000210623 [0,2,0,0,0,0|2,0,0]=4 7737 B12R1.374 C=CCSc1cc(cnc1Cl)N 62a_100000210623_100010253917 [0,2,0,0,0,0|2,0,0]=4 7738 B12R1.374 C=CCSc1cc(cnc1Cl)N 62a_100010253917_100000210623 [0,2,0,0,0,0|2,0,0]=4 7739 B12R1.374 C=CCSc1cc(cnc1F)Br 62a_100000210623_100010172738 [0,2,0,0,0,0|2,0,0]=4 7740 B12R1.374 C=CCSc1cc(cnc1F)Br 62a_100010172738_100000210623 [0,2,0,0,0,0|2,0,0]=4 7741 B12R1.374 C=CCSc1cc(cnc1F)C 62a_100000049784_100000210623 [0,2,0,0,0,0|2,0,0]=4 7742 B12R1.374 C=CCSc1cc(cnc1F)C 62a_100000210623_100000049784 [0,2,0,0,0,0|2,0,0]=4 7743 B12R1.374 C=CCSc1cc(cnc1F)Cl 62a_100000210623_100010188783 [0,2,0,0,0,0|2,0,0]=4 7744 B12R1.374 C=CCSc1cc(cnc1F)Cl 62a_100010188783_100000210623 [0,2,0,0,0,0|2,0,0]=4 7745 B12R1.374 C=CCSc1cc(cnc1F)F 62a_100000210623_100009820768 [0,2,0,0,0,0|2,0,0]=4 7746 B12R1.374 C=CCSc1cc(cnc1F)F 62a_100009820768_100000210623 [0,2,0,0,0,0|2,0,0]=4 7747 B12R1.374 C=CCSc1cc(cnc1F)N 62a_100000210623_100009840397 [0,2,0,0,0,0|2,0,0]=4 7748 B12R1.374 C=CCSc1cc(cnc1F)N 62a_100009840397_100000210623 [0,2,0,0,0,0|2,0,0]=4 7749 B12R1.374 C=CCSc1cc(cnc1F)O 62a_100000210623_100009817267 [0,2,0,0,0,0|2,0,0]=4 7750 B12R1.374 C=CCSc1cc(cnc1F)O 62a_100009817267_100000210623 [0,2,0,0,0,0|2,0,0]=4 7751 B12R1.374 C=CCSc1cc(cnc1N)Br 62a_100000210623_100000760472 [0,2,0,0,0,0|2,0,0]=4 7752 B12R1.374 C=CCSc1cc(cnc1N)Br 62a_100000760472_100000210623 [0,2,0,0,0,0|2,0,0]=4 7753 B12R1.374 C=CCSc1cc(cnc1N)C 62a_100000049664_100000210623 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.374 C=CCSc1cc(cnc1N)C 62a_100000210623_100000049664 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.374 C=CCSc1cc(cnc1N)Cl 62a_100000050159_100000210623 [0,2,0,0,0,0|2,0,0]=4 7756 B12R1.374 C=CCSc1cc(cnc1N)Cl 62a_100000210623_100000050159 [0,2,0,0,0,0|2,0,0]=4 7757 B12R1.374 C=CCSc1cc(cnc1N)F 62a_100000210623_100009814671 [0,2,0,0,0,0|2,0,0]=4 7758 B12R1.374 C=CCSc1cc(cnc1N)F 62a_100009814671_100000210623 [0,2,0,0,0,0|2,0,0]=4 7759 B12R1.374 C=CCSc1cc(cnc1N)N 62a_100000210623_200011934315 [0,2,0,0,0,0|2,0,0]=4 7760 B12R1.374 C=CCSc1cc(cnc1N)N 62a_200011934315_100000210623 [0,2,0,0,0,0|2,0,0]=4 7761 B12R1.374 C=CCSc1cc(cnc1O)Br 62a_100000210623_100010197142 [0,2,0,0,0,0|1,0,0]=3 7762 B12R1.374 C=CCSc1cc(cnc1O)Br 62a_100010197142_100000210623 [0,2,0,0,0,0|1,0,0]=3 7763 B12R1.374 C=CCSc1cc(cnc1O)C 62a_100000210623_100000719714 [0,2,0,0,0,0|1,0,0]=3 7764 B12R1.374 C=CCSc1cc(cnc1O)C 62a_100000719714_100000210623 [0,2,0,0,0,0|1,0,0]=3 7765 B12R1.374 C=CCSc1cc(cnc1O)Cl 62a_100000210623_100010188700 [0,2,0,0,0,0|1,0,0]=3 7766 B12R1.374 C=CCSc1cc(cnc1O)Cl 62a_100010188700_100000210623 [0,2,0,0,0,0|1,0,0]=3 7767 B12R1.374 C=CCSc1cc(ncc1Br)Br 62a_100000210623_100010171693 [0,2,0,0,0,0|2,0,0]=4 7768 B12R1.374 C=CCSc1cc(ncc1Br)Br 62a_100010171693_100000210623 [0,2,0,0,0,0|2,0,0]=4 7769 B12R1.374 C=CCSc1cc(ncc1Br)Cl 62a_100000210623_100009815598 [0,2,0,0,0,0|2,0,0]=4 7770 B12R1.374 C=CCSc1cc(ncc1Br)Cl 62a_100009815598_100000210623 [0,2,0,0,0,0|2,0,0]=4 7771 B12R1.374 C=CCSc1cc(ncc1C)Br 62a_100000210623_100010067628 [0,2,0,0,0,0|2,0,0]=4 7772 B12R1.374 C=CCSc1cc(ncc1C)Br 62a_100010067628_100000210623 [0,2,0,0,0,0|2,0,0]=4 7773 B12R1.374 C=CCSc1cc(ncc1C)C 62a_100000210623_100009862788 [0,2,0,0,0,0|2,0,0]=4 7774 B12R1.374 C=CCSc1cc(ncc1C)C 62a_100009862788_100000210623 [0,2,0,0,0,0|2,0,0]=4 7775 B12R1.374 C=CCSc1cc(ncc1C)Cl 62a_100000210623_100010068021 [0,2,0,0,0,0|2,0,0]=4 7776 B12R1.374 C=CCSc1cc(ncc1C)Cl 62a_100010068021_100000210623 [0,2,0,0,0,0|2,0,0]=4 7777 B12R1.374 C=CCSc1cc(ncc1C)F 62a_100000049870_100000210623 [0,2,0,0,0,0|2,0,0]=4 7778 B12R1.374 C=CCSc1cc(ncc1C)F 62a_100000210623_100000049870 [0,2,0,0,0,0|2,0,0]=4 7779 B12R1.374 C=CCSc1cc(ncc1C)N 62a_100000210623_100009819938 [0,2,0,0,0,0|2,0,0]=4 7780 B12R1.374 C=CCSc1cc(ncc1C)N 62a_100009819938_100000210623 [0,2,0,0,0,0|2,0,0]=4 7781 B12R1.374 C=CCSc1cc(ncc1C)O 62a_100000210623_100009831917 [0,2,0,0,0,0|2,0,0]=4 7782 B12R1.374 C=CCSc1cc(ncc1C)O 62a_100009831917_100000210623 [0,2,0,0,0,0|2,0,0]=4 7783 B12R1.374 C=CCSc1cc(ncc1Cl)Br 62a_100000210623_100010223331 [0,2,0,0,0,0|2,0,0]=4 7784 B12R1.374 C=CCSc1cc(ncc1Cl)Br 62a_100010223331_100000210623 [0,2,0,0,0,0|2,0,0]=4 7785 B12R1.374 C=CCSc1cc(ncc1Cl)Cl 62a_100000210623_100010172835 [0,2,0,0,0,0|2,0,0]=4 7786 B12R1.374 C=CCSc1cc(ncc1Cl)Cl 62a_100010172835_100000210623 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.374 C=CCSc1cc(ncc1Cl)F 62a_100000210623_100009892587 [0,2,0,0,0,0|2,0,0]=4 7788 B12R1.374 C=CCSc1cc(ncc1Cl)F 62a_100009892587_100000210623 [0,2,0,0,0,0|2,0,0]=4 7789 B12R1.374 C=CCSc1cc(ncc1Cl)N 62a_100000210623_100010134119 [0,2,0,0,0,0|2,0,0]=4 7790 B12R1.374 C=CCSc1cc(ncc1Cl)N 62a_100010134119_100000210623 [0,2,0,0,0,0|2,0,0]=4 7791 B12R1.374 C=CCSc1cc(ncc1F)Br 62a_100000210623_100010193852 [0,2,0,0,0,0|2,0,0]=4 7792 B12R1.374 C=CCSc1cc(ncc1F)Br 62a_100010193852_100000210623 [0,2,0,0,0,0|2,0,0]=4 7793 B12R1.374 C=CCSc1cc(ncc1F)C 62a_100000210623_100009867690 [0,2,0,0,0,0|2,0,0]=4 7794 B12R1.374 C=CCSc1cc(ncc1F)C 62a_100009867690_100000210623 [0,2,0,0,0,0|2,0,0]=4 7795 B12R1.374 C=CCSc1cc(ncc1F)Cl 62a_100000210623_100000708277 [0,2,0,0,0,0|2,0,0]=4 7796 B12R1.374 C=CCSc1cc(ncc1F)Cl 62a_100000708277_100000210623 [0,2,0,0,0,0|2,0,0]=4 7797 B12R1.374 C=CCSc1cc(ncc1F)F 62a_100000210623_100010233071 [0,2,0,0,0,0|2,0,0]=4 7798 B12R1.374 C=CCSc1cc(ncc1F)F 62a_100010233071_100000210623 [0,2,0,0,0,0|2,0,0]=4 7799 B12R1.374 C=CCSc1cc(ncc1F)N 62a_100000210623_100015713587 [0,2,0,0,0,0|2,0,0]=4 7800 B12R1.374 C=CCSc1cc(ncc1F)N 62a_100015713587_100000210623 [0,2,0,0,0,0|2,0,0]=4 7801 B12R1.374 C=CCSc1cc(ncc1N)Cl 62a_100000050123_100000210623 [0,2,0,0,0,0|2,0,0]=4 7802 B12R1.374 C=CCSc1cc(ncc1N)Cl 62a_100000210623_100000050123 [0,2,0,0,0,0|2,0,0]=4 7803 B12R1.374 C=CCSc1cc(ncc1O)C 62a_100000210623_100009843476 [0,2,0,0,0,0|1,0,0]=3 7804 B12R1.374 C=CCSc1cc(ncc1O)C 62a_100009843476_100000210623 [0,2,0,0,0,0|1,0,0]=3 7805 B12R1.374 C=CCSc1cc(ncc1O)Cl 62a_100000210623_100000698892 [0,2,0,0,0,0|1,0,0]=3 7806 B12R1.374 C=CCSc1cc(ncc1O)Cl 62a_100000698892_100000210623 [0,2,0,0,0,0|1,0,0]=3 7807 B12R1.374 C=CCSc1cc(nnc1O)O 62a_100000210623_100000759565 [0,2,0,0,0,0|2,0,0]=4 7808 B12R1.374 C=CCSc1cn(ccc1=O)C 62a_100000210623_100010750718 [0,2,0,0,0,0|1,0,1]=4 7809 B12R1.374 C=CCSc1cn(ccc1=O)C 62a_100010750718_100000210623 [0,2,0,0,0,0|1,0,1]=4 7810 B12R1.374 C=CCSc1nc(ccc1Br)N 62a_100000210623_100010192275 [0,2,0,0,0,0|2,0,0]=4 7811 B12R1.374 C=CCSc1nc(ccc1Br)N 62a_100010192275_100000210623 [0,2,0,0,0,0|2,0,0]=4 7812 B12R1.374 C=CCSc1nc(ccc1C)C 62a_100000210623_100009854376 [0,2,0,0,0,0|2,0,0]=4 7813 B12R1.374 C=CCSc1nc(ccc1C)C 62a_100009854376_100000210623 [0,2,0,0,0,0|2,0,0]=4 7814 B12R1.374 C=CCSc1nc(ccc1C)N 62a_100000126722_100000210623 [0,2,0,0,0,0|2,0,0]=4 7815 B12R1.374 C=CCSc1nc(ccc1C)N 62a_100000210623_100000126722 [0,2,0,0,0,0|2,0,0]=4 7816 B12R1.374 C=CCSc1nc(ccc1F)C 62a_100000210623_100009817602 [0,2,0,0,0,0|2,0,0]=4 7817 B12R1.374 C=CCSc1nc(ccc1F)C 62a_100009817602_100000210623 [0,2,0,0,0,0|2,0,0]=4 7818 B12R1.374 C=CCSc1nc(ccc1F)Cl 62a_100000210623_100010136221 [0,2,0,0,0,0|2,0,0]=4 7819 B12R1.374 C=CCSc1nc(ccc1F)Cl 62a_100010136221_100000210623 [0,2,0,0,0,0|2,0,0]=4 7820 B12R1.374 C=CCSc1nc(ccc1F)F 62a_100000210623_100010997973 [0,2,0,0,0,0|2,0,0]=4 7821 B12R1.374 C=CCSc1nc(ccc1F)F 62a_100010997973_100000210623 [0,2,0,0,0,0|2,0,0]=4 7822 B12R1.374 C=CCSc1nc(ccc1F)N 62a_100000210623_100010892222 [0,2,0,0,0,0|2,0,0]=4 7823 B12R1.374 C=CCSc1nc(ccc1F)N 62a_100010892222_100000210623 [0,2,0,0,0,0|2,0,0]=4 7824 B12R1.374 C=CCSc1nc(ccc1N)Br 62a_100000210623_100010168765 [0,2,0,0,0,0|2,0,0]=4 7825 B12R1.374 C=CCSc1nc(ccc1N)Br 62a_100010168765_100000210623 [0,2,0,0,0,0|2,0,0]=4 7826 B12R1.374 C=CCSc1nc(ccc1N)C 62a_100000210623_100000685570 [0,2,0,0,0,0|2,0,0]=4 7827 B12R1.374 C=CCSc1nc(ccc1N)C 62a_100000685570_100000210623 [0,2,0,0,0,0|2,0,0]=4 7828 B12R1.374 C=CCSc1nc(ccc1N)Cl 62a_100000210623_100010233647 [0,2,0,0,0,0|2,0,0]=4 7829 B12R1.374 C=CCSc1nc(ccc1N)Cl 62a_100010233647_100000210623 [0,2,0,0,0,0|2,0,0]=4 7830 B12R1.374 C=CCSc1nc(ccc1N)F 62a_100000210623_100009879877 [0,2,0,0,0,0|2,0,0]=4 7831 B12R1.374 C=CCSc1nc(ccc1N)F 62a_100009879877_100000210623 [0,2,0,0,0,0|2,0,0]=4 7832 B12R1.374 C=CCSc1nc(ccc1N)N 62a_100000210623_200009884323 [0,2,0,0,0,0|2,0,0]=4 7833 B12R1.374 C=CCSc1nc(ccc1N)N 62a_200009884323_100000210623 [0,2,0,0,0,0|2,0,0]=4 7834 B12R1.374 C=CCSc1nc(ccc1O)Br 62a_100000210623_100010253912 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.374 C=CCSc1nc(ccc1O)Br 62a_100010253912_100000210623 [0,2,0,0,0,0|1,0,0]=3 7836 B12R1.374 C=CCSc1nc(ccc1O)C 62a_100000210623_100000702858 [0,2,0,0,0,0|1,0,0]=3 7837 B12R1.374 C=CCSc1nc(ccc1O)C 62a_100000702858_100000210623 [0,2,0,0,0,0|1,0,0]=3 7838 B12R1.374 C=CCSc1nc(ccc1O)Cl 62a_100000210623_100000696390 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.374 C=CCSc1nc(ccc1O)F 62a_100000210623_100010382442 [0,2,0,0,0,0|1,0,0]=3 7840 B12R1.374 C=CCSc1nc(ccc1O)F 62a_100010382442_100000210623 [0,2,0,0,0,0|1,0,0]=3 7841 B12R1.374 CCCCc1cc(ccc1O)Br 271570a_100020621405_100012355227 [0,2,0,0,0,0|0,0,2]=4 7842 B12R1.374 CCCCc1cc(ccc1O)C 271570a_100020621405_100000765521 [0,2,0,0,0,0|0,0,2]=4 7843 B12R1.374 CCCCc1cc(ccc1O)Cl 271570a_100020621405_100011356953 [0,2,0,0,0,0|0,0,2]=4 7844 B12R1.374 CCCCc1cc(ccc1O)F 271570a_100020621405_100000211999 [0,2,0,0,0,0|0,0,2]=4 7845 B12R1.374 CCCCc1cc(ccc1O)N 271570a_100020621405_100011534360 [0,2,0,0,0,0|0,0,2]=4 7846 B12R1.374 CCCCc1cc(ccc1O)O 271570a_100020621405_100009813629 [0,2,0,0,0,0|0,0,2]=4 7847 B12R1.374 CCCNc1cc(ccc1O)Br 34a_100000752626_100000210303 [0,2,0,0,0,0|0,0,2]=4 7848 B12R1.374 CCCNc1cc(ccc1O)C 34a_100011215204_100000210303 [0,2,0,0,0,0|0,0,2]=4 7849 B12R1.374 CCCNc1cc(ccc1O)Cl 34a_100000210500_100000210303 [0,2,0,0,0,0|0,0,2]=4 7850 B12R1.374 CCCNc1cc(ccc1O)F 34a_100000759472_100000210303 [0,2,0,0,0,0|0,0,2]=4 7851 B12R1.374 CCCOc1cc(ccc1O)F 271570a_203496583355_200012344540 [0,2,0,0,0,0|0,0,2]=4 7852 B12R1.374 CCCSc1cc(ccc1O)Br 62a_100000210303_100012355227 [0,2,0,0,0,0|0,0,2]=4 7853 B12R1.374 CCCSc1cc(ccc1O)Br 62a_100012355227_100000210303 [0,2,0,0,0,0|0,0,2]=4 7854 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000210303_100000765521 [0,2,0,0,0,0|0,0,2]=4 7855 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000765521_100000210303 [0,2,0,0,0,0|0,0,2]=4 7856 B12R1.374 CCCSc1cc(ccc1O)Cl 62a_100000210303_100011356953 [0,2,0,0,0,0|0,0,2]=4 7857 B12R1.374 CCCSc1cc(ccc1O)Cl 62a_100011356953_100000210303 [0,2,0,0,0,0|0,0,2]=4 7858 B12R1.374 CCCSc1cc(ccc1O)F 62a_100000210303_100000211999 [0,2,0,0,0,0|0,0,2]=4 7859 B12R1.374 CCCSc1cc(ccc1O)F 62a_100000211999_100000210303 [0,2,0,0,0,0|0,0,2]=4 7860 B12R1.374 CCCSc1cc(ccc1O)N 62a_100000210303_100011534360 [0,2,0,0,0,0|0,0,2]=4 7861 B12R1.374 CCCSc1cc(ccc1O)N 62a_100011534360_100000210303 [0,2,0,0,0,0|0,0,2]=4 7862 B12R1.374 CCCSc1cc(ccc1O)O 62a_100000210303_100009813629 [0,2,0,0,0,0|0,0,2]=4 7863 B12R1.374 CCNCc1cc(ccc1O)Br 34a_100000730032_100000210202 [0,2,0,0,0,0|0,0,2]=4 7864 B12R1.374 CCNCc1cc(ccc1O)Cl 34a_100000238540_100000210202 [0,2,0,0,0,0|0,0,2]=4 7865 B12R1.374 CCNCc1cc(ccc1O)O 271570a_203496583355_100000765307 [0,2,0,0,0,0|0,0,2]=4 7866 B12R1.374 CCOCc1cc(ccc1O)F 34a_100121572206_100010161318 [0,2,0,0,0,0|0,0,2]=4 7867 B12R1.374 CCSCc1cc(ccc1O)F 62a_100000210202_100010161318 [0,2,0,0,0,0|0,0,2]=4 7868 B12R1.374 CCSCc1cc(ccc1O)F 62a_100010161318_100000210202 [0,2,0,0,0,0|0,0,2]=4 7869 B12R1.374 COCOc1cc(ccc1O)C 271570a_203496583355_200023989289 [0,2,0,0,0,0|1,0,1]=4 7870 B12R1.374 COCOc1cc(ccc1O)F 271570a_203496583355_200012568746 [0,2,0,0,0,0|1,0,1]=4 7871 B12R1.374 COCSc1cc(ccc1O)Br 62a_100000766300_100012355227 [0,2,0,0,0,0|1,0,1]=4 7872 B12R1.374 COCSc1cc(ccc1O)Br 62a_100012355227_100000766300 [0,2,0,0,0,0|1,0,1]=4 7873 B12R1.374 COCSc1cc(ccc1O)C 62a_100000765521_100000766300 [0,2,0,0,0,0|1,0,1]=4 7874 B12R1.374 COCSc1cc(ccc1O)C 62a_100000766300_100000765521 [0,2,0,0,0,0|1,0,1]=4 7875 B12R1.374 COCSc1cc(ccc1O)Cl 62a_100000766300_100011356953 [0,2,0,0,0,0|1,0,1]=4 7876 B12R1.374 COCSc1cc(ccc1O)Cl 62a_100011356953_100000766300 [0,2,0,0,0,0|1,0,1]=4 7877 B12R1.374 COCSc1cc(ccc1O)F 62a_100000211999_100000766300 [0,2,0,0,0,0|1,0,1]=4 7878 B12R1.374 COCSc1cc(ccc1O)F 62a_100000766300_100000211999 [0,2,0,0,0,0|1,0,1]=4 7879 B12R1.374 COCSc1cc(ccc1O)N 62a_100000766300_100011534360 [0,2,0,0,0,0|1,0,1]=4 7880 B12R1.374 COCSc1cc(ccc1O)N 62a_100011534360_100000766300 [0,2,0,0,0,0|1,0,1]=4 7881 B12R1.374 COCSc1cc(ccc1O)O 62a_100000766300_100009813629 [0,2,0,0,0,0|1,0,1]=4 7882 B12R1.374 CSCNc1cc(ccc1O)Br 34a_100000752626_100011218213 [0,2,0,0,0,0|1,0,1]=4 7883 B12R1.374 CSCNc1cc(ccc1O)C 34a_100011215204_100011218213 [0,2,0,0,0,0|1,0,1]=4 7884 B12R1.374 CSCNc1cc(ccc1O)Cl 34a_100000210500_100011218213 [0,2,0,0,0,0|1,0,1]=4 7885 B12R1.374 CSCNc1cc(ccc1O)F 34a_100000759472_100011218213 [0,2,0,0,0,0|1,0,1]=4 7886 B12R1.374 CSCSc1cc(ccc1O)Br 62a_100011218213_100012355227 [0,2,0,0,0,0|1,0,1]=4 7887 B12R1.374 CSCSc1cc(ccc1O)Br 62a_100012355227_100011218213 [0,2,0,0,0,0|1,0,1]=4 7888 B12R1.374 CSCSc1cc(ccc1O)C 62a_100000765521_100011218213 [0,2,0,0,0,0|1,0,1]=4 7889 B12R1.374 CSCSc1cc(ccc1O)C 62a_100011218213_100000765521 [0,2,0,0,0,0|1,0,1]=4 7890 B12R1.374 CSCSc1cc(ccc1O)Cl 62a_100011218213_100011356953 [0,2,0,0,0,0|1,0,1]=4 7891 B12R1.374 CSCSc1cc(ccc1O)Cl 62a_100011356953_100011218213 [0,2,0,0,0,0|1,0,1]=4 7892 B12R1.374 CSCSc1cc(ccc1O)F 62a_100000211999_100011218213 [0,2,0,0,0,0|1,0,1]=4 7893 B12R1.374 CSCSc1cc(ccc1O)F 62a_100011218213_100000211999 [0,2,0,0,0,0|1,0,1]=4 7894 B12R1.374 CSCSc1cc(ccc1O)N 62a_100011218213_100011534360 [0,2,0,0,0,0|1,0,1]=4 7895 B12R1.374 CSCSc1cc(ccc1O)N 62a_100011534360_100011218213 [0,2,0,0,0,0|1,0,1]=4 7896 B12R1.374 CSCSc1cc(ccc1O)O 62a_100011218213_100009813629 [0,2,0,0,0,0|1,0,1]=4 7897 B12R1.374 Cc1cc(c(cn1)O)SCC=O 62a_100009843476_200015260668 [0,2,0,0,0,0|2,0,0]=4 7898 B12R1.374 Cc1cc(c(cn1)O)SCC=O 62a_200015260668_100009843476 [0,2,0,0,0,0|2,0,0]=4 7899 B12R1.374 Cc1ccc(c(c1)NCC=O)Br 34a_100000745044_200009817547 [0,2,0,0,0,0|2,0,0]=4 7900 B12R1.374 Cc1ccc(c(c1)NCC=O)C 2230a_100000185781_200015260668 [0,2,0,0,0,0|2,0,0]=4 7901 B12R1.374 Cc1ccc(c(c1)NCC=O)C 34a_100000185781_200009817547 [0,2,0,0,0,0|2,0,0]=4 7902 B12R1.374 Cc1ccc(c(c1)NCC=O)C 7a_100000185781_200015260668 [0,2,0,0,0,0|2,0,0]=4 7903 B12R1.374 Cc1ccc(c(c1)NCC=O)Cl 34a_100011215360_200009817547 [0,2,0,0,0,0|2,0,0]=4 7904 B12R1.374 Cc1ccc(c(c1)NCC=O)F 34a_100000211285_200009817547 [0,2,0,0,0,0|2,0,0]=4 7905 B12R1.374 Cc1ccc(c(c1)NCC=O)I 34a_100011216686_200009817547 [0,2,0,0,0,0|2,0,0]=4 7906 B12R1.374 Cc1ccc(c(c1)NCC=O)O 34a_100011215204_200009817547 [0,2,0,0,0,0|1,0,0]=3 7907 B12R1.374 Cc1ccc(c(c1)NCCF)O 34a_100011215204_100011217306 [0,2,0,0,0,0|1,0,1]=4 7908 B12R1.374 Cc1ccc(c(c1)NCCO)O 34a_100011215204_100000211926 [0,2,0,0,0,0|1,0,1]=4 7909 B12R1.374 Cc1ccc(c(c1)OCC=O)Br 34a_100012002257_200009817547 [0,2,0,0,0,0|2,0,0]=4 7910 B12R1.374 Cc1ccc(c(c1)OCC=O)Br 7a_100012002257_200015260668 [0,2,0,0,0,0|2,0,0]=4 7911 B12R1.374 Cc1ccc(c(c1)OCC=O)C 34a_100000210931_200009817547 [0,2,0,0,0,0|2,0,0]=4 7912 B12R1.374 Cc1ccc(c(c1)OCC=O)C 7a_100000210931_200015260668 [0,2,0,0,0,0|2,0,0]=4 7913 B12R1.374 Cc1ccc(c(c1)OCC=O)Cl 34a_100000211493_200009817547 [0,2,0,0,0,0|2,0,0]=4 7914 B12R1.374 Cc1ccc(c(c1)OCC=O)Cl 7a_100000211493_200015260668 [0,2,0,0,0,0|2,0,0]=4 7915 B12R1.374 Cc1ccc(c(c1)OCC=O)F 34a_100000759540_200009817547 [0,2,0,0,0,0|2,0,0]=4 7916 B12R1.374 Cc1ccc(c(c1)OCC=O)F 7a_100000759540_200015260668 [0,2,0,0,0,0|2,0,0]=4 7917 B12R1.374 Cc1ccc(c(c1)OCC=O)N 34a_100000211527_200009817547 [0,2,0,0,0,0|2,0,0]=4 7918 B12R1.374 Cc1ccc(c(c1)OCC=O)N 7a_100000211527_200015260668 [0,2,0,0,0,0|2,0,0]=4 7919 B12R1.374 Cc1ccc(c(c1)SCC#N)O 62a_100000765521_100011215382 [0,2,0,0,0,0|1,0,1]=4 7920 B12R1.374 Cc1ccc(c(c1)SCC#N)O 62a_100011215382_100000765521 [0,2,0,0,0,0|1,0,1]=4 7921 B12R1.374 Cc1ccc(c(c1)SCC=O)Br 62a_100012353751_200015260668 [0,2,0,0,0,0|2,0,0]=4 7922 B12R1.374 Cc1ccc(c(c1)SCC=O)Br 62a_200015260668_100012353751 [0,2,0,0,0,0|2,0,0]=4 7923 B12R1.374 Cc1ccc(c(c1)SCC=O)C 62a_100000210833_200015260668 [0,2,0,0,0,0|2,0,0]=4 7924 B12R1.374 Cc1ccc(c(c1)SCC=O)C 62a_200015260668_100000210833 [0,2,0,0,0,0|2,0,0]=4 7925 B12R1.374 Cc1ccc(c(c1)SCC=O)Cl 62a_100012356289_200015260668 [0,2,0,0,0,0|2,0,0]=4 7926 B12R1.374 Cc1ccc(c(c1)SCC=O)Cl 62a_200015260668_100012356289 [0,2,0,0,0,0|2,0,0]=4 7927 B12R1.374 Cc1ccc(c(c1)SCC=O)F 62a_100000736223_200015260668 [0,2,0,0,0,0|2,0,0]=4 7928 B12R1.374 Cc1ccc(c(c1)SCC=O)F 62a_200015260668_100000736223 [0,2,0,0,0,0|2,0,0]=4 7929 B12R1.374 Cc1ccc(c(c1)SCC=O)N 62a_100011356834_200015260668 [0,2,0,0,0,0|2,0,0]=4 7930 B12R1.374 Cc1ccc(c(c1)SCC=O)N 62a_200015260668_100011356834 [0,2,0,0,0,0|2,0,0]=4 7931 B12R1.374 Cc1ccc(c(c1)SCC=O)O 62a_100000765521_200015260668 [0,2,0,0,0,0|1,0,0]=3 7932 B12R1.374 Cc1ccc(c(c1)SCC=O)O 62a_200015260668_100000765521 [0,2,0,0,0,0|1,0,0]=3 7933 B12R1.374 Cc1ccc(c(c1)SCCF)O 62a_100000765521_100011217306 [0,2,0,0,0,0|1,0,1]=4 7934 B12R1.374 Cc1ccc(c(c1)SCCF)O 62a_100011217306_100000765521 [0,2,0,0,0,0|1,0,1]=4 7935 B12R1.374 Cc1ccc(c(c1)SCCO)O 62a_100000211926_100000765521 [0,2,0,0,0,0|1,0,1]=4 7936 B12R1.374 Cc1ccc(c(c1)SCCO)O 62a_100000765521_100000211926 [0,2,0,0,0,0|1,0,1]=4 7937 B12R1.374 Cc1ccc(c(n1)SCC=O)O 62a_100000702858_200015260668 [0,2,0,0,0,0|2,0,0]=4 7938 B12R1.374 Cc1ccc(c(n1)SCC=O)O 62a_200015260668_100000702858 [0,2,0,0,0,0|2,0,0]=4 7939 B12R1.374 Cc1ccc(cc1NCC=O)Br 34a_100000741167_200009817547 [0,2,0,0,0,0|2,0,0]=4 7940 B12R1.374 Cc1ccc(cc1NCC=O)Br 7a_100000741167_200015260668 [0,2,0,0,0,0|2,0,0]=4 7941 B12R1.374 Cc1ccc(cc1NCC=O)Cl 34a_100000211374_200009817547 [0,2,0,0,0,0|2,0,0]=4 7942 B12R1.374 Cc1ccc(cc1NCC=O)Cl 7a_100000211374_200015260668 [0,2,0,0,0,0|2,0,0]=4 7943 B12R1.374 Cc1ccc(cc1NCC=O)F 34a_100000211107_200009817547 [0,2,0,0,0,0|2,0,0]=4 7944 B12R1.374 Cc1ccc(cc1NCC=O)F 7a_100000211107_200015260668 [0,2,0,0,0,0|2,0,0]=4 7945 B12R1.374 Cc1ccc(cc1NCC=O)I 7a_100000761890_200015260668 [0,2,0,0,0,0|2,0,0]=4 7946 B12R1.374 Cc1ccc(cc1NCC=O)O 34a_100011216113_200009817547 [0,2,0,0,0,0|2,0,0]=4 7947 B12R1.374 Cc1ccc(cc1OCC=O)Br 34a_100000685420_200009817547 [0,2,0,0,0,0|2,0,0]=4 7948 B12R1.374 Cc1ccc(cc1OCC=O)Br 7a_100000685420_200015260668 [0,2,0,0,0,0|2,0,0]=4 7949 B12R1.374 Cc1ccc(cc1OCC=O)Cl 34a_100000756515_200009817547 [0,2,0,0,0,0|2,0,0]=4 7950 B12R1.374 Cc1ccc(cc1OCC=O)Cl 7a_100000756515_200015260668 [0,2,0,0,0,0|2,0,0]=4 7951 B12R1.374 Cc1ccc(cc1OCC=O)F 34a_100000690566_200009817547 [0,2,0,0,0,0|2,0,0]=4 7952 B12R1.374 Cc1ccc(cc1OCC=O)F 7a_100000690566_200015260668 [0,2,0,0,0,0|2,0,0]=4 7953 B12R1.374 Cc1ccc(cc1OCC=O)I 7a_100000766334_200015260668 [0,2,0,0,0,0|2,0,0]=4 7954 B12R1.374 Cc1ccc(cc1OCC=O)N 34a_100000759471_200009817547 [0,2,0,0,0,0|2,0,0]=4 7955 B12R1.374 Cc1ccc(cc1OCC=O)N 7a_100000759471_200015260668 [0,2,0,0,0,0|2,0,0]=4 7956 B12R1.374 Cc1ccc(cc1SCC=O)Br 62a_100011344865_200015260668 [0,2,0,0,0,0|2,0,0]=4 7957 B12R1.374 Cc1ccc(cc1SCC=O)Br 62a_200015260668_100011344865 [0,2,0,0,0,0|2,0,0]=4 7958 B12R1.374 Cc1ccc(cc1SCC=O)Cl 62a_100011263213_200015260668 [0,2,0,0,0,0|2,0,0]=4 7959 B12R1.374 Cc1ccc(cc1SCC=O)Cl 62a_200015260668_100011263213 [0,2,0,0,0,0|2,0,0]=4 7960 B12R1.374 Cc1ccc(cc1SCC=O)F 62a_100011218078_200015260668 [0,2,0,0,0,0|2,0,0]=4 7961 B12R1.374 Cc1ccc(cc1SCC=O)F 62a_200015260668_100011218078 [0,2,0,0,0,0|2,0,0]=4 7962 B12R1.374 Cc1ccc(cc1SCC=O)N 62a_100000736455_200015260668 [0,2,0,0,0,0|2,0,0]=4 7963 B12R1.374 Cc1ccc(cc1SCC=O)N 62a_200015260668_100000736455 [0,2,0,0,0,0|2,0,0]=4 7964 B12R1.374 Cc1ccc(cc1SCC=O)O 62a_100011380479_200015260668 [0,2,0,0,0,0|2,0,0]=4 7965 B12R1.374 Cc1ccc(cc1SCC=O)O 62a_200015260668_100011380479 [0,2,0,0,0,0|2,0,0]=4 7966 B12R1.374 Cc1cnc(c(c1)SCC=O)O 62a_100000719714_200015260668 [0,2,0,0,0,0|2,0,0]=4 7967 B12R1.374 Cc1cnc(c(c1)SCC=O)O 62a_200015260668_100000719714 [0,2,0,0,0,0|2,0,0]=4 7968 B12R1.374 N#CCSc1cc(ccc1O)Br 62a_100011215382_100012355227 [0,2,0,0,0,0|1,0,1]=4 7969 B12R1.374 N#CCSc1cc(ccc1O)Br 62a_100012355227_100011215382 [0,2,0,0,0,0|1,0,1]=4 7970 B12R1.374 N#CCSc1cc(ccc1O)Cl 62a_100011215382_100011356953 [0,2,0,0,0,0|1,0,1]=4 7971 B12R1.374 N#CCSc1cc(ccc1O)Cl 62a_100011356953_100011215382 [0,2,0,0,0,0|1,0,1]=4 7972 B12R1.374 N#CCSc1cc(ccc1O)F 62a_100000211999_100011215382 [0,2,0,0,0,0|1,0,1]=4 7973 B12R1.374 N#CCSc1cc(ccc1O)F 62a_100011215382_100000211999 [0,2,0,0,0,0|1,0,1]=4 7974 B12R1.374 N#CCSc1cc(ccc1O)N 62a_100011215382_100011534360 [0,2,0,0,0,0|1,0,1]=4 7975 B12R1.374 N#CCSc1cc(ccc1O)N 62a_100011534360_100011215382 [0,2,0,0,0,0|1,0,1]=4 7976 B12R1.374 N#CCSc1cc(ccc1O)O 62a_100011215382_100009813629 [0,2,0,0,0,0|1,0,1]=4 7977 B12R1.374 Nc1ccc(c(c1)OCC=O)Cl 34a_100011934209_200009817547 [0,2,0,0,0,0|2,0,0]=4 7978 B12R1.374 Nc1ccc(c(c1)OCC=O)F 34a_100012017398_200009817547 [0,2,0,0,0,0|2,0,0]=4 7979 B12R1.374 Nc1ccc(c(c1)OCC=O)F 7a_100012017398_200015260668 [0,2,0,0,0,0|2,0,0]=4 7980 B12R1.374 Nc1ccc(c(c1)OCC=O)N 34a_100025717382_200009817547 [0,2,0,0,0,0|2,0,0]=4 7981 B12R1.374 Nc1ccc(c(c1)SCC=O)Br 62a_100000750459_200015260668 [0,2,0,0,0,0|2,0,0]=4 7982 B12R1.374 Nc1ccc(c(c1)SCC=O)Br 62a_200015260668_100000750459 [0,2,0,0,0,0|2,0,0]=4 7983 B12R1.374 Nc1ccc(c(c1)SCC=O)Cl 62a_100012360549_200015260668 [0,2,0,0,0,0|2,0,0]=4 7984 B12R1.374 Nc1ccc(c(c1)SCC=O)Cl 62a_200015260668_100012360549 [0,2,0,0,0,0|2,0,0]=4 7985 B12R1.374 Nc1ccc(c(c1)SCC=O)F 62a_100000760356_200015260668 [0,2,0,0,0,0|2,0,0]=4 7986 B12R1.374 Nc1ccc(c(c1)SCC=O)F 62a_200015260668_100000760356 [0,2,0,0,0,0|2,0,0]=4 7987 B12R1.374 Nc1ccc(c(c1)SCC=O)N 62a_100011534242_200015260668 [0,2,0,0,0,0|2,0,0]=4 7988 B12R1.374 Nc1ccc(c(c1)SCC=O)N 62a_200015260668_100011534242 [0,2,0,0,0,0|2,0,0]=4 7989 B12R1.374 Nc1ccc(c(c1)SCC=O)O 62a_100011534360_200015260668 [0,2,0,0,0,0|1,0,0]=3 7990 B12R1.374 Nc1ccc(c(c1)SCC=O)O 62a_200015260668_100011534360 [0,2,0,0,0,0|1,0,0]=3 7991 B12R1.374 Nc1ccc(c(c1)SCCF)O 62a_100011217306_100011534360 [0,2,0,0,0,0|1,0,1]=4 7992 B12R1.374 Nc1ccc(c(c1)SCCF)O 62a_100011534360_100011217306 [0,2,0,0,0,0|1,0,1]=4 7993 B12R1.374 Nc1ccc(c(c1)SCCO)O 62a_100000211926_100011534360 [0,2,0,0,0,0|1,0,1]=4 7994 B12R1.374 Nc1ccc(c(c1)SCCO)O 62a_100011534360_100000211926 [0,2,0,0,0,0|1,0,1]=4 7995 B12R1.374 Nc1ccc(cc1OCC=O)Br 34a_100000739049_200009817547 [0,2,0,0,0,0|2,0,0]=4 7996 B12R1.374 Nc1ccc(cc1OCC=O)Br 7a_100000739049_200015260668 [0,2,0,0,0,0|2,0,0]=4 7997 B12R1.374 Nc1ccc(cc1OCC=O)Cl 34a_100000185728_200009817547 [0,2,0,0,0,0|2,0,0]=4 7998 B12R1.374 Nc1ccc(cc1OCC=O)Cl 7a_100000185728_200015260668 [0,2,0,0,0,0|2,0,0]=4 7999 B12R1.374 Nc1ccc(cc1OCC=O)F 34a_100000753323_200009817547 [0,2,0,0,0,0|2,0,0]=4 8000 B12R1.374 Nc1ccc(cc1OCC=O)F 7a_100000753323_200015260668 [0,2,0,0,0,0|2,0,0]=4 8001 B12R1.374 Nc1ccc(cc1OCC=O)I 34a_100000057187_200009817547 [0,2,0,0,0,0|2,0,0]=4 8002 B12R1.374 Nc1ccc(cc1OCC=O)I 7a_100000057187_200015260668 [0,2,0,0,0,0|2,0,0]=4 8003 B12R1.374 Nc1ccc(cc1SCC=O)Br 62a_100000187925_200015260668 [0,2,0,0,0,0|2,0,0]=4 8004 B12R1.374 Nc1ccc(cc1SCC=O)Br 62a_200015260668_100000187925 [0,2,0,0,0,0|2,0,0]=4 8005 B12R1.374 Nc1ccc(cc1SCC=O)Cl 62a_100000761889_200015260668 [0,2,0,0,0,0|2,0,0]=4 8006 B12R1.374 Nc1ccc(cc1SCC=O)Cl 62a_200015260668_100000761889 [0,2,0,0,0,0|2,0,0]=4 8007 B12R1.374 Nc1ccc(cc1SCC=O)F 62a_100000760547_200015260668 [0,2,0,0,0,0|2,0,0]=4 8008 B12R1.374 Nc1ccc(cc1SCC=O)F 62a_200015260668_100000760547 [0,2,0,0,0,0|2,0,0]=4 8009 B12R1.374 Nc1ccc(cc1SCC=O)O 62a_100012001276_200015260668 [0,2,0,0,0,0|2,0,0]=4 8010 B12R1.374 Nc1ccc(cc1SCC=O)O 62a_200015260668_100012001276 [0,2,0,0,0,0|2,0,0]=4 8011 B12R1.374 O=CCNc1cc(ccc1Br)Br 34a_100000737762_200009817547 [0,2,0,0,0,0|2,0,0]=4 8012 B12R1.374 O=CCNc1cc(ccc1Br)Cl 34a_100000687073_200009817547 [0,2,0,0,0,0|2,0,0]=4 8013 B12R1.374 O=CCNc1cc(ccc1Br)F 34a_100000687223_200009817547 [0,2,0,0,0,0|2,0,0]=4 8014 B12R1.374 O=CCNc1cc(ccc1Br)O 34a_100011999798_200009817547 [0,2,0,0,0,0|2,0,0]=4 8015 B12R1.374 O=CCNc1cc(ccc1Cl)Br 34a_100000750497_200009817547 [0,2,0,0,0,0|2,0,0]=4 8016 B12R1.374 O=CCNc1cc(ccc1Cl)Cl 34a_100000184485_200009817547 [0,2,0,0,0,0|2,0,0]=4 8017 B12R1.374 O=CCNc1cc(ccc1Cl)F 34a_100000751338_200009817547 [0,2,0,0,0,0|2,0,0]=4 8018 B12R1.374 O=CCNc1cc(ccc1Cl)I 34a_200000761891_200009817547 [0,2,0,0,0,0|2,0,0]=4 8019 B12R1.374 O=CCNc1cc(ccc1Cl)O 34a_100011934297_200009817547 [0,2,0,0,0,0|2,0,0]=4 8020 B12R1.374 O=CCNc1cc(ccc1F)Br 34a_100000740924_200009817547 [0,2,0,0,0,0|2,0,0]=4 8021 B12R1.374 O=CCNc1cc(ccc1F)Cl 34a_100000212115_200009817547 [0,2,0,0,0,0|2,0,0]=4 8022 B12R1.374 O=CCNc1cc(ccc1F)F 34a_100000210742_200009817547 [0,2,0,0,0,0|2,0,0]=4 8023 B12R1.374 O=CCNc1cc(ccc1F)I 34a_100011464823_200009817547 [0,2,0,0,0,0|2,0,0]=4 8024 B12R1.374 O=CCNc1cc(ccc1F)O 34a_100012017239_200009817547 [0,2,0,0,0,0|2,0,0]=4 8025 B12R1.374 O=CCNc1cc(ccc1I)Br 34a_100000743836_200009817547 [0,2,0,0,0,0|2,0,0]=4 8026 B12R1.374 O=CCNc1cc(ccc1I)Cl 34a_100000761886_200009817547 [0,2,0,0,0,0|2,0,0]=4 8027 B12R1.374 O=CCNc1cc(ccc1I)F 34a_100011218093_200009817547 [0,2,0,0,0,0|2,0,0]=4 8028 B12R1.374 O=CCNc1cc(ccc1O)Br 34a_100000752626_200009817547 [0,2,0,0,0,0|1,0,0]=3 8029 B12R1.374 O=CCNc1cc(ccc1O)Cl 34a_100000210500_200009817547 [0,2,0,0,0,0|1,0,0]=3 8030 B12R1.374 O=CCNc1cc(ccc1O)F 34a_100000759472_200009817547 [0,2,0,0,0,0|1,0,0]=3 8031 B12R1.374 O=CCOc1cc(ccc1Br)Br 34a_100011220040_200009817547 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.374 O=CCOc1cc(ccc1Br)Br 7a_100011220040_200015260668 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.374 O=CCOc1cc(ccc1Br)Cl 34a_100012339455_200009817547 [0,2,0,0,0,0|2,0,0]=4 8034 B12R1.374 O=CCOc1cc(ccc1Br)Cl 7a_100012339455_200015260668 [0,2,0,0,0,0|2,0,0]=4 8035 B12R1.374 O=CCOc1cc(ccc1Br)F 34a_100000690578_200009817547 [0,2,0,0,0,0|2,0,0]=4 8036 B12R1.374 O=CCOc1cc(ccc1Br)F 7a_100000690578_200015260668 [0,2,0,0,0,0|2,0,0]=4 8037 B12R1.374 O=CCOc1cc(ccc1Br)I 34a_100012356990_200009817547 [0,2,0,0,0,0|2,0,0]=4 8038 B12R1.374 O=CCOc1cc(ccc1Br)I 7a_100012356990_200015260668 [0,2,0,0,0,0|2,0,0]=4 8039 B12R1.374 O=CCOc1cc(ccc1Cl)Br 34a_100000738945_200009817547 [0,2,0,0,0,0|2,0,0]=4 8040 B12R1.374 O=CCOc1cc(ccc1Cl)Br 7a_100000738945_200015260668 [0,2,0,0,0,0|2,0,0]=4 8041 B12R1.374 O=CCOc1cc(ccc1Cl)Cl 34a_100000211422_200009817547 [0,2,0,0,0,0|2,0,0]=4 8042 B12R1.374 O=CCOc1cc(ccc1Cl)Cl 7a_100000211422_200015260668 [0,2,0,0,0,0|2,0,0]=4 8043 B12R1.374 O=CCOc1cc(ccc1Cl)F 34a_100000692107_200009817547 [0,2,0,0,0,0|2,0,0]=4 8044 B12R1.374 O=CCOc1cc(ccc1Cl)F 7a_100000692107_200015260668 [0,2,0,0,0,0|2,0,0]=4 8045 B12R1.374 O=CCOc1cc(ccc1Cl)I 34a_100011356854_200009817547 [0,2,0,0,0,0|2,0,0]=4 8046 B12R1.374 O=CCOc1cc(ccc1Cl)I 7a_100011356854_200015260668 [0,2,0,0,0,0|2,0,0]=4 8047 B12R1.374 O=CCOc1cc(ccc1F)Br 34a_100000686035_200009817547 [0,2,0,0,0,0|2,0,0]=4 8048 B12R1.374 O=CCOc1cc(ccc1F)Br 7a_100000686035_200015260668 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.374 O=CCOc1cc(ccc1F)Cl 34a_100000757397_200009817547 [0,2,0,0,0,0|2,0,0]=4 8050 B12R1.374 O=CCOc1cc(ccc1F)Cl 7a_100000757397_200015260668 [0,2,0,0,0,0|2,0,0]=4 8051 B12R1.374 O=CCOc1cc(ccc1F)F 34a_100000752141_200009817547 [0,2,0,0,0,0|2,0,0]=4 8052 B12R1.374 O=CCOc1cc(ccc1F)F 7a_100000752141_200015260668 [0,2,0,0,0,0|2,0,0]=4 8053 B12R1.374 O=CCOc1cc(ccc1F)I 34a_100009958187_200009817547 [0,2,0,0,0,0|2,0,0]=4 8054 B12R1.374 O=CCOc1cc(ccc1F)I 7a_100009958187_200015260668 [0,2,0,0,0,0|2,0,0]=4 8055 B12R1.374 O=CCOc1cc(ccc1I)Br 34a_100012344904_200009817547 [0,2,0,0,0,0|2,0,0]=4 8056 B12R1.374 O=CCOc1cc(ccc1I)Br 7a_100012344904_200015260668 [0,2,0,0,0,0|2,0,0]=4 8057 B12R1.374 O=CCOc1cc(ccc1I)Cl 34a_100000050036_200009817547 [0,2,0,0,0,0|2,0,0]=4 8058 B12R1.374 O=CCOc1cc(ccc1I)Cl 7a_100000050036_200015260668 [0,2,0,0,0,0|2,0,0]=4 8059 B12R1.374 O=CCOc1cc(ccc1I)F 34a_100010084537_200009817547 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.374 O=CCOc1cc(ccc1I)F 7a_100010084537_200015260668 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.374 O=CCSc1cc(ccc1Br)Br 62a_100011483371_200015260668 [0,2,0,0,0,0|2,0,0]=4 8062 B12R1.374 O=CCSc1cc(ccc1Br)Br 62a_200015260668_100011483371 [0,2,0,0,0,0|2,0,0]=4 8063 B12R1.374 O=CCSc1cc(ccc1Br)Cl 62a_100012339723_200015260668 [0,2,0,0,0,0|2,0,0]=4 8064 B12R1.374 O=CCSc1cc(ccc1Br)Cl 62a_200015260668_100012339723 [0,2,0,0,0,0|2,0,0]=4 8065 B12R1.374 O=CCSc1cc(ccc1Br)F 62a_100011217576_200015260668 [0,2,0,0,0,0|2,0,0]=4 8066 B12R1.374 O=CCSc1cc(ccc1Br)F 62a_200015260668_100011217576 [0,2,0,0,0,0|2,0,0]=4 8067 B12R1.374 O=CCSc1cc(ccc1Br)O 62a_100012339312_200015260668 [0,2,0,0,0,0|2,0,0]=4 8068 B12R1.374 O=CCSc1cc(ccc1Br)O 62a_200015260668_100012339312 [0,2,0,0,0,0|2,0,0]=4 8069 B12R1.374 O=CCSc1cc(ccc1Cl)Br 62a_100011772130_200015260668 [0,2,0,0,0,0|2,0,0]=4 8070 B12R1.374 O=CCSc1cc(ccc1Cl)Br 62a_200015260668_100011772130 [0,2,0,0,0,0|2,0,0]=4 8071 B12R1.374 O=CCSc1cc(ccc1Cl)Cl 62a_100000707729_200015260668 [0,2,0,0,0,0|2,0,0]=4 8072 B12R1.374 O=CCSc1cc(ccc1Cl)Cl 62a_200015260668_100000707729 [0,2,0,0,0,0|2,0,0]=4 8073 B12R1.374 O=CCSc1cc(ccc1Cl)F 62a_100011217299_200015260668 [0,2,0,0,0,0|2,0,0]=4 8074 B12R1.374 O=CCSc1cc(ccc1Cl)F 62a_200015260668_100011217299 [0,2,0,0,0,0|2,0,0]=4 8075 B12R1.374 O=CCSc1cc(ccc1Cl)O 62a_100000049588_200015260668 [0,2,0,0,0,0|2,0,0]=4 8076 B12R1.374 O=CCSc1cc(ccc1Cl)O 62a_200015260668_100000049588 [0,2,0,0,0,0|2,0,0]=4 8077 B12R1.374 O=CCSc1cc(ccc1F)Br 62a_100011217312_200015260668 [0,2,0,0,0,0|2,0,0]=4 8078 B12R1.374 O=CCSc1cc(ccc1F)Br 62a_200015260668_100011217312 [0,2,0,0,0,0|2,0,0]=4 8079 B12R1.374 O=CCSc1cc(ccc1F)Cl 62a_100011218116_200015260668 [0,2,0,0,0,0|2,0,0]=4 8080 B12R1.374 O=CCSc1cc(ccc1F)Cl 62a_200015260668_100011218116 [0,2,0,0,0,0|2,0,0]=4 8081 B12R1.374 O=CCSc1cc(ccc1F)F 62a_100011219198_200015260668 [0,2,0,0,0,0|2,0,0]=4 8082 B12R1.374 O=CCSc1cc(ccc1F)F 62a_200015260668_100011219198 [0,2,0,0,0,0|2,0,0]=4 8083 B12R1.374 O=CCSc1cc(ccc1F)O 62a_100000693481_200015260668 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.374 O=CCSc1cc(ccc1F)O 62a_200015260668_100000693481 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.374 O=CCSc1cc(ccc1O)Br 62a_100012355227_200015260668 [0,2,0,0,0,0|1,0,0]=3 8086 B12R1.374 O=CCSc1cc(ccc1O)Br 62a_200015260668_100012355227 [0,2,0,0,0,0|1,0,0]=3 8087 B12R1.374 O=CCSc1cc(ccc1O)Cl 62a_100011356953_200015260668 [0,2,0,0,0,0|1,0,0]=3 8088 B12R1.374 O=CCSc1cc(ccc1O)Cl 62a_200015260668_100011356953 [0,2,0,0,0,0|1,0,0]=3 8089 B12R1.374 O=CCSc1cc(ccc1O)F 62a_100000211999_200015260668 [0,2,0,0,0,0|1,0,0]=3 8090 B12R1.374 O=CCSc1cc(ccc1O)F 62a_200015260668_100000211999 [0,2,0,0,0,0|1,0,0]=3 8091 B12R1.374 O=CCSc1cc(ccc1O)O 62a_200015260668_100009813629 [0,2,0,0,0,0|1,0,0]=3 8092 B12R1.374 O=CCSc1cc(cnc1O)Br 62a_100010197142_200015260668 [0,2,0,0,0,0|2,0,0]=4 8093 B12R1.374 O=CCSc1cc(cnc1O)Br 62a_200015260668_100010197142 [0,2,0,0,0,0|2,0,0]=4 8094 B12R1.374 O=CCSc1cc(cnc1O)Cl 62a_100010188700_200015260668 [0,2,0,0,0,0|2,0,0]=4 8095 B12R1.374 O=CCSc1cc(cnc1O)Cl 62a_200015260668_100010188700 [0,2,0,0,0,0|2,0,0]=4 8096 B12R1.374 O=CCSc1cc(ncc1O)Cl 62a_100000698892_200015260668 [0,2,0,0,0,0|2,0,0]=4 8097 B12R1.374 O=CCSc1cc(ncc1O)Cl 62a_200015260668_100000698892 [0,2,0,0,0,0|2,0,0]=4 8098 B12R1.374 O=CCSc1nc(ccc1O)Br 62a_100010253912_200015260668 [0,2,0,0,0,0|2,0,0]=4 8099 B12R1.374 O=CCSc1nc(ccc1O)Br 62a_200015260668_100010253912 [0,2,0,0,0,0|2,0,0]=4 8100 B12R1.374 O=CCSc1nc(ccc1O)Cl 62a_200015260668_100000696390 [0,2,0,0,0,0|2,0,0]=4 8101 B12R1.374 O=CCSc1nc(ccc1O)F 62a_100010382442_200015260668 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.374 O=CCSc1nc(ccc1O)F 62a_200015260668_100010382442 [0,2,0,0,0,0|2,0,0]=4 8103 B12R1.374 OCCNc1cc(ccc1O)Br 34a_100000752626_100000211926 [0,2,0,0,0,0|1,0,1]=4 8104 B12R1.374 OCCNc1cc(ccc1O)Cl 34a_100000210500_100000211926 [0,2,0,0,0,0|1,0,1]=4 8105 B12R1.374 OCCNc1cc(ccc1O)F 34a_100000759472_100000211926 [0,2,0,0,0,0|1,0,1]=4 8106 B12R1.374 OCCSc1cc(ccc1O)Br 62a_100000211926_100012355227 [0,2,0,0,0,0|1,0,1]=4 8107 B12R1.374 OCCSc1cc(ccc1O)Br 62a_100012355227_100000211926 [0,2,0,0,0,0|1,0,1]=4 8108 B12R1.374 OCCSc1cc(ccc1O)Cl 62a_100000211926_100011356953 [0,2,0,0,0,0|1,0,1]=4 8109 B12R1.374 OCCSc1cc(ccc1O)Cl 62a_100011356953_100000211926 [0,2,0,0,0,0|1,0,1]=4 8110 B12R1.374 OCCSc1cc(ccc1O)F 62a_100000211926_100000211999 [0,2,0,0,0,0|1,0,1]=4 8111 B12R1.374 OCCSc1cc(ccc1O)F 62a_100000211999_100000211926 [0,2,0,0,0,0|1,0,1]=4 8112 B12R1.374 OCCSc1cc(ccc1O)O 62a_100000211926_100009813629 [0,2,0,0,0,0|1,0,1]=4 8113 B12R1.374 Oc1ccc(c(c1)SCCF)O 62a_100011217306_100009813629 [0,2,0,0,0,0|1,0,1]=4 8114 B12R1.374 Oc1ccc(cc1CNCF)Br 34a_100000730032_100015361967 [0,2,0,0,0,0|1,0,1]=4 8115 B12R1.374 Oc1ccc(cc1CNCF)Cl 34a_100000238540_100015361967 [0,2,0,0,0,0|1,0,1]=4 8116 B12R1.374 Oc1ccc(cc1CSCF)F 62a_100010161318_100015361967 [0,2,0,0,0,0|1,0,1]=4 8117 B12R1.374 Oc1ccc(cc1CSCF)F 62a_100015361967_100010161318 [0,2,0,0,0,0|1,0,1]=4 8118 B12R1.374 Oc1ccc(cc1NCCF)Br 34a_100000752626_100011217306 [0,2,0,0,0,0|1,0,1]=4 8119 B12R1.374 Oc1ccc(cc1NCCF)Cl 34a_100000210500_100011217306 [0,2,0,0,0,0|1,0,1]=4 8120 B12R1.374 Oc1ccc(cc1NCCF)F 34a_100000759472_100011217306 [0,2,0,0,0,0|1,0,1]=4 8121 B12R1.374 Oc1ccc(cc1SCCF)Br 62a_100011217306_100012355227 [0,2,0,0,0,0|1,0,1]=4 8122 B12R1.374 Oc1ccc(cc1SCCF)Br 62a_100012355227_100011217306 [0,2,0,0,0,0|1,0,1]=4 8123 B12R1.374 Oc1ccc(cc1SCCF)Cl 62a_100011217306_100011356953 [0,2,0,0,0,0|1,0,1]=4 8124 B12R1.374 Oc1ccc(cc1SCCF)Cl 62a_100011356953_100011217306 [0,2,0,0,0,0|1,0,1]=4 8125 B12R1.374 Oc1ccc(cc1SCCF)F 62a_100000211999_100011217306 [0,2,0,0,0,0|1,0,1]=4 8126 B12R1.374 Oc1ccc(cc1SCCF)F 62a_100011217306_100000211999 [0,2,0,0,0,0|1,0,1]=4 8127 B12R1.1631 C#CCNc1c(cccc1Br)O 34a_100011934926_100000184674 [0,2,0,0,0,0|0,0,2]=4 8128 B12R1.1631 C#CCNc1c(cccc1Cl)O 34a_100012022510_100000184674 [0,2,0,0,0,0|0,0,2]=4 8129 B12R1.1631 C#CCNc1c(cccc1F)O 34a_100020591140_100000184674 [0,2,0,0,0,0|0,0,2]=4 8130 B12R1.1631 C#CCNc1c(cccc1O)C 34a_100000743429_100000184674 [0,2,0,0,0,0|0,0,2]=4 8131 B12R1.1631 C#CCSc1c(cccc1Br)O 62a_100000038162_100010187912 [0,2,0,0,0,0|0,0,2]=4 8132 B12R1.1631 C#CCSc1c(cccc1Cl)O 62a_100000038162_100000050174 [0,2,0,0,0,0|0,0,2]=4 8133 B12R1.1631 C#CCSc1c(cccc1F)O 62a_100000038162_100009820682 [0,2,0,0,0,0|0,0,2]=4 8134 B12R1.1631 C#CCSc1c(cccc1O)C 62a_100000038162_100000686692 [0,2,0,0,0,0|0,0,2]=4 8135 B12R1.1631 C#CCSc1c(cccc1O)N 62a_100000038162_100012183704 [0,2,0,0,0,0|0,0,2]=4 8136 B12R1.1631 C#CCSc1c(cccc1O)O 62a_100000038162_100010205330 [0,2,0,0,0,0|0,0,2]=4 8137 B12R1.1631 C=CCNc1c(cccc1Br)Br 34a_100000690995_100015514636 [0,2,0,0,0,0|1,0,0]=3 8138 B12R1.1631 C=CCNc1c(cccc1Br)C 34a_100011834072_100015514636 [0,2,0,0,0,0|1,0,0]=3 8139 B12R1.1631 C=CCNc1c(cccc1Br)Cl 34a_100102946385_100015514636 [0,2,0,0,0,0|1,0,0]=3 8140 B12R1.1631 C=CCNc1c(cccc1Br)F 34a_100000684712_100015514636 [0,2,0,0,0,0|1,0,0]=3 8141 B12R1.1631 C=CCNc1c(cccc1Br)O 34a_100011934926_100015514636 [0,2,0,0,0,0|0,0,0]=2 8142 B12R1.1631 C=CCNc1c(cccc1C)C 34a_100000185769_100015514636 [0,2,0,0,0,0|1,0,0]=3 8143 B12R1.1631 C=CCNc1c(cccc1Cl)C 34a_100000756524_100015514636 [0,2,0,0,0,0|1,0,0]=3 8144 B12R1.1631 C=CCNc1c(cccc1Cl)Cl 34a_100000210028_100015514636 [0,2,0,0,0,0|1,0,0]=3 8145 B12R1.1631 C=CCNc1c(cccc1Cl)F 34a_100000760031_100015514636 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.1631 C=CCNc1c(cccc1Cl)O 34a_100012022510_100015514636 [0,2,0,0,0,0|0,0,0]=2 8147 B12R1.1631 C=CCNc1c(cccc1F)C 34a_100000766463_100015514636 [0,2,0,0,0,0|1,0,0]=3 8148 B12R1.1631 C=CCNc1c(cccc1F)F 2230a_100000210704_100000210623 [0,2,0,0,0,0|1,0,0]=3 8149 B12R1.1631 C=CCNc1c(cccc1F)F 34a_100000210704_100015514636 [0,2,0,0,0,0|1,0,0]=3 8150 B12R1.1631 C=CCNc1c(cccc1F)O 34a_100020591140_100015514636 [0,2,0,0,0,0|0,0,0]=2 8151 B12R1.1631 C=CCNc1c(cccc1I)F 34a_100000042321_100015514636 [0,2,0,0,0,0|1,0,0]=3 8152 B12R1.1631 C=CCNc1c(cccc1O)C 34a_100000743429_100015514636 [0,2,0,0,0,0|0,0,0]=2 8153 B12R1.1631 C=CCNc1c(ccnc1F)C 27a_100020586998_100009818256 [0,2,0,0,0,0|2,0,0]=4 8154 B12R1.1631 C=CCNc1c(ccnc1F)F 27a_100020586998_100009874084 [0,2,0,0,0,0|2,0,0]=4 8155 B12R1.1631 C=CCOc1c(cccc1Br)Br 34a_100000736428_100015514636 [0,2,0,0,0,0|1,0,0]=3 8156 B12R1.1631 C=CCOc1c(cccc1Br)Br 7a_100000736428_100015514636 [0,2,0,0,0,0|1,0,0]=3 8157 B12R1.1631 C=CCOc1c(cccc1Br)C 34a_100009817157_100015514636 [0,2,0,0,0,0|1,0,0]=3 8158 B12R1.1631 C=CCOc1c(cccc1Br)C 7a_100009817157_100015514636 [0,2,0,0,0,0|1,0,0]=3 8159 B12R1.1631 C=CCOc1c(cccc1Br)Cl 34a_100010214474_100015514636 [0,2,0,0,0,0|1,0,0]=3 8160 B12R1.1631 C=CCOc1c(cccc1Br)Cl 7a_100010214474_100015514636 [0,2,0,0,0,0|1,0,0]=3 8161 B12R1.1631 C=CCOc1c(cccc1Br)F 34a_100009813666_100015514636 [0,2,0,0,0,0|1,0,0]=3 8162 B12R1.1631 C=CCOc1c(cccc1Br)F 7a_100009813666_100015514636 [0,2,0,0,0,0|1,0,0]=3 8163 B12R1.1631 C=CCOc1c(cccc1Br)N 34a_100011934915_100015514636 [0,2,0,0,0,0|1,0,0]=3 8164 B12R1.1631 C=CCOc1c(cccc1C)C 34a_100000210341_100015514636 [0,2,0,0,0,0|1,0,0]=3 8165 B12R1.1631 C=CCOc1c(cccc1C)C 7a_100000210341_100015514636 [0,2,0,0,0,0|1,0,0]=3 8166 B12R1.1631 C=CCOc1c(cccc1Cl)C 34a_100000033731_100015514636 [0,2,0,0,0,0|1,0,0]=3 8167 B12R1.1631 C=CCOc1c(cccc1Cl)C 7a_100000033731_100015514636 [0,2,0,0,0,0|1,0,0]=3 8168 B12R1.1631 C=CCOc1c(cccc1Cl)Cl 34a_100000211709_100015514636 [0,2,0,0,0,0|1,0,0]=3 8169 B12R1.1631 C=CCOc1c(cccc1Cl)Cl 7a_100000211709_100015514636 [0,2,0,0,0,0|1,0,0]=3 8170 B12R1.1631 C=CCOc1c(cccc1Cl)F 34a_100000694953_100015514636 [0,2,0,0,0,0|1,0,0]=3 8171 B12R1.1631 C=CCOc1c(cccc1Cl)F 7a_100000694953_100015514636 [0,2,0,0,0,0|1,0,0]=3 8172 B12R1.1631 C=CCOc1c(cccc1Cl)N 34a_100000754742_100015514636 [0,2,0,0,0,0|1,0,0]=3 8173 B12R1.1631 C=CCOc1c(cccc1F)C 34a_100011659162_100015514636 [0,2,0,0,0,0|1,0,0]=3 8174 B12R1.1631 C=CCOc1c(cccc1F)C 7a_100011659162_100015514636 [0,2,0,0,0,0|1,0,0]=3 8175 B12R1.1631 C=CCOc1c(cccc1F)F 34a_100000230165_100015514636 [0,2,0,0,0,0|1,0,0]=3 8176 B12R1.1631 C=CCOc1c(cccc1F)F 7a_100000230165_100015514636 [0,2,0,0,0,0|1,0,0]=3 8177 B12R1.1631 C=CCOc1c(cccc1F)N 34a_100011934987_100015514636 [0,2,0,0,0,0|1,0,0]=3 8178 B12R1.1631 C=CCOc1c(cccc1I)Br 34a_100010084509_100015514636 [0,2,0,0,0,0|1,0,0]=3 8179 B12R1.1631 C=CCOc1c(cccc1I)Br 7a_100010084509_100015514636 [0,2,0,0,0,0|1,0,0]=3 8180 B12R1.1631 C=CCOc1c(cccc1I)Cl 34a_100010202889_100015514636 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.1631 C=CCOc1c(cccc1I)Cl 7a_100010202889_100015514636 [0,2,0,0,0,0|1,0,0]=3 8182 B12R1.1631 C=CCOc1c(cccc1I)F 34a_100010186298_100015514636 [0,2,0,0,0,0|1,0,0]=3 8183 B12R1.1631 C=CCOc1c(cccc1I)F 7a_100010186298_100015514636 [0,2,0,0,0,0|1,0,0]=3 8184 B12R1.1631 C=CCOc1c(cccc1I)N 34a_100010084371_100015514636 [0,2,0,0,0,0|1,0,0]=3 8185 B12R1.1631 C=CCOc1c(cccc1N)C 34a_100000756359_100015514636 [0,2,0,0,0,0|1,0,0]=3 8186 B12R1.1631 C=CCOc1c(cccc1N)C 7a_100000756359_100015514636 [0,2,0,0,0,0|1,0,0]=3 8187 B12R1.1631 C=CCOc1c(cccc1N)N 34a_200016994477_100015514636 [0,2,0,0,0,0|1,0,0]=3 8188 B12R1.1631 C=CCOc1c(ccnc1C)C 34a_100011934651_100015514636 [0,2,0,0,0,0|2,0,0]=4 8189 B12R1.1631 C=CCOc1c(ccnc1C)C 7a_100011934651_100015514636 [0,2,0,0,0,0|2,0,0]=4 8190 B12R1.1631 C=CCOc1c(ccnc1Cl)C 34a_100000696282_100015514636 [0,2,0,0,0,0|2,0,0]=4 8191 B12R1.1631 C=CCOc1c(ccnc1Cl)C 7a_100000696282_100015514636 [0,2,0,0,0,0|2,0,0]=4 8192 B12R1.1631 C=CCOc1c(ccnc1Cl)Cl 34a_100000118450_100015514636 [0,2,0,0,0,0|2,0,0]=4 8193 B12R1.1631 C=CCOc1c(ccnc1Cl)Cl 7a_100000118450_100015514636 [0,2,0,0,0,0|2,0,0]=4 8194 B12R1.1631 C=CCOc1c(ccnc1Cl)F 34a_100009867227_100015514636 [0,2,0,0,0,0|2,0,0]=4 8195 B12R1.1631 C=CCOc1c(ccnc1Cl)F 7a_100009867227_100015514636 [0,2,0,0,0,0|2,0,0]=4 8196 B12R1.1631 C=CCOc1c(ccnc1Cl)I 34a_100010067911_100015514636 [0,2,0,0,0,0|2,0,0]=4 8197 B12R1.1631 C=CCOc1c(ccnc1Cl)I 7a_100010067911_100015514636 [0,2,0,0,0,0|2,0,0]=4 8198 B12R1.1631 C=CCOc1c(ccnc1Cl)N 34a_100009844647_100015514636 [0,2,0,0,0,0|2,0,0]=4 8199 B12R1.1631 C=CCOc1c(ccnc1Cl)N 7a_100009844647_100015514636 [0,2,0,0,0,0|2,0,0]=4 8200 B12R1.1631 C=CCOc1c(occc1=O)C 34a_100000031901_100015514636 [0,2,0,0,0,0|1,0,1]=4 8201 B12R1.1631 C=CCSc1c(ccc[n+]1[O-])C 62a_100000210623_100116209805 [0,2,0,0,0,0|1,0,1]=4 8202 B12R1.1631 C=CCSc1c(cccc1Br)Br 62a_100000210623_100009994525 [0,2,0,0,0,0|1,0,0]=3 8203 B12R1.1631 C=CCSc1c(cccc1Br)Br 62a_100009994525_100000210623 [0,2,0,0,0,0|1,0,0]=3 8204 B12R1.1631 C=CCSc1c(cccc1Br)C 62a_100000210623_100010141302 [0,2,0,0,0,0|1,0,0]=3 8205 B12R1.1631 C=CCSc1c(cccc1Br)C 62a_100010141302_100000210623 [0,2,0,0,0,0|1,0,0]=3 8206 B12R1.1631 C=CCSc1c(cccc1Br)Cl 62a_100000210623_100010214488 [0,2,0,0,0,0|1,0,0]=3 8207 B12R1.1631 C=CCSc1c(cccc1Br)Cl 62a_100010214488_100000210623 [0,2,0,0,0,0|1,0,0]=3 8208 B12R1.1631 C=CCSc1c(cccc1Br)F 62a_100000210623_100011219512 [0,2,0,0,0,0|1,0,0]=3 8209 B12R1.1631 C=CCSc1c(cccc1Br)F 62a_100011219512_100000210623 [0,2,0,0,0,0|1,0,0]=3 8210 B12R1.1631 C=CCSc1c(cccc1Br)N 62a_100000210623_100020590159 [0,2,0,0,0,0|1,0,0]=3 8211 B12R1.1631 C=CCSc1c(cccc1Br)N 62a_100020590159_100000210623 [0,2,0,0,0,0|1,0,0]=3 8212 B12R1.1631 C=CCSc1c(cccc1Br)O 62a_100000210623_100010187912 [0,2,0,0,0,0|0,0,0]=2 8213 B12R1.1631 C=CCSc1c(cccc1Br)O 62a_100010187912_100000210623 [0,2,0,0,0,0|0,0,0]=2 8214 B12R1.1631 C=CCSc1c(cccc1C)C 62a_100000033847_100000210623 [0,2,0,0,0,0|1,0,0]=3 8215 B12R1.1631 C=CCSc1c(cccc1C)C 62a_100000210623_100000033847 [0,2,0,0,0,0|1,0,0]=3 8216 B12R1.1631 C=CCSc1c(cccc1Cl)C 62a_100000043165_100000210623 [0,2,0,0,0,0|1,0,0]=3 8217 B12R1.1631 C=CCSc1c(cccc1Cl)C 62a_100000210623_100000043165 [0,2,0,0,0,0|1,0,0]=3 8218 B12R1.1631 C=CCSc1c(cccc1Cl)Cl 62a_100000034237_100000210623 [0,2,0,0,0,0|1,0,0]=3 8219 B12R1.1631 C=CCSc1c(cccc1Cl)Cl 62a_100000210623_100000034237 [0,2,0,0,0,0|1,0,0]=3 8220 B12R1.1631 C=CCSc1c(cccc1Cl)F 62a_100000050007_100000210623 [0,2,0,0,0,0|1,0,0]=3 8221 B12R1.1631 C=CCSc1c(cccc1Cl)F 62a_100000210623_100000050007 [0,2,0,0,0,0|1,0,0]=3 8222 B12R1.1631 C=CCSc1c(cccc1Cl)N 62a_100000049713_100000210623 [0,2,0,0,0,0|1,0,0]=3 8223 B12R1.1631 C=CCSc1c(cccc1Cl)N 62a_100000210623_100000049713 [0,2,0,0,0,0|1,0,0]=3 8224 B12R1.1631 C=CCSc1c(cccc1Cl)O 62a_100000210623_100000050174 [0,2,0,0,0,0|0,0,0]=2 8225 B12R1.1631 C=CCSc1c(cccc1F)C 62a_100000210623_100011218421 [0,2,0,0,0,0|1,0,0]=3 8226 B12R1.1631 C=CCSc1c(cccc1F)C 62a_100011218421_100000210623 [0,2,0,0,0,0|1,0,0]=3 8227 B12R1.1631 C=CCSc1c(cccc1F)F 62a_100000210623_100000693133 [0,2,0,0,0,0|1,0,0]=3 8228 B12R1.1631 C=CCSc1c(cccc1F)F 62a_100000693133_100000210623 [0,2,0,0,0,0|1,0,0]=3 8229 B12R1.1631 C=CCSc1c(cccc1F)N 62a_100000210623_100000690935 [0,2,0,0,0,0|1,0,0]=3 8230 B12R1.1631 C=CCSc1c(cccc1F)N 62a_100000690935_100000210623 [0,2,0,0,0,0|1,0,0]=3 8231 B12R1.1631 C=CCSc1c(cccc1F)O 62a_100000210623_100009820682 [0,2,0,0,0,0|0,0,0]=2 8232 B12R1.1631 C=CCSc1c(cccc1F)O 62a_100009820682_100000210623 [0,2,0,0,0,0|0,0,0]=2 8233 B12R1.1631 C=CCSc1c(cccc1N)C 62a_100000210623_100000684715 [0,2,0,0,0,0|1,0,0]=3 8234 B12R1.1631 C=CCSc1c(cccc1N)C 62a_100000684715_100000210623 [0,2,0,0,0,0|1,0,0]=3 8235 B12R1.1631 C=CCSc1c(cccc1O)C 62a_100000210623_100000686692 [0,2,0,0,0,0|0,0,0]=2 8236 B12R1.1631 C=CCSc1c(cccc1O)C 62a_100000686692_100000210623 [0,2,0,0,0,0|0,0,0]=2 8237 B12R1.1631 C=CCSc1c(cccc1O)N 62a_100000210623_100012183704 [0,2,0,0,0,0|0,0,0]=2 8238 B12R1.1631 C=CCSc1c(cccc1O)N 62a_100012183704_100000210623 [0,2,0,0,0,0|0,0,0]=2 8239 B12R1.1631 C=CCSc1c(cccc1O)O 62a_100000210623_100010205330 [0,2,0,0,0,0|0,0,0]=2 8240 B12R1.1631 C=CCSc1c(ccnc1C)C 62a_100000210623_100012000501 [0,2,0,0,0,0|2,0,0]=4 8241 B12R1.1631 C=CCSc1c(ccnc1C)C 62a_100012000501_100000210623 [0,2,0,0,0,0|2,0,0]=4 8242 B12R1.1631 C=CCSc1c(ccnc1C)N 62a_100000210623_100010243816 [0,2,0,0,0,0|2,0,0]=4 8243 B12R1.1631 C=CCSc1c(ccnc1C)N 62a_100010243816_100000210623 [0,2,0,0,0,0|2,0,0]=4 8244 B12R1.1631 C=CCSc1c(ccnc1Cl)Br 62a_100000210623_100009814607 [0,2,0,0,0,0|2,0,0]=4 8245 B12R1.1631 C=CCSc1c(ccnc1Cl)Br 62a_100009814607_100000210623 [0,2,0,0,0,0|2,0,0]=4 8246 B12R1.1631 C=CCSc1c(ccnc1Cl)C 62a_100000210623_100010248874 [0,2,0,0,0,0|2,0,0]=4 8247 B12R1.1631 C=CCSc1c(ccnc1Cl)C 62a_100010248874_100000210623 [0,2,0,0,0,0|2,0,0]=4 8248 B12R1.1631 C=CCSc1c(ccnc1Cl)Cl 62a_100000050019_100000210623 [0,2,0,0,0,0|2,0,0]=4 8249 B12R1.1631 C=CCSc1c(ccnc1Cl)Cl 62a_100000210623_100000050019 [0,2,0,0,0,0|2,0,0]=4 8250 B12R1.1631 C=CCSc1c(ccnc1Cl)F 62a_100000210623_100000716511 [0,2,0,0,0,0|2,0,0]=4 8251 B12R1.1631 C=CCSc1c(ccnc1Cl)F 62a_100000716511_100000210623 [0,2,0,0,0,0|2,0,0]=4 8252 B12R1.1631 C=CCSc1c(ccnc1Cl)N 62a_100000210623_100010208016 [0,2,0,0,0,0|2,0,0]=4 8253 B12R1.1631 C=CCSc1c(ccnc1Cl)N 62a_100010208016_100000210623 [0,2,0,0,0,0|2,0,0]=4 8254 B12R1.1631 C=CCSc1c(ccnc1F)C 62a_100000210623_100009818256 [0,2,0,0,0,0|2,0,0]=4 8255 B12R1.1631 C=CCSc1c(ccnc1F)C 62a_100009818256_100000210623 [0,2,0,0,0,0|2,0,0]=4 8256 B12R1.1631 C=CCSc1c(ccnc1F)F 62a_100000210623_100009874084 [0,2,0,0,0,0|2,0,0]=4 8257 B12R1.1631 C=CCSc1c(ccnc1F)F 62a_100009874084_100000210623 [0,2,0,0,0,0|2,0,0]=4 8258 B12R1.1631 C=CCSc1c(ccnc1F)N 62a_100000210623_100010381272 [0,2,0,0,0,0|2,0,0]=4 8259 B12R1.1631 C=CCSc1c(ccnc1F)N 62a_100010381272_100000210623 [0,2,0,0,0,0|2,0,0]=4 8260 B12R1.1631 C=CCSc1c(ccnc1N)C 62a_100000210623_100011998619 [0,2,0,0,0,0|2,0,0]=4 8261 B12R1.1631 C=CCSc1c(ccnc1N)C 62a_100011998619_100000210623 [0,2,0,0,0,0|2,0,0]=4 8262 B12R1.1631 C=CCSc1c(ccnc1N)Cl 62a_100000210623_100010199028 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.1631 C=CCSc1c(ccnc1N)Cl 62a_100010199028_100000210623 [0,2,0,0,0,0|2,0,0]=4 8264 B12R1.1631 C=CCSc1c(ccnc1O)C 62a_100000210623_100012000493 [0,2,0,0,0,0|1,0,0]=3 8265 B12R1.1631 C=CCSc1c(ccnc1O)C 62a_100012000493_100000210623 [0,2,0,0,0,0|1,0,0]=3 8266 B12R1.1631 C=CCSc1c(ccnc1O)O 62a_100000210623_200009817435 [0,2,0,0,0,0|1,0,0]=3 8267 B12R1.1631 C=CCSc1c(cn[nH]c1=O)O 62a_100000210623_100000116976 [0,2,0,0,0,0|2,0,0]=4 8268 B12R1.1631 C=CCSc1c(cncc1Br)Br 62a_100000210623_100010172828 [0,2,0,0,0,0|2,0,0]=4 8269 B12R1.1631 C=CCSc1c(cncc1Br)Br 62a_100010172828_100000210623 [0,2,0,0,0,0|2,0,0]=4 8270 B12R1.1631 C=CCSc1c(cncc1C)C 62a_100000210623_100009817138 [0,2,0,0,0,0|2,0,0]=4 8271 B12R1.1631 C=CCSc1c(cncc1C)C 62a_100009817138_100000210623 [0,2,0,0,0,0|2,0,0]=4 8272 B12R1.1631 C=CCSc1c(cncc1Cl)Cl 62a_100000036193_100000210623 [0,2,0,0,0,0|2,0,0]=4 8273 B12R1.1631 C=CCSc1c(cncc1Cl)Cl 62a_100000210623_100000036193 [0,2,0,0,0,0|2,0,0]=4 8274 B12R1.1631 C=CCSc1c(cncc1F)F 62a_100000210623_100000760538 [0,2,0,0,0,0|2,0,0]=4 8275 B12R1.1631 C=CCSc1c(cncc1F)F 62a_100000760538_100000210623 [0,2,0,0,0,0|2,0,0]=4 8276 B12R1.1631 C=CCSc1c(ncnc1O)O 62a_100000210623_100000006518 [0,2,0,0,0,0|2,0,0]=4 8277 B12R1.1631 CCCCc1c(cccc1Br)O 271570a_100020621405_100010187912 [0,2,0,0,0,0|0,0,2]=4 8278 B12R1.1631 CCCCc1c(cccc1Cl)O 271570a_100020621405_100000050174 [0,2,0,0,0,0|0,0,2]=4 8279 B12R1.1631 CCCCc1c(cccc1F)O 271570a_100020621405_100009820682 [0,2,0,0,0,0|0,0,2]=4 8280 B12R1.1631 CCCCc1c(cccc1O)C 271570a_100020621405_100000686692 [0,2,0,0,0,0|0,0,2]=4 8281 B12R1.1631 CCCCc1c(cccc1O)N 271570a_100020621405_100012183704 [0,2,0,0,0,0|0,0,2]=4 8282 B12R1.1631 CCCCc1c(cccc1O)O 271570a_100020621405_100010205330 [0,2,0,0,0,0|0,0,2]=4 8283 B12R1.1631 CCCNc1c(cccc1Br)O 34a_100011934926_100000210303 [0,2,0,0,0,0|0,0,2]=4 8284 B12R1.1631 CCCNc1c(cccc1Cl)O 34a_100012022510_100000210303 [0,2,0,0,0,0|0,0,2]=4 8285 B12R1.1631 CCCNc1c(cccc1F)O 34a_100020591140_100000210303 [0,2,0,0,0,0|0,0,2]=4 8286 B12R1.1631 CCCNc1c(cccc1O)C 34a_100000743429_100000210303 [0,2,0,0,0,0|0,0,2]=4 8287 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100000210303_100010187912 [0,2,0,0,0,0|0,0,2]=4 8288 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100010187912_100000210303 [0,2,0,0,0,0|0,0,2]=4 8289 B12R1.1631 CCCSc1c(cccc1Cl)O 62a_100000210303_100000050174 [0,2,0,0,0,0|0,0,2]=4 8290 B12R1.1631 CCCSc1c(cccc1F)O 62a_100000210303_100009820682 [0,2,0,0,0,0|0,0,2]=4 8291 B12R1.1631 CCCSc1c(cccc1F)O 62a_100009820682_100000210303 [0,2,0,0,0,0|0,0,2]=4 8292 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000210303_100000686692 [0,2,0,0,0,0|0,0,2]=4 8293 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000686692_100000210303 [0,2,0,0,0,0|0,0,2]=4 8294 B12R1.1631 CCCSc1c(cccc1O)N 62a_100000210303_100012183704 [0,2,0,0,0,0|0,0,2]=4 8295 B12R1.1631 CCCSc1c(cccc1O)N 62a_100012183704_100000210303 [0,2,0,0,0,0|0,0,2]=4 8296 B12R1.1631 CCCSc1c(cccc1O)O 62a_100000210303_100010205330 [0,2,0,0,0,0|0,0,2]=4 8297 B12R1.1631 COCSc1c(cccc1Br)O 62a_100000766300_100010187912 [0,2,0,0,0,0|1,0,1]=4 8298 B12R1.1631 COCSc1c(cccc1Br)O 62a_100010187912_100000766300 [0,2,0,0,0,0|1,0,1]=4 8299 B12R1.1631 COCSc1c(cccc1Cl)O 62a_100000766300_100000050174 [0,2,0,0,0,0|1,0,1]=4 8300 B12R1.1631 COCSc1c(cccc1F)O 62a_100000766300_100009820682 [0,2,0,0,0,0|1,0,1]=4 8301 B12R1.1631 COCSc1c(cccc1F)O 62a_100009820682_100000766300 [0,2,0,0,0,0|1,0,1]=4 8302 B12R1.1631 COCSc1c(cccc1O)C 62a_100000686692_100000766300 [0,2,0,0,0,0|1,0,1]=4 8303 B12R1.1631 COCSc1c(cccc1O)C 62a_100000766300_100000686692 [0,2,0,0,0,0|1,0,1]=4 8304 B12R1.1631 COCSc1c(cccc1O)N 62a_100000766300_100012183704 [0,2,0,0,0,0|1,0,1]=4 8305 B12R1.1631 COCSc1c(cccc1O)N 62a_100012183704_100000766300 [0,2,0,0,0,0|1,0,1]=4 8306 B12R1.1631 COCSc1c(cccc1O)O 62a_100000766300_100010205330 [0,2,0,0,0,0|1,0,1]=4 8307 B12R1.1631 CSCNc1c(cccc1Br)O 34a_100011934926_100011218213 [0,2,0,0,0,0|1,0,1]=4 8308 B12R1.1631 CSCNc1c(cccc1Cl)O 34a_100012022510_100011218213 [0,2,0,0,0,0|1,0,1]=4 8309 B12R1.1631 CSCNc1c(cccc1F)O 34a_100020591140_100011218213 [0,2,0,0,0,0|1,0,1]=4 8310 B12R1.1631 CSCNc1c(cccc1O)C 34a_100000743429_100011218213 [0,2,0,0,0,0|1,0,1]=4 8311 B12R1.1631 CSCSc1c(cccc1Br)O 62a_100010187912_100011218213 [0,2,0,0,0,0|1,0,1]=4 8312 B12R1.1631 CSCSc1c(cccc1Br)O 62a_100011218213_100010187912 [0,2,0,0,0,0|1,0,1]=4 8313 B12R1.1631 CSCSc1c(cccc1Cl)O 62a_100011218213_100000050174 [0,2,0,0,0,0|1,0,1]=4 8314 B12R1.1631 CSCSc1c(cccc1F)O 62a_100009820682_100011218213 [0,2,0,0,0,0|1,0,1]=4 8315 B12R1.1631 CSCSc1c(cccc1F)O 62a_100011218213_100009820682 [0,2,0,0,0,0|1,0,1]=4 8316 B12R1.1631 CSCSc1c(cccc1O)C 62a_100000686692_100011218213 [0,2,0,0,0,0|1,0,1]=4 8317 B12R1.1631 CSCSc1c(cccc1O)C 62a_100011218213_100000686692 [0,2,0,0,0,0|1,0,1]=4 8318 B12R1.1631 CSCSc1c(cccc1O)N 62a_100011218213_100012183704 [0,2,0,0,0,0|1,0,1]=4 8319 B12R1.1631 CSCSc1c(cccc1O)N 62a_100012183704_100011218213 [0,2,0,0,0,0|1,0,1]=4 8320 B12R1.1631 CSCSc1c(cccc1O)O 62a_100011218213_100010205330 [0,2,0,0,0,0|1,0,1]=4 8321 B12R1.1631 Cc1cccc(c1NCC=O)Br 34a_100011834072_200009817547 [0,2,0,0,0,0|2,0,0]=4 8322 B12R1.1631 Cc1cccc(c1NCC=O)C 34a_100000185769_200009817547 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.1631 Cc1cccc(c1NCC=O)Cl 34a_100000756524_200009817547 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.1631 Cc1cccc(c1NCC=O)F 34a_100000766463_200009817547 [0,2,0,0,0,0|2,0,0]=4 8325 B12R1.1631 Cc1cccc(c1NCC=O)O 34a_100000743429_200009817547 [0,2,0,0,0,0|1,0,0]=3 8326 B12R1.1631 Cc1cccc(c1NCCF)O 34a_100000743429_100011217306 [0,2,0,0,0,0|1,0,1]=4 8327 B12R1.1631 Cc1cccc(c1NCCO)O 34a_100000743429_100000211926 [0,2,0,0,0,0|1,0,1]=4 8328 B12R1.1631 Cc1cccc(c1OCC=O)Br 34a_100009817157_200009817547 [0,2,0,0,0,0|2,0,0]=4 8329 B12R1.1631 Cc1cccc(c1OCC=O)Br 7a_100009817157_200015260668 [0,2,0,0,0,0|2,0,0]=4 8330 B12R1.1631 Cc1cccc(c1OCC=O)C 34a_100000210341_200009817547 [0,2,0,0,0,0|2,0,0]=4 8331 B12R1.1631 Cc1cccc(c1OCC=O)C 7a_100000210341_200015260668 [0,2,0,0,0,0|2,0,0]=4 8332 B12R1.1631 Cc1cccc(c1OCC=O)Cl 34a_100000033731_200009817547 [0,2,0,0,0,0|2,0,0]=4 8333 B12R1.1631 Cc1cccc(c1OCC=O)Cl 7a_100000033731_200015260668 [0,2,0,0,0,0|2,0,0]=4 8334 B12R1.1631 Cc1cccc(c1OCC=O)F 34a_100011659162_200009817547 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.1631 Cc1cccc(c1OCC=O)F 7a_100011659162_200015260668 [0,2,0,0,0,0|2,0,0]=4 8336 B12R1.1631 Cc1cccc(c1OCC=O)N 34a_100000756359_200009817547 [0,2,0,0,0,0|2,0,0]=4 8337 B12R1.1631 Cc1cccc(c1OCC=O)N 7a_100000756359_200015260668 [0,2,0,0,0,0|2,0,0]=4 8338 B12R1.1631 Cc1cccc(c1SCC#N)O 62a_100000686692_100011215382 [0,2,0,0,0,0|1,0,1]=4 8339 B12R1.1631 Cc1cccc(c1SCC#N)O 62a_100011215382_100000686692 [0,2,0,0,0,0|1,0,1]=4 8340 B12R1.1631 Cc1cccc(c1SCC=O)Br 62a_100010141302_200015260668 [0,2,0,0,0,0|2,0,0]=4 8341 B12R1.1631 Cc1cccc(c1SCC=O)Br 62a_200015260668_100010141302 [0,2,0,0,0,0|2,0,0]=4 8342 B12R1.1631 Cc1cccc(c1SCC=O)C 62a_100000033847_200015260668 [0,2,0,0,0,0|2,0,0]=4 8343 B12R1.1631 Cc1cccc(c1SCC=O)C 62a_200015260668_100000033847 [0,2,0,0,0,0|2,0,0]=4 8344 B12R1.1631 Cc1cccc(c1SCC=O)Cl 62a_100000043165_200015260668 [0,2,0,0,0,0|2,0,0]=4 8345 B12R1.1631 Cc1cccc(c1SCC=O)Cl 62a_200015260668_100000043165 [0,2,0,0,0,0|2,0,0]=4 8346 B12R1.1631 Cc1cccc(c1SCC=O)F 62a_100011218421_200015260668 [0,2,0,0,0,0|2,0,0]=4 8347 B12R1.1631 Cc1cccc(c1SCC=O)F 62a_200015260668_100011218421 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.1631 Cc1cccc(c1SCC=O)N 62a_100000684715_200015260668 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.1631 Cc1cccc(c1SCC=O)N 62a_200015260668_100000684715 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.1631 Cc1cccc(c1SCC=O)O 62a_100000686692_200015260668 [0,2,0,0,0,0|1,0,0]=3 8351 B12R1.1631 Cc1cccc(c1SCC=O)O 62a_200015260668_100000686692 [0,2,0,0,0,0|1,0,0]=3 8352 B12R1.1631 Cc1cccc(c1SCCF)O 62a_100000686692_100011217306 [0,2,0,0,0,0|1,0,1]=4 8353 B12R1.1631 Cc1cccc(c1SCCF)O 62a_100011217306_100000686692 [0,2,0,0,0,0|1,0,1]=4 8354 B12R1.1631 Cc1cccc(c1SCCO)O 62a_100000211926_100000686692 [0,2,0,0,0,0|1,0,1]=4 8355 B12R1.1631 Cc1cccc(c1SCCO)O 62a_100000686692_100000211926 [0,2,0,0,0,0|1,0,1]=4 8356 B12R1.1631 Cc1ccnc(c1SCC=O)O 62a_100012000493_200015260668 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.1631 Cc1ccnc(c1SCC=O)O 62a_200015260668_100012000493 [0,2,0,0,0,0|2,0,0]=4 8358 B12R1.1631 N#CCSc1c(cccc1Br)O 62a_100010187912_100011215382 [0,2,0,0,0,0|1,0,1]=4 8359 B12R1.1631 N#CCSc1c(cccc1Br)O 62a_100011215382_100010187912 [0,2,0,0,0,0|1,0,1]=4 8360 B12R1.1631 N#CCSc1c(cccc1Cl)O 62a_100011215382_100000050174 [0,2,0,0,0,0|1,0,1]=4 8361 B12R1.1631 N#CCSc1c(cccc1F)O 62a_100009820682_100011215382 [0,2,0,0,0,0|1,0,1]=4 8362 B12R1.1631 N#CCSc1c(cccc1F)O 62a_100011215382_100009820682 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.1631 N#CCSc1c(cccc1O)N 62a_100011215382_100012183704 [0,2,0,0,0,0|1,0,1]=4 8364 B12R1.1631 N#CCSc1c(cccc1O)N 62a_100012183704_100011215382 [0,2,0,0,0,0|1,0,1]=4 8365 B12R1.1631 N#CCSc1c(cccc1O)O 62a_100011215382_100010205330 [0,2,0,0,0,0|1,0,1]=4 8366 B12R1.1631 Nc1cccc(c1OCC=O)Br 34a_100011934915_200009817547 [0,2,0,0,0,0|2,0,0]=4 8367 B12R1.1631 Nc1cccc(c1OCC=O)Cl 34a_100000754742_200009817547 [0,2,0,0,0,0|2,0,0]=4 8368 B12R1.1631 Nc1cccc(c1OCC=O)F 34a_100011934987_200009817547 [0,2,0,0,0,0|2,0,0]=4 8369 B12R1.1631 Nc1cccc(c1OCC=O)I 34a_100010084371_200009817547 [0,2,0,0,0,0|2,0,0]=4 8370 B12R1.1631 Nc1cccc(c1OCC=O)N 34a_200016994477_200009817547 [0,2,0,0,0,0|2,0,0]=4 8371 B12R1.1631 Nc1cccc(c1SCC=O)Br 62a_100020590159_200015260668 [0,2,0,0,0,0|2,0,0]=4 8372 B12R1.1631 Nc1cccc(c1SCC=O)Br 62a_200015260668_100020590159 [0,2,0,0,0,0|2,0,0]=4 8373 B12R1.1631 Nc1cccc(c1SCC=O)Cl 62a_100000049713_200015260668 [0,2,0,0,0,0|2,0,0]=4 8374 B12R1.1631 Nc1cccc(c1SCC=O)Cl 62a_200015260668_100000049713 [0,2,0,0,0,0|2,0,0]=4 8375 B12R1.1631 Nc1cccc(c1SCC=O)F 62a_100000690935_200015260668 [0,2,0,0,0,0|2,0,0]=4 8376 B12R1.1631 Nc1cccc(c1SCC=O)F 62a_200015260668_100000690935 [0,2,0,0,0,0|2,0,0]=4 8377 B12R1.1631 Nc1cccc(c1SCC=O)O 62a_100012183704_200015260668 [0,2,0,0,0,0|1,0,0]=3 8378 B12R1.1631 Nc1cccc(c1SCC=O)O 62a_200015260668_100012183704 [0,2,0,0,0,0|1,0,0]=3 8379 B12R1.1631 Nc1cccc(c1SCCF)O 62a_100011217306_100012183704 [0,2,0,0,0,0|1,0,1]=4 8380 B12R1.1631 Nc1cccc(c1SCCF)O 62a_100012183704_100011217306 [0,2,0,0,0,0|1,0,1]=4 8381 B12R1.1631 Nc1cccc(c1SCCO)O 62a_100000211926_100012183704 [0,2,0,0,0,0|1,0,1]=4 8382 B12R1.1631 Nc1cccc(c1SCCO)O 62a_100012183704_100000211926 [0,2,0,0,0,0|1,0,1]=4 8383 B12R1.1631 O=CCNc1c(cccc1Br)Br 34a_100000690995_200009817547 [0,2,0,0,0,0|2,0,0]=4 8384 B12R1.1631 O=CCNc1c(cccc1Br)Cl 34a_100102946385_200009817547 [0,2,0,0,0,0|2,0,0]=4 8385 B12R1.1631 O=CCNc1c(cccc1Br)F 34a_100000684712_200009817547 [0,2,0,0,0,0|2,0,0]=4 8386 B12R1.1631 O=CCNc1c(cccc1Br)O 34a_100011934926_200009817547 [0,2,0,0,0,0|1,0,0]=3 8387 B12R1.1631 O=CCNc1c(cccc1Cl)Cl 34a_100000210028_200009817547 [0,2,0,0,0,0|2,0,0]=4 8388 B12R1.1631 O=CCNc1c(cccc1Cl)F 34a_100000760031_200009817547 [0,2,0,0,0,0|2,0,0]=4 8389 B12R1.1631 O=CCNc1c(cccc1Cl)O 34a_100012022510_200009817547 [0,2,0,0,0,0|1,0,0]=3 8390 B12R1.1631 O=CCNc1c(cccc1F)F 2230a_100000210704_200015260668 [0,2,0,0,0,0|2,0,0]=4 8391 B12R1.1631 O=CCNc1c(cccc1F)F 34a_100000210704_200009817547 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.1631 O=CCNc1c(cccc1F)O 34a_100020591140_200009817547 [0,2,0,0,0,0|1,0,0]=3 8393 B12R1.1631 O=CCNc1c(cccc1I)F 34a_100000042321_200009817547 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.1631 O=CCOc1c(cccc1Br)Br 34a_100000736428_200009817547 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.1631 O=CCOc1c(cccc1Br)Br 7a_100000736428_200015260668 [0,2,0,0,0,0|2,0,0]=4 8396 B12R1.1631 O=CCOc1c(cccc1Br)Cl 34a_100010214474_200009817547 [0,2,0,0,0,0|2,0,0]=4 8397 B12R1.1631 O=CCOc1c(cccc1Br)Cl 7a_100010214474_200015260668 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.1631 O=CCOc1c(cccc1Br)F 34a_100009813666_200009817547 [0,2,0,0,0,0|2,0,0]=4 8399 B12R1.1631 O=CCOc1c(cccc1Br)F 7a_100009813666_200015260668 [0,2,0,0,0,0|2,0,0]=4 8400 B12R1.1631 O=CCOc1c(cccc1Cl)Cl 34a_100000211709_200009817547 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.1631 O=CCOc1c(cccc1Cl)Cl 7a_100000211709_200015260668 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.1631 O=CCOc1c(cccc1Cl)F 34a_100000694953_200009817547 [0,2,0,0,0,0|2,0,0]=4 8403 B12R1.1631 O=CCOc1c(cccc1Cl)F 7a_100000694953_200015260668 [0,2,0,0,0,0|2,0,0]=4 8404 B12R1.1631 O=CCOc1c(cccc1F)F 34a_100000230165_200009817547 [0,2,0,0,0,0|2,0,0]=4 8405 B12R1.1631 O=CCOc1c(cccc1F)F 7a_100000230165_200015260668 [0,2,0,0,0,0|2,0,0]=4 8406 B12R1.1631 O=CCOc1c(cccc1I)Br 34a_100010084509_200009817547 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.1631 O=CCOc1c(cccc1I)Br 7a_100010084509_200015260668 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.1631 O=CCOc1c(cccc1I)Cl 34a_100010202889_200009817547 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.1631 O=CCOc1c(cccc1I)Cl 7a_100010202889_200015260668 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.1631 O=CCOc1c(cccc1I)F 34a_100010186298_200009817547 [0,2,0,0,0,0|2,0,0]=4 8411 B12R1.1631 O=CCOc1c(cccc1I)F 7a_100010186298_200015260668 [0,2,0,0,0,0|2,0,0]=4 8412 B12R1.1631 O=CCSc1c(cccc1Br)Br 62a_100009994525_200015260668 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.1631 O=CCSc1c(cccc1Br)Br 62a_200015260668_100009994525 [0,2,0,0,0,0|2,0,0]=4 8414 B12R1.1631 O=CCSc1c(cccc1Br)Cl 62a_100010214488_200015260668 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.1631 O=CCSc1c(cccc1Br)Cl 62a_200015260668_100010214488 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.1631 O=CCSc1c(cccc1Br)F 62a_100011219512_200015260668 [0,2,0,0,0,0|2,0,0]=4 8417 B12R1.1631 O=CCSc1c(cccc1Br)F 62a_200015260668_100011219512 [0,2,0,0,0,0|2,0,0]=4 8418 B12R1.1631 O=CCSc1c(cccc1Br)O 62a_100010187912_200015260668 [0,2,0,0,0,0|1,0,0]=3 8419 B12R1.1631 O=CCSc1c(cccc1Br)O 62a_200015260668_100010187912 [0,2,0,0,0,0|1,0,0]=3 8420 B12R1.1631 O=CCSc1c(cccc1Cl)Cl 62a_100000034237_200015260668 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.1631 O=CCSc1c(cccc1Cl)Cl 62a_200015260668_100000034237 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.1631 O=CCSc1c(cccc1Cl)F 62a_100000050007_200015260668 [0,2,0,0,0,0|2,0,0]=4 8423 B12R1.1631 O=CCSc1c(cccc1Cl)F 62a_200015260668_100000050007 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.1631 O=CCSc1c(cccc1Cl)O 62a_200015260668_100000050174 [0,2,0,0,0,0|1,0,0]=3 8425 B12R1.1631 O=CCSc1c(cccc1F)F 62a_100000693133_200015260668 [0,2,0,0,0,0|2,0,0]=4 8426 B12R1.1631 O=CCSc1c(cccc1F)F 62a_200015260668_100000693133 [0,2,0,0,0,0|2,0,0]=4 8427 B12R1.1631 O=CCSc1c(cccc1F)O 62a_100009820682_200015260668 [0,2,0,0,0,0|1,0,0]=3 8428 B12R1.1631 O=CCSc1c(cccc1F)O 62a_200015260668_100009820682 [0,2,0,0,0,0|1,0,0]=3 8429 B12R1.1631 O=CCSc1c(cccc1O)O 62a_200015260668_100010205330 [0,2,0,0,0,0|1,0,0]=3 8430 B12R1.1631 O=CCSc1c(ccnc1O)O 62a_200015260668_200009817435 [0,2,0,0,0,0|2,0,0]=4 8431 B12R1.1631 OCCCc1c(cccc1F)O 271570a_203496583355_100021413403 [0,2,0,0,0,0|0,0,2]=4 8432 B12R1.1631 OCCNc1c(cccc1Br)O 34a_100011934926_100000211926 [0,2,0,0,0,0|1,0,1]=4 8433 B12R1.1631 OCCNc1c(cccc1Cl)O 34a_100012022510_100000211926 [0,2,0,0,0,0|1,0,1]=4 8434 B12R1.1631 OCCNc1c(cccc1F)O 34a_100020591140_100000211926 [0,2,0,0,0,0|1,0,1]=4 8435 B12R1.1631 OCCSc1c(cccc1Br)O 62a_100000211926_100010187912 [0,2,0,0,0,0|1,0,1]=4 8436 B12R1.1631 OCCSc1c(cccc1Br)O 62a_100010187912_100000211926 [0,2,0,0,0,0|1,0,1]=4 8437 B12R1.1631 OCCSc1c(cccc1Cl)O 62a_100000211926_100000050174 [0,2,0,0,0,0|1,0,1]=4 8438 B12R1.1631 OCCSc1c(cccc1F)O 62a_100000211926_100009820682 [0,2,0,0,0,0|1,0,1]=4 8439 B12R1.1631 OCCSc1c(cccc1F)O 62a_100009820682_100000211926 [0,2,0,0,0,0|1,0,1]=4 8440 B12R1.1631 OCCSc1c(cccc1O)O 62a_100000211926_100010205330 [0,2,0,0,0,0|1,0,1]=4 8441 B12R1.1631 Oc1cccc(c1NCCF)Br 34a_100011934926_100011217306 [0,2,0,0,0,0|1,0,1]=4 8442 B12R1.1631 Oc1cccc(c1NCCF)Cl 34a_100012022510_100011217306 [0,2,0,0,0,0|1,0,1]=4 8443 B12R1.1631 Oc1cccc(c1NCCF)F 34a_100020591140_100011217306 [0,2,0,0,0,0|1,0,1]=4 8444 B12R1.1631 Oc1cccc(c1SCCF)Br 62a_100010187912_100011217306 [0,2,0,0,0,0|1,0,1]=4 8445 B12R1.1631 Oc1cccc(c1SCCF)Br 62a_100011217306_100010187912 [0,2,0,0,0,0|1,0,1]=4 8446 B12R1.1631 Oc1cccc(c1SCCF)Cl 62a_100011217306_100000050174 [0,2,0,0,0,0|1,0,1]=4 8447 B12R1.1631 Oc1cccc(c1SCCF)F 62a_100009820682_100011217306 [0,2,0,0,0,0|1,0,1]=4 8448 B12R1.1631 Oc1cccc(c1SCCF)F 62a_100011217306_100009820682 [0,2,0,0,0,0|1,0,1]=4 8449 B12R1.1631 Oc1cccc(c1SCCF)O 62a_100011217306_100010205330 [0,2,0,0,0,0|1,0,1]=4 8450 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,2,0,0,0,0|1,0,1]=4 8451 B12R1.75 C=Cc1ccccc1CC(=O)N 271570a_100011290941_200009814924 [0,2,0,0,0,0|2,0,0]=4 8452 B12R1.75 CC(=Cc1ccccc1CO)C 271570a_100102525489_100000187465 [0,2,0,0,0,0|0,0,2]=4 8453 B12R1.75 CC(=O)Cc1ccccc1C#N 1458a_100000070787_100000181865 [0,2,0,0,0,0|1,0,1]=4 8454 B12R1.75 CC(=O)Cc1ccccc1C#N 1458a_100000238613_200000210301 [0,2,0,0,0,0|1,0,1]=4 8455 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [0,2,0,0,0,0|0,0,2]=4 8456 B12R1.75 CC(=O)Cc1ccccc1CO 1458a_100000070787_100009816955 [0,2,0,0,0,0|0,0,1]=3 8457 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_100011350739_200025704644 [0,2,0,0,0,0|0,1,1]=4 8458 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100011350739 [0,2,0,0,0,0|0,1,1]=4 8459 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [0,2,0,0,0,0|1,0,1]=4 8460 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 34a_100000185124_200025704644 [0,2,0,0,0,0|1,0,1]=4 8461 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 7a_100000185124_200025704644 [0,2,0,0,0,0|1,0,1]=4 8462 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100000044721_200000210301 [0,2,0,0,0,0|1,0,1]=4 8463 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100102631434_100009816955 [0,2,0,0,0,0|1,0,1]=4 8464 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100000044721_200000210301 [0,2,0,0,0,0|1,0,1]=4 8465 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100102631434_100009816955 [0,2,0,0,0,0|1,0,1]=4 8466 B12R1.75 CN([13CH3])Cc1ccccc1CO 2230a_100000044721_200025704644 [0,2,0,0,0,0|1,0,1]=4 8467 B12R1.75 CN([13CH3])Cc1ccccc1CO 269982a_100000044721_200025704644 [0,2,0,0,0,0|1,0,1]=4 8468 B12R1.75 COc1ccccc1C=C(C)C 271570a_100102525489_100000174000 [0,2,0,0,0,0|0,0,2]=4 8469 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000070787_100000210004 [0,2,0,0,0,0|0,0,1]=3 8470 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000211604_200000210301 [0,2,0,0,0,0|0,0,1]=3 8471 B12R1.75 COc1ccccc1CC(=O)[13CH3] 1458a_100000211604_200025704644 [0,2,0,0,0,0|0,0,1]=3 8472 B12R1.75 COc1ccccc1CN(C)C 2230a_100000184376_200000210301 [0,2,0,0,0,0|1,0,1]=4 8473 B12R1.75 COc1ccccc1CN(C)C 2230a_100102631434_100000210004 [0,2,0,0,0,0|1,0,1]=4 8474 B12R1.75 COc1ccccc1CN(C)C 269982a_100000184376_200000210301 [0,2,0,0,0,0|1,0,1]=4 8475 B12R1.75 COc1ccccc1CN(C)C 269982a_100102631434_100000210004 [0,2,0,0,0,0|1,0,1]=4 8476 B12R1.75 COc1ccccc1CN(C)C 270004a_100102631434_100000169842 [0,2,0,0,0,0|1,0,1]=4 8477 B12R1.75 COc1ccccc1CN(C)[13CH3] 2230a_100000184376_200025704644 [0,2,0,0,0,0|1,0,1]=4 8478 B12R1.75 COc1ccccc1CN(C)[13CH3] 269982a_100000184376_200025704644 [0,2,0,0,0,0|1,0,1]=4 8479 B12R1.75 COc1ccccc1NC(=O)C 11a_100000210025_100015343762 [0,2,0,0,0,0|1,0,1]=4 8480 B12R1.75 COc1ccccc1NC(=O)C 1626a_100000210025_100015343762 [0,2,0,0,0,0|1,0,1]=4 8481 B12R1.75 COc1ccccc1NC(=O)C 22a_100000210025_100000070787 [0,2,0,0,0,0|1,0,1]=4 8482 B12R1.75 COc1ccccc1NC(=O)C 34a_100000185124_200000210301 [0,2,0,0,0,0|1,0,1]=4 8483 B12R1.75 COc1ccccc1NC(=O)C 527a_100000210025_100103153847 [0,2,0,0,0,0|1,0,1]=4 8484 B12R1.75 COc1ccccc1NC(=O)C 7a_100000185124_200000210301 [0,2,0,0,0,0|1,0,1]=4 8485 B12R1.75 COc1ccccc1NC(=S)N 7a_200000011649_200000210301 [0,2,0,0,0,0|2,0,0]=4 8486 B12R1.75 COc1cnccc1CC(=O)C 1458a_100000070787_100020635607 [0,2,0,0,0,0|1,0,1]=4 8487 B12R1.75 COc1ncccc1CC(=O)C 1458a_100000070787_100020631285 [0,2,0,0,0,0|1,0,1]=4 8488 B12R1.75 CSc1ccccc1CC(=O)C 1458a_100000070787_100000699184 [0,2,0,0,0,0|0,1,1]=4 8489 B12R1.75 CSc1ccccc1CC(=O)C 62a_100011350739_200000210301 [0,2,0,0,0,0|0,1,1]=4 8490 B12R1.75 CSc1ccccc1CC(=O)C 62a_200000210301_100011350739 [0,2,0,0,0,0|0,1,1]=4 8491 B12R1.75 CSc1ccccc1CC(=O)N 62a_200000210301_200009814924 [0,2,0,0,0,0|1,1,0]=4 8492 B12R1.75 CSc1ccccc1CC(=O)N 62a_200009814924_200000210301 [0,2,0,0,0,0|1,1,0]=4 8493 B12R1.75 [13CH3]C(=O)Cc1ccccc1C#N 1458a_100000238613_200025704644 [0,2,0,0,0,0|1,0,1]=4 8494 B12R1.75 [13CH3]Oc1ccccc1NC(=S)N 7a_200000011649_200025704644 [0,2,0,0,0,0|2,0,0]=4 8495 B12R1.75 [13CH3]Sc1ccccc1CC(=O)N 62a_200009814924_200025704644 [0,2,0,0,0,0|1,1,0]=4 8496 B12R1.75 [13CH3]Sc1ccccc1CC(=O)N 62a_200025704644_200009814924 [0,2,0,0,0,0|1,1,0]=4 8497 B12R1.77 CCC(C)c1ccccc1OC 7a_100000211618_200000210301 [0,2,0,0,0,0|0,0,2]=4 8498 B12R1.77 CCC(C)c1ccccc1O[13CH3] 7a_100000211618_200025704644 [0,2,0,0,0,0|0,0,2]=4 8499 B12R1.77 CNC(C)c1ccccc1OC 2230a_100000185323_200000210301 [0,2,0,0,0,0|1,0,1]=4 8500 B12R1.77 CNC(C)c1ccccc1OC 269862a_106832991636_100000173324 [0,2,0,0,0,0|1,0,1]=4 8501 B12R1.77 COc1ccccc1C(C)N[13CH3] 2230a_100000185323_200025704644 [0,2,0,0,0,0|1,0,1]=4 8502 B12R1.77 COc1ccccc1C(C)OC 7a_100000742714_200000210301 [0,2,0,0,0,0|1,0,1]=4 8503 B12R1.77 COc1ccccc1C(C)O[13CH3] 7a_100000742714_200025704644 [0,2,0,0,0,0|1,0,1]=4 8504 B12R1.112 C=C=Cc1ccc(cc1CO)Br 271570a_100015277604_100011356890 [0,2,0,0,0,0|0,0,2]=4 8505 B12R1.112 C=C=Cc1ccc(cc1CO)C 271570a_100015277604_100012361352 [0,2,0,0,0,0|0,0,2]=4 8506 B12R1.112 C=C=Cc1ccc(cc1CO)F 271570a_100015277604_100011217561 [0,2,0,0,0,0|0,0,2]=4 8507 B12R1.112 C=C=Cc1ccc(cc1CO)N 271570a_100015277604_100012347228 [0,2,0,0,0,0|0,0,2]=4 8508 B12R1.112 C=C=Cc1ccc(cc1CO)O 271570a_100015277604_100012351483 [0,2,0,0,0,0|0,0,2]=4 8509 B12R1.112 C=C=Cc1ccc(cc1OC)Br 271570a_100015277604_100010245111 [0,2,0,0,0,0|0,0,2]=4 8510 B12R1.112 C=C=Cc1ccc(cc1OC)C 271570a_100015277604_100010200004 [0,2,0,0,0,0|0,0,2]=4 8511 B12R1.112 C=C=Cc1ccc(cc1OC)Cl 271570a_100015277604_100000050115 [0,2,0,0,0,0|0,0,2]=4 8512 B12R1.112 C=C=Cc1ccc(cc1OC)F 271570a_100015277604_100000757151 [0,2,0,0,0,0|0,0,2]=4 8513 B12R1.112 C=C=Cc1ccc(cc1OC)N 271570a_100015277604_100000765947 [0,2,0,0,0,0|0,0,2]=4 8514 B12R1.112 C=C=Cc1ccc(cc1OC)O 271570a_100015277604_100011827694 [0,2,0,0,0,0|0,0,2]=4 8515 B12R1.112 CC=Cc1ccc(cc1CO)Br 271570a_100016259895_100011356890 [0,2,0,0,0,0|0,0,2]=4 8516 B12R1.112 CC=Cc1ccc(cc1CO)C 271570a_100016259895_100012361352 [0,2,0,0,0,0|0,0,2]=4 8517 B12R1.112 CC=Cc1ccc(cc1CO)F 271570a_100016259895_100011217561 [0,2,0,0,0,0|0,0,2]=4 8518 B12R1.112 CC=Cc1ccc(cc1CO)N 271570a_100016259895_100012347228 [0,2,0,0,0,0|0,0,2]=4 8519 B12R1.112 CC=Cc1ccc(cc1CO)O 271570a_100016259895_100012351483 [0,2,0,0,0,0|0,0,2]=4 8520 B12R1.112 CC=Cc1ccc(cc1OC)Br 271570a_100016259895_100010245111 [0,2,0,0,0,0|0,0,2]=4 8521 B12R1.112 CC=Cc1ccc(cc1OC)C 271570a_100016259895_100010200004 [0,2,0,0,0,0|0,0,2]=4 8522 B12R1.112 CC=Cc1ccc(cc1OC)Cl 271570a_100016259895_100000050115 [0,2,0,0,0,0|0,0,2]=4 8523 B12R1.112 CC=Cc1ccc(cc1OC)F 271570a_100016259895_100000757151 [0,2,0,0,0,0|0,0,2]=4 8524 B12R1.112 CC=Cc1ccc(cc1OC)N 271570a_100016259895_100000765947 [0,2,0,0,0,0|0,0,2]=4 8525 B12R1.112 CC=Cc1ccc(cc1OC)O 271570a_100016259895_100011827694 [0,2,0,0,0,0|0,0,2]=4 8526 B12R1.112 CNCc1ccc(cc1CO)Br 26a_100102657272_100000184703 [0,2,0,0,0,0|1,0,1]=4 8527 B12R1.112 CNCc1ccc(cc1OC)Br 207a_100102657272_100000697075 [0,2,0,0,0,0|1,0,1]=4 8528 B12R1.112 CNCc1ccc(cc1OC)Br 2230a_106832991635_100012359436 [0,2,0,0,0,0|1,0,1]=4 8529 B12R1.112 CNCc1ccc(cc1OC)Br 26a_100102657272_100000694246 [0,2,0,0,0,0|1,0,1]=4 8530 B12R1.112 CNCc1ccc(cc1OC)Br 270004a_106832991635_100000697075 [0,2,0,0,0,0|1,0,1]=4 8531 B12R1.112 CNCc1ccc(cc1OC)Br 34a_100102657272_100012359436 [0,2,0,0,0,0|1,0,1]=4 8532 B12R1.112 CNCc1ccc(cc1OC)Br 7a_106832991635_100012359436 [0,2,0,0,0,0|1,0,1]=4 8533 B12R1.112 CNCc1ccc(cc1OC)C 207a_100102657272_100000689369 [0,2,0,0,0,0|1,0,1]=4 8534 B12R1.112 CNCc1ccc(cc1OC)C 270004a_106832991635_100000689369 [0,2,0,0,0,0|1,0,1]=4 8535 B12R1.112 CNCc1ccc(cc1OC)Cl 207a_100102657272_100000235374 [0,2,0,0,0,0|1,0,1]=4 8536 B12R1.112 CNCc1ccc(cc1OC)Cl 270004a_106832991635_100000235374 [0,2,0,0,0,0|1,0,1]=4 8537 B12R1.112 CNCc1ccc(cc1OC)F 207a_100102657272_100000042785 [0,2,0,0,0,0|1,0,1]=4 8538 B12R1.112 CNCc1ccc(cc1OC)F 2230a_106832991635_200010171551 [0,2,0,0,0,0|1,0,1]=4 8539 B12R1.112 CNCc1ccc(cc1OC)F 270004a_106832991635_100000042785 [0,2,0,0,0,0|1,0,1]=4 8540 B12R1.112 CNCc1ccc(cc1OC)F 34a_100000062129_200000210301 [0,2,0,0,0,0|1,0,1]=4 8541 B12R1.112 CNCc1ccc(cc1OC)F 34a_100102657272_200010171551 [0,2,0,0,0,0|1,0,1]=4 8542 B12R1.112 CNCc1ccc(cc1OC)F 7a_106832991635_200010171551 [0,2,0,0,0,0|1,0,1]=4 8543 B12R1.112 CNCc1ccc(cc1OC)I 207a_100102657272_100010290300 [0,2,0,0,0,0|1,0,1]=4 8544 B12R1.112 COCc1ccc(cc1OC)Br 34a_100011277633_200000210301 [0,2,0,0,0,0|1,0,1]=4 8545 B12R1.112 COCc1ccc(cc1OC)Br 34a_100138415774_100012359436 [0,2,0,0,0,0|1,0,1]=4 8546 B12R1.112 COCc1ccc(cc1OC)Br 7a_100011277633_200000210301 [0,2,0,0,0,0|1,0,1]=4 8547 B12R1.112 COCc1ccc(cc1OC)C 34a_200012017176_200000210301 [0,2,0,0,0,0|1,0,1]=4 8548 B12R1.112 COCc1ccc(cc1OC)C 7a_200012017176_200000210301 [0,2,0,0,0,0|1,0,1]=4 8549 B12R1.112 COCc1ccc(cc1OC)Cl 34a_200011215853_200000210301 [0,2,0,0,0,0|1,0,1]=4 8550 B12R1.112 COCc1ccc(cc1OC)Cl 7a_200011215853_200000210301 [0,2,0,0,0,0|1,0,1]=4 8551 B12R1.112 COCc1ccc(cc1OC)F 34a_100000117171_200000210301 [0,2,0,0,0,0|1,0,1]=4 8552 B12R1.112 COCc1ccc(cc1OC)F 34a_100138415774_200010171551 [0,2,0,0,0,0|1,0,1]=4 8553 B12R1.112 COCc1ccc(cc1OC)F 7a_100000117171_200000210301 [0,2,0,0,0,0|1,0,1]=4 8554 B12R1.112 COCc1ccc(cc1OC)I 34a_100010233823_200000210301 [0,2,0,0,0,0|1,0,1]=4 8555 B12R1.112 COCc1ccc(cc1OC)I 7a_100010233823_200000210301 [0,2,0,0,0,0|1,0,1]=4 8556 B12R1.112 COCc1ccc(cc1OC)N 34a_100012183141_200000210301 [0,2,0,0,0,0|1,0,1]=4 8557 B12R1.112 COc1cc(ccc1CC#N)O 271570a_203496583355_100010245117 [0,2,0,0,0,0|1,0,1]=4 8558 B12R1.112 COc1cc(ccc1CN[13CH3])F 34a_100000062129_200025704644 [0,2,0,0,0,0|1,0,1]=4 8559 B12R1.112 COc1cc(ccc1CO[13CH3])Br 34a_100011277633_200025704644 [0,2,0,0,0,0|1,0,1]=4 8560 B12R1.112 COc1cc(ccc1CO[13CH3])Br 7a_100011277633_200025704644 [0,2,0,0,0,0|1,0,1]=4 8561 B12R1.112 COc1cc(ccc1CO[13CH3])C 34a_200012017176_200025704644 [0,2,0,0,0,0|1,0,1]=4 8562 B12R1.112 COc1cc(ccc1CO[13CH3])C 7a_200012017176_200025704644 [0,2,0,0,0,0|1,0,1]=4 8563 B12R1.112 COc1cc(ccc1CO[13CH3])Cl 34a_200011215853_200025704644 [0,2,0,0,0,0|1,0,1]=4 8564 B12R1.112 COc1cc(ccc1CO[13CH3])Cl 7a_200011215853_200025704644 [0,2,0,0,0,0|1,0,1]=4 8565 B12R1.112 COc1cc(ccc1CO[13CH3])F 34a_100000117171_200025704644 [0,2,0,0,0,0|1,0,1]=4 8566 B12R1.112 COc1cc(ccc1CO[13CH3])F 7a_100000117171_200025704644 [0,2,0,0,0,0|1,0,1]=4 8567 B12R1.112 COc1cc(ccc1CO[13CH3])I 34a_100010233823_200025704644 [0,2,0,0,0,0|1,0,1]=4 8568 B12R1.112 COc1cc(ccc1CO[13CH3])I 7a_100010233823_200025704644 [0,2,0,0,0,0|1,0,1]=4 8569 B12R1.112 COc1cc(ccc1CO[13CH3])N 34a_100012183141_200025704644 [0,2,0,0,0,0|1,0,1]=4 8570 B12R1.112 COc1cc(ccc1CSC)Br 62a_100012359436_200000210301 [0,2,0,0,0,0|1,0,1]=4 8571 B12R1.112 COc1cc(ccc1CSC)Br 62a_200000210301_100012359436 [0,2,0,0,0,0|1,0,1]=4 8572 B12R1.112 COc1cc(ccc1CSC)F 62a_200000210301_200010171551 [0,2,0,0,0,0|1,0,1]=4 8573 B12R1.112 COc1cc(ccc1CSC)F 62a_200010171551_200000210301 [0,2,0,0,0,0|1,0,1]=4 8574 B12R1.112 COc1cc(ccc1CS[13CH3])Br 62a_100012359436_200025704644 [0,2,0,0,0,0|1,0,1]=4 8575 B12R1.112 COc1cc(ccc1CS[13CH3])Br 62a_200025704644_100012359436 [0,2,0,0,0,0|1,0,1]=4 8576 B12R1.112 COc1cc(ccc1CS[13CH3])F 62a_200010171551_200025704644 [0,2,0,0,0,0|1,0,1]=4 8577 B12R1.112 COc1cc(ccc1CS[13CH3])F 62a_200025704644_200010171551 [0,2,0,0,0,0|1,0,1]=4 8578 B12R1.169 C/C=C/c1ccccc1OCC 34a_200000189419_100000210202 [0,2,0,0,0,0|0,0,2]=4 8579 B12R1.169 C/C=C/c1ccccc1OCC 7a_200000189419_100000210202 [0,2,0,0,0,0|0,0,2]=4 8580 B12R1.169 C/C=C/c1ccccc1OCF 34a_200000189419_100015361967 [0,2,0,0,0,0|0,0,2]=4 8581 B12R1.169 C/C=C/c1ccccc1OCF 7a_200000189419_100015361967 [0,2,0,0,0,0|0,0,2]=4 8582 B12R1.169 C=C=Cc1ccccc1CC=C 271570a_100015277604_100009828059 [0,2,0,0,0,0|1,0,0]=3 8583 B12R1.169 C=C=Cc1ccccc1CCO 271570a_100015277604_100000731337 [0,2,0,0,0,0|0,0,2]=4 8584 B12R1.169 C=C=Cc1ccccc1COC 271570a_100015277604_100011493684 [0,2,0,0,0,0|0,0,2]=4 8585 B12R1.169 C=C=Cc1ccccc1OCC 271570a_100015277604_100000230754 [0,2,0,0,0,0|0,0,2]=4 8586 B12R1.169 C=CCc1ccccc1C=CC 271570a_100016259895_100009828059 [0,2,0,0,0,0|1,0,0]=3 8587 B12R1.169 C=CCc1ccccc1CNC 207a_100102657272_100010619294 [0,2,0,0,0,0|1,0,0]=3 8588 B12R1.169 C=CCc1ccccc1CNC 26a_100102657272_100000211836 [0,2,0,0,0,0|1,0,0]=3 8589 B12R1.169 C=CCc1ccccc1CNC 270004a_106832991635_100010619294 [0,2,0,0,0,0|1,0,0]=3 8590 B12R1.169 C=CCc1ccccc1NCC 2230a_200138433279_100000210202 [0,2,0,0,0,0|1,0,0]=3 8591 B12R1.169 C=CCc1ccccc1NCC 34a_200138433279_100000210202 [0,2,0,0,0,0|1,0,0]=3 8592 B12R1.169 C=CCc1ccccc1NCF 34a_200138433279_100015361967 [0,2,0,0,0,0|1,0,0]=3 8593 B12R1.169 C=CCc1ccccc1OCC 34a_100000211836_100000210202 [0,2,0,0,0,0|0,0,0]=2 8594 B12R1.169 C=CCc1ccccc1OCC 7a_100000211836_100000210202 [0,2,0,0,0,0|0,0,0]=2 8595 B12R1.169 C=CCc1ccccc1OCF 34a_100000211836_100015361967 [0,2,0,0,0,0|0,0,0]=2 8596 B12R1.169 C=CCc1ccccc1OCF 7a_100000211836_100015361967 [0,2,0,0,0,0|0,0,0]=2 8597 B12R1.169 C=CCc1ccccc1SCC 62a_100000210202_100009828059 [0,2,0,0,0,0|0,1,0]=3 8598 B12R1.169 C=CCc1ccccc1SCC 62a_100009828059_100000210202 [0,2,0,0,0,0|0,1,0]=3 8599 B12R1.169 C=CCc1ccccc1SCF 62a_100009828059_100015361967 [0,2,0,0,0,0|0,1,0]=3 8600 B12R1.169 C=CCc1ccccc1SCF 62a_100015361967_100009828059 [0,2,0,0,0,0|0,1,0]=3 8601 B12R1.169 CC=Cc1ccccc1CCO 271570a_100016259895_100000731337 [0,2,0,0,0,0|0,0,2]=4 8602 B12R1.169 CC=Cc1ccccc1COC 271570a_100016259895_100011493684 [0,2,0,0,0,0|0,0,2]=4 8603 B12R1.169 CC=Cc1ccccc1OCC 271570a_100016259895_100000230754 [0,2,0,0,0,0|0,0,2]=4 8604 B12R1.169 CCCc1ccccc1OCC 34a_100011217252_100000210202 [0,2,0,0,0,0|0,0,2]=4 8605 B12R1.169 CCCc1ccccc1OCC 7a_100011217252_100000210202 [0,2,0,0,0,0|0,0,2]=4 8606 B12R1.169 CCCc1ccccc1OCF 34a_100011217252_100015361967 [0,2,0,0,0,0|0,0,2]=4 8607 B12R1.169 CCCc1ccccc1OCF 7a_100011217252_100015361967 [0,2,0,0,0,0|0,0,2]=4 8608 B12R1.169 CCOc1ccccc1CC#N 34a_100000043107_100000210202 [0,2,0,0,0,0|1,0,1]=4 8609 B12R1.169 CCOc1ccccc1CC#N 7a_100000043107_100000210202 [0,2,0,0,0,0|1,0,1]=4 8610 B12R1.169 CCOc1ccccc1CCBr 34a_100000722297_100000210202 [0,2,0,0,0,0|1,0,1]=4 8611 B12R1.169 CCOc1ccccc1CCBr 7a_100000722297_100000210202 [0,2,0,0,0,0|1,0,1]=4 8612 B12R1.169 CCOc1ccccc1CCN 34a_100011207237_100000210202 [0,2,0,0,0,0|1,0,1]=4 8613 B12R1.169 CCOc1ccccc1CCO 34a_100000719421_100000210202 [0,2,0,0,0,0|1,0,1]=4 8614 B12R1.169 CCOc1ccccc1CCO 7a_100000719421_100000210202 [0,2,0,0,0,0|1,0,1]=4 8615 B12R1.169 CCOc1ccccc1CNC 207a_100102657272_100000169843 [0,2,0,0,0,0|1,0,1]=4 8616 B12R1.169 CCOc1ccccc1CNC 270004a_106832991635_100000169843 [0,2,0,0,0,0|1,0,1]=4 8617 B12R1.169 CCOc1ccccc1CNC 34a_100015189988_100000210202 [0,2,0,0,0,0|1,0,1]=4 8618 B12R1.169 CCOc1ccccc1COC 34a_100000708577_200000210301 [0,2,0,0,0,0|1,0,1]=4 8619 B12R1.169 CCOc1ccccc1COC 34a_100011488565_100000210202 [0,2,0,0,0,0|1,0,1]=4 8620 B12R1.169 CCOc1ccccc1COC 7a_100000708577_200000210301 [0,2,0,0,0,0|1,0,1]=4 8621 B12R1.169 CCOc1ccccc1COC 7a_100011488565_100000210202 [0,2,0,0,0,0|1,0,1]=4 8622 B12R1.169 CCOc1ccccc1CO[13CH3] 34a_100000708577_200025704644 [0,2,0,0,0,0|1,0,1]=4 8623 B12R1.169 CCOc1ccccc1CO[13CH3] 7a_100000708577_200025704644 [0,2,0,0,0,0|1,0,1]=4 8624 B12R1.169 CNCc1ccccc1OCF 34a_100015189988_100015361967 [0,2,0,0,0,0|1,0,1]=4 8625 B12R1.169 COCc1ccccc1OCF 34a_100011488565_100015361967 [0,2,0,0,0,0|1,0,1]=4 8626 B12R1.169 COCc1ccccc1OCF 7a_100011488565_100015361967 [0,2,0,0,0,0|1,0,1]=4 8627 B12R1.169 FCOc1ccccc1CCBr 34a_100000722297_100015361967 [0,2,0,0,0,0|1,0,1]=4 8628 B12R1.169 FCOc1ccccc1CCBr 7a_100000722297_100015361967 [0,2,0,0,0,0|1,0,1]=4 8629 B12R1.169 N#CCc1ccccc1OCF 34a_100000043107_100015361967 [0,2,0,0,0,0|1,0,1]=4 8630 B12R1.169 N#CCc1ccccc1OCF 7a_100000043107_100015361967 [0,2,0,0,0,0|1,0,1]=4 8631 B12R1.169 NCCc1ccccc1OCF 34a_100011207237_100015361967 [0,2,0,0,0,0|1,0,1]=4 8632 B12R1.169 OCCc1ccccc1OCF 34a_100000719421_100015361967 [0,2,0,0,0,0|1,0,1]=4 8633 B12R1.169 OCCc1ccccc1OCF 7a_100000719421_100015361967 [0,2,0,0,0,0|1,0,1]=4 8634 B12R1.268 C=C=Cc1cc(ccc1CO)Br 271570a_100015277604_100010146605 [0,2,0,0,0,0|0,0,2]=4 8635 B12R1.268 C=C=Cc1cc(ccc1CO)Cl 271570a_100015277604_100000722340 [0,2,0,0,0,0|0,0,2]=4 8636 B12R1.268 C=C=Cc1cc(ccc1CO)F 271570a_100015277604_100000744086 [0,2,0,0,0,0|0,0,2]=4 8637 B12R1.268 C=C=Cc1cc(ccc1CO)O 271570a_100015277604_100010146404 [0,2,0,0,0,0|0,0,2]=4 8638 B12R1.268 C=C=Cc1cc(ccc1OC)Br 271570a_100015277604_100012351588 [0,2,0,0,0,0|0,0,2]=4 8639 B12R1.268 C=C=Cc1cc(ccc1OC)C 271570a_100015277604_100000186399 [0,2,0,0,0,0|0,0,2]=4 8640 B12R1.268 C=C=Cc1cc(ccc1OC)Cl 271570a_100015277604_100011215930 [0,2,0,0,0,0|0,0,2]=4 8641 B12R1.268 C=C=Cc1cc(ccc1OC)F 271570a_100015277604_100000171694 [0,2,0,0,0,0|0,0,2]=4 8642 B12R1.268 C=C=Cc1cc(ccc1OC)N 271570a_100015277604_100000187427 [0,2,0,0,0,0|0,0,2]=4 8643 B12R1.268 C=C=Cc1cc(ccc1OC)O 271570a_100015277604_100010084122 [0,2,0,0,0,0|0,0,2]=4 8644 B12R1.268 CC=Cc1cc(ccc1CO)Br 271570a_100016259895_100010146605 [0,2,0,0,0,0|0,0,2]=4 8645 B12R1.268 CC=Cc1cc(ccc1CO)Cl 271570a_100016259895_100000722340 [0,2,0,0,0,0|0,0,2]=4 8646 B12R1.268 CC=Cc1cc(ccc1CO)F 271570a_100016259895_100000744086 [0,2,0,0,0,0|0,0,2]=4 8647 B12R1.268 CC=Cc1cc(ccc1CO)O 271570a_100016259895_100010146404 [0,2,0,0,0,0|0,0,2]=4 8648 B12R1.268 CC=Cc1cc(ccc1OC)Br 271570a_100016259895_100012351588 [0,2,0,0,0,0|0,0,2]=4 8649 B12R1.268 CC=Cc1cc(ccc1OC)C 271570a_100016259895_100000186399 [0,2,0,0,0,0|0,0,2]=4 8650 B12R1.268 CC=Cc1cc(ccc1OC)Cl 271570a_100016259895_100011215930 [0,2,0,0,0,0|0,0,2]=4 8651 B12R1.268 CC=Cc1cc(ccc1OC)F 271570a_100016259895_100000171694 [0,2,0,0,0,0|0,0,2]=4 8652 B12R1.268 CC=Cc1cc(ccc1OC)N 271570a_100016259895_100000187427 [0,2,0,0,0,0|0,0,2]=4 8653 B12R1.268 CC=Cc1cc(ccc1OC)O 271570a_100016259895_100010084122 [0,2,0,0,0,0|0,0,2]=4 8654 B12R1.268 CNCc1cc(ccc1CO)Br 26a_100102657272_100000071718 [0,2,0,0,0,0|1,0,1]=4 8655 B12R1.268 CNCc1cc(ccc1OC)Br 207a_100102657272_100000170026 [0,2,0,0,0,0|1,0,1]=4 8656 B12R1.268 CNCc1cc(ccc1OC)Br 2230a_106832991635_100000204665 [0,2,0,0,0,0|1,0,1]=4 8657 B12R1.268 CNCc1cc(ccc1OC)Br 26a_100102657272_100009816560 [0,2,0,0,0,0|1,0,1]=4 8658 B12R1.268 CNCc1cc(ccc1OC)Br 270004a_106832991635_100000170026 [0,2,0,0,0,0|1,0,1]=4 8659 B12R1.268 CNCc1cc(ccc1OC)Br 34a_100000690498_200000210301 [0,2,0,0,0,0|1,0,1]=4 8660 B12R1.268 CNCc1cc(ccc1OC)Br 34a_100011602694_200000210301 [0,2,0,0,0,0|1,0,1]=4 8661 B12R1.268 CNCc1cc(ccc1OC)Br 34a_100102657272_100000204665 [0,2,0,0,0,0|1,0,1]=4 8662 B12R1.268 CNCc1cc(ccc1OC)Br 7a_106832991635_100000204665 [0,2,0,0,0,0|1,0,1]=4 8663 B12R1.268 CNCc1cc(ccc1OC)C 207a_100102657272_100000203738 [0,2,0,0,0,0|1,0,1]=4 8664 B12R1.268 CNCc1cc(ccc1OC)C 2230a_106832991635_100000199068 [0,2,0,0,0,0|1,0,1]=4 8665 B12R1.268 CNCc1cc(ccc1OC)C 270004a_106832991635_100000203738 [0,2,0,0,0,0|1,0,1]=4 8666 B12R1.268 CNCc1cc(ccc1OC)C 34a_100102657272_100000199068 [0,2,0,0,0,0|1,0,1]=4 8667 B12R1.268 CNCc1cc(ccc1OC)C 7a_106832991635_100000199068 [0,2,0,0,0,0|1,0,1]=4 8668 B12R1.268 CNCc1cc(ccc1OC)Cl 207a_100102657272_100000188328 [0,2,0,0,0,0|1,0,1]=4 8669 B12R1.268 CNCc1cc(ccc1OC)Cl 2230a_100000740580_200000210301 [0,2,0,0,0,0|1,0,1]=4 8670 B12R1.268 CNCc1cc(ccc1OC)Cl 2230a_106832991635_100000209806 [0,2,0,0,0,0|1,0,1]=4 8671 B12R1.268 CNCc1cc(ccc1OC)Cl 270004a_106832991635_100000188328 [0,2,0,0,0,0|1,0,1]=4 8672 B12R1.268 CNCc1cc(ccc1OC)Cl 34a_100000712467_200000210301 [0,2,0,0,0,0|1,0,1]=4 8673 B12R1.268 CNCc1cc(ccc1OC)Cl 34a_100000740580_200000210301 [0,2,0,0,0,0|1,0,1]=4 8674 B12R1.268 CNCc1cc(ccc1OC)Cl 34a_100102657272_100000209806 [0,2,0,0,0,0|1,0,1]=4 8675 B12R1.268 CNCc1cc(ccc1OC)Cl 7a_106832991635_100000209806 [0,2,0,0,0,0|1,0,1]=4 8676 B12R1.268 CNCc1cc(ccc1OC)F 207a_100102657272_100000722865 [0,2,0,0,0,0|1,0,1]=4 8677 B12R1.268 CNCc1cc(ccc1OC)F 2230a_106832991635_100011830354 [0,2,0,0,0,0|1,0,1]=4 8678 B12R1.268 CNCc1cc(ccc1OC)F 270004a_106832991635_100000722865 [0,2,0,0,0,0|1,0,1]=4 8679 B12R1.268 CNCc1cc(ccc1OC)F 34a_100011199032_200000210301 [0,2,0,0,0,0|1,0,1]=4 8680 B12R1.268 CNCc1cc(ccc1OC)F 34a_100102657272_100011830354 [0,2,0,0,0,0|1,0,1]=4 8681 B12R1.268 CNCc1cc(ccc1OC)F 34a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 8682 B12R1.268 CNCc1cc(ccc1OC)F 7a_106832991635_100011830354 [0,2,0,0,0,0|1,0,1]=4 8683 B12R1.268 CNCc1cc(ccc1OC)I 207a_100102657272_100011266407 [0,2,0,0,0,0|1,0,1]=4 8684 B12R1.268 CNCc1cc(ccc1OC)I 270004a_106832991635_100011266407 [0,2,0,0,0,0|1,0,1]=4 8685 B12R1.268 CNCc1cc(ccc1OC)O 207a_100102657272_100000067581 [0,2,0,0,0,0|1,0,1]=4 8686 B12R1.268 CNCc1cc(ccc1OC)O 271570a_203496583355_100000690607 [0,2,0,0,0,0|1,0,1]=4 8687 B12R1.268 CNCc1cc(ccc1O[13CH3])Br 34a_100011602694_200025704644 [0,2,0,0,0,0|1,0,1]=4 8688 B12R1.268 CNCc1cc(ccc1O[13CH3])Cl 34a_100000712467_200025704644 [0,2,0,0,0,0|1,0,1]=4 8689 B12R1.268 CNCc1cc(ccc1O[13CH3])F 34a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 8690 B12R1.268 COCc1cc(ccc1OC)Br 34a_100000204679_200000210301 [0,2,0,0,0,0|1,0,1]=4 8691 B12R1.268 COCc1cc(ccc1OC)Br 34a_100138415774_100000204665 [0,2,0,0,0,0|1,0,1]=4 8692 B12R1.268 COCc1cc(ccc1OC)Br 7a_100000204679_200000210301 [0,2,0,0,0,0|1,0,1]=4 8693 B12R1.268 COCc1cc(ccc1OC)C 34a_100138415774_100000199068 [0,2,0,0,0,0|1,0,1]=4 8694 B12R1.268 COCc1cc(ccc1OC)C 34a_200000246444_200000210301 [0,2,0,0,0,0|1,0,1]=4 8695 B12R1.268 COCc1cc(ccc1OC)C 7a_200000246444_200000210301 [0,2,0,0,0,0|1,0,1]=4 8696 B12R1.268 COCc1cc(ccc1OC)Cl 34a_100138415774_100000209806 [0,2,0,0,0,0|1,0,1]=4 8697 B12R1.268 COCc1cc(ccc1OC)F 34a_100011266440_200000210301 [0,2,0,0,0,0|1,0,1]=4 8698 B12R1.268 COCc1cc(ccc1OC)F 34a_100135391359_200000210301 [0,2,0,0,0,0|1,0,1]=4 8699 B12R1.268 COCc1cc(ccc1OC)F 34a_100138415774_100011830354 [0,2,0,0,0,0|1,0,1]=4 8700 B12R1.268 COCc1cc(ccc1OC)F 7a_100011266440_200000210301 [0,2,0,0,0,0|1,0,1]=4 8701 B12R1.268 COCc1cc(ccc1OC)F 7a_100135391359_200000210301 [0,2,0,0,0,0|1,0,1]=4 8702 B12R1.268 COCc1cc(ccc1OC)I 34a_200137411115_200000210301 [0,2,0,0,0,0|1,0,1]=4 8703 B12R1.268 COCc1cc(ccc1OC)I 7a_200137411115_200000210301 [0,2,0,0,0,0|1,0,1]=4 8704 B12R1.268 COCc1cc(ccc1OC)O 271570a_203496583355_200011493686 [0,2,0,0,0,0|1,0,1]=4 8705 B12R1.268 COCc1cc(ccc1O[13CH3])F 34a_100135391359_200025704644 [0,2,0,0,0,0|1,0,1]=4 8706 B12R1.268 COCc1cc(ccc1O[13CH3])F 7a_100135391359_200025704644 [0,2,0,0,0,0|1,0,1]=4 8707 B12R1.268 COc1ccc(cc1CC#N)O 271570a_203496583355_200011218486 [0,2,0,0,0,0|1,0,1]=4 8708 B12R1.268 COc1ccc(cc1CCN)O 271570a_203496583355_100000763266 [0,2,0,0,0,0|1,0,1]=4 8709 B12R1.268 COc1ccc(cc1CN[13CH3])Br 34a_100000690498_200025704644 [0,2,0,0,0,0|1,0,1]=4 8710 B12R1.268 COc1ccc(cc1CN[13CH3])Cl 2230a_100000740580_200025704644 [0,2,0,0,0,0|1,0,1]=4 8711 B12R1.268 COc1ccc(cc1CN[13CH3])Cl 34a_100000740580_200025704644 [0,2,0,0,0,0|1,0,1]=4 8712 B12R1.268 COc1ccc(cc1CN[13CH3])F 34a_100011199032_200025704644 [0,2,0,0,0,0|1,0,1]=4 8713 B12R1.268 COc1ccc(cc1CO[13CH3])Br 34a_100000204679_200025704644 [0,2,0,0,0,0|1,0,1]=4 8714 B12R1.268 COc1ccc(cc1CO[13CH3])Br 7a_100000204679_200025704644 [0,2,0,0,0,0|1,0,1]=4 8715 B12R1.268 COc1ccc(cc1CO[13CH3])C 34a_200000246444_200025704644 [0,2,0,0,0,0|1,0,1]=4 8716 B12R1.268 COc1ccc(cc1CO[13CH3])C 7a_200000246444_200025704644 [0,2,0,0,0,0|1,0,1]=4 8717 B12R1.268 COc1ccc(cc1CO[13CH3])F 34a_100011266440_200025704644 [0,2,0,0,0,0|1,0,1]=4 8718 B12R1.268 COc1ccc(cc1CO[13CH3])F 7a_100011266440_200025704644 [0,2,0,0,0,0|1,0,1]=4 8719 B12R1.268 COc1ccc(cc1CO[13CH3])I 34a_200137411115_200025704644 [0,2,0,0,0,0|1,0,1]=4 8720 B12R1.268 COc1ccc(cc1CO[13CH3])I 7a_200137411115_200025704644 [0,2,0,0,0,0|1,0,1]=4 8721 B12R1.268 COc1ccc(cc1CSC)Br 62a_100000204665_200000210301 [0,2,0,0,0,0|1,0,1]=4 8722 B12R1.268 COc1ccc(cc1CSC)Br 62a_200000210301_100000204665 [0,2,0,0,0,0|1,0,1]=4 8723 B12R1.268 COc1ccc(cc1CSC)C 62a_100000199068_200000210301 [0,2,0,0,0,0|1,0,1]=4 8724 B12R1.268 COc1ccc(cc1CSC)C 62a_200000210301_100000199068 [0,2,0,0,0,0|1,0,1]=4 8725 B12R1.268 COc1ccc(cc1CSC)Cl 62a_100000209806_200000210301 [0,2,0,0,0,0|1,0,1]=4 8726 B12R1.268 COc1ccc(cc1CSC)Cl 62a_200000210301_100000209806 [0,2,0,0,0,0|1,0,1]=4 8727 B12R1.268 COc1ccc(cc1CSC)F 62a_100011830354_200000210301 [0,2,0,0,0,0|1,0,1]=4 8728 B12R1.268 COc1ccc(cc1CSC)F 62a_200000210301_100011830354 [0,2,0,0,0,0|1,0,1]=4 8729 B12R1.268 COc1ccc(cc1CS[13CH3])Br 62a_100000204665_200025704644 [0,2,0,0,0,0|1,0,1]=4 8730 B12R1.268 COc1ccc(cc1CS[13CH3])Br 62a_200025704644_100000204665 [0,2,0,0,0,0|1,0,1]=4 8731 B12R1.268 COc1ccc(cc1CS[13CH3])C 62a_100000199068_200025704644 [0,2,0,0,0,0|1,0,1]=4 8732 B12R1.268 COc1ccc(cc1CS[13CH3])C 62a_200025704644_100000199068 [0,2,0,0,0,0|1,0,1]=4 8733 B12R1.268 COc1ccc(cc1CS[13CH3])Cl 62a_100000209806_200025704644 [0,2,0,0,0,0|1,0,1]=4 8734 B12R1.268 COc1ccc(cc1CS[13CH3])Cl 62a_200025704644_100000209806 [0,2,0,0,0,0|1,0,1]=4 8735 B12R1.268 COc1ccc(cc1CS[13CH3])F 62a_100011830354_200025704644 [0,2,0,0,0,0|1,0,1]=4 8736 B12R1.268 COc1ccc(cc1CS[13CH3])F 62a_200025704644_100011830354 [0,2,0,0,0,0|1,0,1]=4 8737 B12R1.283 C=C=Cc1ccccc1B(O)O 271570a_100015277604_100000693059 [0,2,0,0,0,0|0,0,2]=4 8738 B12R1.283 C=C=Cc1ccccc1C(C)O 271570a_100015277604_100000702211 [0,2,0,0,0,0|0,0,2]=4 8739 B12R1.283 C=CCc1ccccc1C(=C)C 271570a_100000694244_100009828059 [0,2,0,0,0,0|1,0,0]=3 8740 B12R1.283 CC=Cc1ccccc1B(O)O 271570a_100016259895_100000693059 [0,2,0,0,0,0|0,0,2]=4 8741 B12R1.283 CC=Cc1ccccc1C(C)O 271570a_100016259895_100000702211 [0,2,0,0,0,0|0,0,2]=4 8742 B12R1.283 CNCc1ccccc1B(O)O 2230a_106832991635_100009814197 [0,2,0,0,0,0|1,0,1]=4 8743 B12R1.283 CNCc1ccccc1B(O)O 34a_100102657272_100009814197 [0,2,0,0,0,0|1,0,1]=4 8744 B12R1.283 CNCc1ccccc1B(O)O 7a_106832991635_100009814197 [0,2,0,0,0,0|1,0,1]=4 8745 B12R1.283 CNCc1ccccc1C(=O)O 269956a_100015183376_200000210301 [0,2,0,0,0,0|1,0,1]=4 8746 B12R1.283 COCc1ccccc1B(O)O 34a_100138415774_100009814197 [0,2,0,0,0,0|1,0,1]=4 8747 B12R1.283 CSCc1ccccc1B(O)O 62a_100009814197_200000210301 [0,2,0,0,0,0|1,0,1]=4 8748 B12R1.283 CSCc1ccccc1B(O)O 62a_200000210301_100009814197 [0,2,0,0,0,0|1,0,1]=4 8749 B12R1.283 [13CH3]NCc1ccccc1C(=O)O 269956a_100015183376_200025704644 [0,2,0,0,0,0|1,0,1]=4 8750 B12R1.283 [13CH3]SCc1ccccc1B(O)O 62a_100009814197_200025704644 [0,2,0,0,0,0|1,0,1]=4 8751 B12R1.283 [13CH3]SCc1ccccc1B(O)O 62a_200025704644_100009814197 [0,2,0,0,0,0|1,0,1]=4 8752 B12R1.1112 C=C=Cc1c(cccc1C#N)O 271570a_100015277604_100009818990 [0,2,0,0,0,0|0,0,2]=4 8753 B12R1.1112 C=C=Cc1c(cccc1C=O)O 271570a_100015277604_100009816417 [0,2,0,0,0,0|0,0,2]=4 8754 B12R1.1112 C=C=Cc1c(cccc1CO)Br 271570a_100015277604_100010146604 [0,2,0,0,0,0|0,0,2]=4 8755 B12R1.1112 C=C=Cc1c(cccc1CO)C 271570a_100015277604_100011659289 [0,2,0,0,0,0|0,0,2]=4 8756 B12R1.1112 C=C=Cc1c(cccc1CO)F 271570a_100015277604_100000692438 [0,2,0,0,0,0|0,0,2]=4 8757 B12R1.1112 C=C=Cc1c(cccc1OC)Br 271570a_100015277604_100010131421 [0,2,0,0,0,0|0,0,2]=4 8758 B12R1.1112 C=C=Cc1c(cccc1OC)F 271570a_100015277604_100000041735 [0,2,0,0,0,0|0,0,2]=4 8759 B12R1.1112 C=C=Cc1c(cccc1OC)N 271570a_100015277604_100000703447 [0,2,0,0,0,0|0,0,2]=4 8760 B12R1.1112 C=C=Cc1c(cccc1OC)O 271570a_100015277604_100010202623 [0,2,0,0,0,0|0,0,2]=4 8761 B12R1.1112 C=CCc1c(ccnc1F)C=C 271570a_100011290941_200010238768 [0,2,0,0,0,0|2,0,0]=4 8762 B12R1.1112 C=CCc1c(ccnc1F)SC 62a_200000210301_200010238768 [0,2,0,0,0,0|1,1,0]=4 8763 B12R1.1112 C=CCc1c(ccnc1F)SC 62a_200010238768_200000210301 [0,2,0,0,0,0|1,1,0]=4 8764 B12R1.1112 C=CCc1c(ccnc1F)S[13CH3] 62a_200010238768_200025704644 [0,2,0,0,0,0|1,1,0]=4 8765 B12R1.1112 C=CCc1c(ccnc1F)S[13CH3] 62a_200025704644_200010238768 [0,2,0,0,0,0|1,1,0]=4 8766 B12R1.1112 CC=Cc1c(cccc1C#N)O 271570a_100016259895_100009818990 [0,2,0,0,0,0|0,0,2]=4 8767 B12R1.1112 CC=Cc1c(cccc1C=O)O 271570a_100016259895_100009816417 [0,2,0,0,0,0|0,0,2]=4 8768 B12R1.1112 CC=Cc1c(cccc1CO)Br 271570a_100016259895_100010146604 [0,2,0,0,0,0|0,0,2]=4 8769 B12R1.1112 CC=Cc1c(cccc1CO)C 271570a_100016259895_100011659289 [0,2,0,0,0,0|0,0,2]=4 8770 B12R1.1112 CC=Cc1c(cccc1CO)F 271570a_100016259895_100000692438 [0,2,0,0,0,0|0,0,2]=4 8771 B12R1.1112 CC=Cc1c(cccc1OC)Br 271570a_100016259895_100010131421 [0,2,0,0,0,0|0,0,2]=4 8772 B12R1.1112 CC=Cc1c(cccc1OC)F 271570a_100016259895_100000041735 [0,2,0,0,0,0|0,0,2]=4 8773 B12R1.1112 CC=Cc1c(cccc1OC)N 271570a_100016259895_100000703447 [0,2,0,0,0,0|0,0,2]=4 8774 B12R1.1112 CC=Cc1c(cccc1OC)O 271570a_100016259895_100010202623 [0,2,0,0,0,0|0,0,2]=4 8775 B12R1.1112 CNCc1c(cccc1OC)Br 207a_100102657272_100009814803 [0,2,0,0,0,0|1,0,1]=4 8776 B12R1.1112 CNCc1c(cccc1OC)Br 26a_100102657272_100000686866 [0,2,0,0,0,0|1,0,1]=4 8777 B12R1.1112 CNCc1c(cccc1OC)Br 270004a_106832991635_100009814803 [0,2,0,0,0,0|1,0,1]=4 8778 B12R1.1112 CNCc1c(cccc1OC)C 207a_100102657272_100000050978 [0,2,0,0,0,0|1,0,1]=4 8779 B12R1.1112 CNCc1c(cccc1OC)C 270004a_106832991635_100000050978 [0,2,0,0,0,0|1,0,1]=4 8780 B12R1.1112 CNCc1c(cccc1OC)Cl 207a_100102657272_100000757644 [0,2,0,0,0,0|1,0,1]=4 8781 B12R1.1112 CNCc1c(cccc1OC)Cl 2230a_106832991635_100012349678 [0,2,0,0,0,0|1,0,1]=4 8782 B12R1.1112 CNCc1c(cccc1OC)Cl 270004a_106832991635_100000757644 [0,2,0,0,0,0|1,0,1]=4 8783 B12R1.1112 CNCc1c(cccc1OC)Cl 34a_100102657272_100012349678 [0,2,0,0,0,0|1,0,1]=4 8784 B12R1.1112 CNCc1c(cccc1OC)Cl 7a_106832991635_100012349678 [0,2,0,0,0,0|1,0,1]=4 8785 B12R1.1112 CNCc1c(cccc1OC)F 207a_100102657272_100011216730 [0,2,0,0,0,0|1,0,1]=4 8786 B12R1.1112 CNCc1c(cccc1OC)F 2230a_106832991635_100011216731 [0,2,0,0,0,0|1,0,1]=4 8787 B12R1.1112 CNCc1c(cccc1OC)F 270004a_106832991635_100011216730 [0,2,0,0,0,0|1,0,1]=4 8788 B12R1.1112 CNCc1c(cccc1OC)F 34a_100016992011_200000210301 [0,2,0,0,0,0|1,0,1]=4 8789 B12R1.1112 CNCc1c(cccc1OC)F 34a_100102657272_100011216731 [0,2,0,0,0,0|1,0,1]=4 8790 B12R1.1112 CNCc1c(cccc1OC)F 7a_106832991635_100011216731 [0,2,0,0,0,0|1,0,1]=4 8791 B12R1.1112 COCc1c(cccc1OC)Cl 34a_100138415774_100012349678 [0,2,0,0,0,0|1,0,1]=4 8792 B12R1.1112 COCc1c(cccc1OC)F 34a_100011216733_200000210301 [0,2,0,0,0,0|1,0,1]=4 8793 B12R1.1112 COCc1c(cccc1OC)F 34a_100138415774_100011216731 [0,2,0,0,0,0|1,0,1]=4 8794 B12R1.1112 COCc1c(cccc1OC)F 7a_100011216733_200000210301 [0,2,0,0,0,0|1,0,1]=4 8795 B12R1.1112 COc1cccc(c1CN[13CH3])F 34a_100016992011_200025704644 [0,2,0,0,0,0|1,0,1]=4 8796 B12R1.1112 COc1cccc(c1CO[13CH3])F 34a_100011216733_200025704644 [0,2,0,0,0,0|1,0,1]=4 8797 B12R1.1112 COc1cccc(c1CO[13CH3])F 7a_100011216733_200025704644 [0,2,0,0,0,0|1,0,1]=4 8798 B12R1.1112 COc1cccc(c1CSC)Cl 62a_100012349678_200000210301 [0,2,0,0,0,0|1,0,1]=4 8799 B12R1.1112 COc1cccc(c1CSC)Cl 62a_200000210301_100012349678 [0,2,0,0,0,0|1,0,1]=4 8800 B12R1.1112 COc1cccc(c1CSC)F 62a_100011216731_200000210301 [0,2,0,0,0,0|1,0,1]=4 8801 B12R1.1112 COc1cccc(c1CSC)F 62a_200000210301_100011216731 [0,2,0,0,0,0|1,0,1]=4 8802 B12R1.1112 COc1cccc(c1CS[13CH3])Cl 62a_100012349678_200025704644 [0,2,0,0,0,0|1,0,1]=4 8803 B12R1.1112 COc1cccc(c1CS[13CH3])Cl 62a_200025704644_100012349678 [0,2,0,0,0,0|1,0,1]=4 8804 B12R1.1112 COc1cccc(c1CS[13CH3])F 62a_100011216731_200025704644 [0,2,0,0,0,0|1,0,1]=4 8805 B12R1.1112 COc1cccc(c1CS[13CH3])F 62a_200025704644_100011216731 [0,2,0,0,0,0|1,0,1]=4 8806 B12R1.114 C=C=Cc1ccc(cc1O)C#N 271570a_100015277604_100000724445 [0,2,0,0,0,0|0,0,2]=4 8807 B12R1.114 C=C=Cc1ccc(cc1O)C=O 271570a_100015277604_100000041418 [0,2,0,0,0,0|0,0,2]=4 8808 B12R1.114 C=C=Cc1ccc(cc1O)CO 271570a_100015277604_100000049605 [0,2,0,0,0,0|0,0,2]=4 8809 B12R1.114 C=C=Cc1ccc(cc1O)OC 271570a_100015277604_100000719091 [0,2,0,0,0,0|0,0,2]=4 8810 B12R1.114 CC=Cc1ccc(cc1O)C#N 271570a_100016259895_100000724445 [0,2,0,0,0,0|0,0,2]=4 8811 B12R1.114 CC=Cc1ccc(cc1O)C=O 271570a_100016259895_100000041418 [0,2,0,0,0,0|0,0,2]=4 8812 B12R1.114 CC=Cc1ccc(cc1O)CO 271570a_100016259895_100000049605 [0,2,0,0,0,0|0,0,2]=4 8813 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [0,2,0,0,0,0|0,0,2]=4 8814 B12R1.114 COc1ccc(c(c1)O)CC#N 271570a_203496583355_100010146818 [0,2,0,0,0,0|1,0,1]=4 8815 B12R1.233 CC(=Cc1ccc(cc1O)Br)C 271570a_100102525489_100012344904 [0,2,0,0,0,0|0,0,2]=4 8816 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [0,2,0,0,0,0|0,0,2]=4 8817 B12R1.233 CC(=Cc1ccc(cc1O)Cl)C 271570a_100102525489_100000050036 [0,2,0,0,0,0|0,0,2]=4 8818 B12R1.233 CC(=Cc1ccc(cc1O)F)C 271570a_100102525489_100000690578 [0,2,0,0,0,0|0,0,2]=4 8819 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,2,0,0,0,0|0,0,2]=4 8820 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100000070787_200012351560 [0,2,0,0,0,0|1,0,1]=4 8821 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200000210301 [0,2,0,0,0,0|1,0,1]=4 8822 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [0,2,0,0,0,0|1,0,1]=4 8823 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [0,2,0,0,0,0|1,0,1]=4 8824 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000070787_100000243222 [0,2,0,0,0,0|1,0,1]=4 8825 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200000210301 [0,2,0,0,0,0|1,0,1]=4 8826 B12R1.233 CC(=O)Cc1ccc(cc1Br)I 1458a_100000070787_100010146610 [0,2,0,0,0,0|1,0,1]=4 8827 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,2,0,0,0,0|1,0,1]=4 8828 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000070787_100000708836 [0,2,0,0,0,0|1,0,1]=4 8829 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_200000210301 [0,2,0,0,0,0|1,0,1]=4 8830 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100000070787_100011219618 [0,2,0,0,0,0|1,0,1]=4 8831 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100011236500_200000210301 [0,2,0,0,0,0|1,0,1]=4 8832 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [0,2,0,0,0,0|1,0,1]=4 8833 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100000070787_100000700533 [0,2,0,0,0,0|1,0,1]=4 8834 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100011667441_200000210301 [0,2,0,0,0,0|1,0,1]=4 8835 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000070787_100011740631 [0,2,0,0,0,0|1,0,1]=4 8836 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200000210301 [0,2,0,0,0,0|1,0,1]=4 8837 B12R1.233 CC(=O)Cc1ccc(cc1Cl)C 1458a_100000070787_100012349684 [0,2,0,0,0,0|1,0,1]=4 8838 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [0,2,0,0,0,0|1,0,1]=4 8839 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [0,2,0,0,0,0|1,0,1]=4 8840 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000070787_100011216360 [0,2,0,0,0,0|1,0,1]=4 8841 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200000210301 [0,2,0,0,0,0|1,0,1]=4 8842 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100000070787_100000211606 [0,2,0,0,0,0|1,0,1]=4 8843 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200000210301 [0,2,0,0,0,0|1,0,1]=4 8844 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000042674_200000210301 [0,2,0,0,0,0|1,0,1]=4 8845 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000070787_100012002367 [0,2,0,0,0,0|1,0,1]=4 8846 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [0,2,0,0,0,0|1,0,1]=4 8847 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [0,2,0,0,0,0|1,0,1]=4 8848 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000070787_100000748237 [0,2,0,0,0,0|1,0,1]=4 8849 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_200000210301 [0,2,0,0,0,0|1,0,1]=4 8850 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100000070787_100010244991 [0,2,0,0,0,0|1,0,1]=4 8851 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_200000210301 [0,2,0,0,0,0|1,0,1]=4 8852 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,2,0,0,0,0|1,0,1]=4 8853 B12R1.233 CC(=O)Cc1ccc(cc1I)Br 1458a_100000070787_100010146615 [0,2,0,0,0,0|1,0,1]=4 8854 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [0,2,0,0,0,0|1,0,1]=4 8855 B12R1.233 CC(=O)Cc1ccc(cc1I)F 1458a_100000070787_100012354799 [0,2,0,0,0,0|1,0,1]=4 8856 B12R1.233 CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200000210301 [0,2,0,0,0,0|0,0,1]=3 8857 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000070787 [0,2,0,0,0,0|1,0,1]=4 8858 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 271570a_203496583355_100009813020 [0,2,0,0,0,0|1,0,1]=4 8859 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100103153847 [0,2,0,0,0,0|1,0,1]=4 8860 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [0,2,0,0,0,0|1,0,1]=4 8861 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [0,2,0,0,0,0|1,0,1]=4 8862 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [0,2,0,0,0,0|1,0,1]=4 8863 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [0,2,0,0,0,0|1,0,1]=4 8864 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [0,2,0,0,0,0|1,0,1]=4 8865 B12R1.233 CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000070787 [0,2,0,0,0,0|1,0,1]=4 8866 B12R1.233 CC(=O)Nc1ccc(cc1O)F 271570a_203496583355_100011215554 [0,2,0,0,0,0|1,0,1]=4 8867 B12R1.233 CC(=O)Nc1ccc(cc1O)F 527a_100000753323_100103153847 [0,2,0,0,0,0|1,0,1]=4 8868 B12R1.233 CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000070787 [0,2,0,0,0,0|1,0,1]=4 8869 B12R1.233 CC(=O)Nc1ccc(cc1O)I 527a_100000057187_100103153847 [0,2,0,0,0,0|1,0,1]=4 8870 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,2,0,0,0,0|1,0,1]=4 8871 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,2,0,0,0,0|1,0,1]=4 8872 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])Br 1458a_100000697930_200025704644 [0,2,0,0,0,0|1,0,1]=4 8873 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])F 1458a_100011667441_200025704644 [0,2,0,0,0,0|1,0,1]=4 8874 B12R1.233 Cc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011236500_200025704644 [0,2,0,0,0,0|1,0,1]=4 8875 B12R1.233 Cc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000042674_200025704644 [0,2,0,0,0,0|1,0,1]=4 8876 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200025704644 [0,2,0,0,0,0|1,0,1]=4 8877 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [0,2,0,0,0,0|1,0,1]=4 8878 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200025704644 [0,2,0,0,0,0|1,0,1]=4 8879 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,2,0,0,0,0|1,0,1]=4 8880 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200025704644 [0,2,0,0,0,0|1,0,1]=4 8881 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [0,2,0,0,0,0|1,0,1]=4 8882 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200025704644 [0,2,0,0,0,0|1,0,1]=4 8883 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200025704644 [0,2,0,0,0,0|1,0,1]=4 8884 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [0,2,0,0,0,0|1,0,1]=4 8885 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)F 1458a_100000684719_200025704644 [0,2,0,0,0,0|1,0,1]=4 8886 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)I 1458a_100010149628_200025704644 [0,2,0,0,0,0|1,0,1]=4 8887 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,2,0,0,0,0|1,0,1]=4 8888 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200025704644 [0,2,0,0,0,0|0,0,1]=3 8889 B12R1.1095 C=C=Cc1c(cc(cc1F)F)O 271570a_100015277604_100009815984 [0,2,0,0,0,0|0,0,2]=4 8890 B12R1.1095 C=C=Cc1c(cc(cc1O)C)C 271570a_100015277604_100010342985 [0,2,0,0,0,0|0,0,2]=4 8891 B12R1.1095 C=C=Cc1c(cc(cc1O)Cl)C 271570a_100015277604_100010254216 [0,2,0,0,0,0|0,0,2]=4 8892 B12R1.1095 C=C=Cc1c(cc(cc1O)O)O 271570a_100015277604_200010341185 [0,2,0,0,0,0|0,0,2]=4 8893 B12R1.1095 CC=Cc1c(cc(cc1F)F)O 271570a_100016259895_100009815984 [0,2,0,0,0,0|0,0,2]=4 8894 B12R1.1095 CC=Cc1c(cc(cc1O)C)C 271570a_100016259895_100010342985 [0,2,0,0,0,0|0,0,2]=4 8895 B12R1.1095 CC=Cc1c(cc(cc1O)Cl)C 271570a_100016259895_100010254216 [0,2,0,0,0,0|0,0,2]=4 8896 B12R1.1095 CC=Cc1c(cc(cc1O)O)O 271570a_100016259895_200010341185 [0,2,0,0,0,0|0,0,2]=4 8897 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)O 270004a_106832991635_100011827663 [0,2,0,0,0,0|1,0,1]=4 8898 B12R1.1123 C=C=Cc1cc(c(cc1O)C)C 271570a_100015277604_100009814663 [0,2,0,0,0,0|0,0,2]=4 8899 B12R1.1123 C=C=Cc1cc(c(cc1O)F)F 271570a_100015277604_100009813768 [0,2,0,0,0,0|0,0,2]=4 8900 B12R1.1123 CC=Cc1cc(c(cc1O)C)C 271570a_100016259895_100009814663 [0,2,0,0,0,0|0,0,2]=4 8901 B12R1.1123 CC=Cc1cc(c(cc1O)F)F 271570a_100016259895_100009813768 [0,2,0,0,0,0|0,0,2]=4 8902 B12R1.1123 N#CCc1cc(c(cc1O)F)F 271570a_203496583355_100011156620 [0,2,0,0,0,0|1,0,1]=4 8903 B12R1.1703 CNC(C)c1ccc(cc1O)Br 269862a_106832991636_100000188348 [0,2,0,0,0,0|1,0,1]=4 8904 B12R1.1703 CNC(C)c1ccc(cc1O)C 269862a_106832991636_100000234885 [0,2,0,0,0,0|1,0,1]=4 8905 B12R1.1703 CNC(C)c1ccc(cc1O)Cl 269862a_106832991636_100000061402 [0,2,0,0,0,0|1,0,1]=4 8906 B12R1.1703 CNC(C)c1ccc(cc1O)F 269862a_106832991636_100011215782 [0,2,0,0,0,0|1,0,1]=4 8907 B12R1.124 CC(=C(C)c1ccccc1O)C 271570a_200000049429_100000739446 [0,2,0,0,0,0|0,0,2]=4 8908 B12R1.124 CC(=O)C(C)c1ccccc1Br 1458a_100012359601_200000210301 [0,2,0,0,0,0|1,0,1]=4 8909 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100000070787_100000181259 [0,2,0,0,0,0|1,0,1]=4 8910 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_200000210301 [0,2,0,0,0,0|1,0,1]=4 8911 B12R1.124 CC(=O)C(C)c1ccccc1F 1458a_100000070787_200000741388 [0,2,0,0,0,0|1,0,1]=4 8912 B12R1.124 CC(=O)C(O)c1ccccc1Br 1458a_200011356456_200000210301 [0,2,0,0,0,0|1,0,1]=4 8913 B12R1.124 CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_200000210301 [0,2,0,0,0,0|1,0,1]=4 8914 B12R1.124 CC(=O)C(O)c1ccccc1F 1458a_100011219519_200000210301 [0,2,0,0,0,0|1,0,1]=4 8915 B12R1.124 CC(=O)N(C)c1ccccc1O 22a_100000033821_100000070787 [0,2,0,0,0,0|1,0,1]=4 8916 B12R1.124 CC(=O)N(C)c1ccccc1O 527a_100000033821_100103153847 [0,2,0,0,0,0|1,0,1]=4 8917 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Br 1458a_100012359601_200025704644 [0,2,0,0,0,0|1,0,1]=4 8918 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Cl 1458a_100011667492_200025704644 [0,2,0,0,0,0|1,0,1]=4 8919 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Br 1458a_200011356456_200025704644 [0,2,0,0,0,0|1,0,1]=4 8920 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Cl 1458a_100011217820_200025704644 [0,2,0,0,0,0|1,0,1]=4 8921 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1F 1458a_100011219519_200025704644 [0,2,0,0,0,0|1,0,1]=4 8922 B12R1.127 CC(=Cc1cc(ccc1O)Br)C 271570a_100102525489_100012355227 [0,2,0,0,0,0|0,0,2]=4 8923 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [0,2,0,0,0,0|0,0,2]=4 8924 B12R1.127 CC(=Cc1cc(ccc1O)Cl)C 271570a_100102525489_100011356953 [0,2,0,0,0,0|0,0,2]=4 8925 B12R1.127 CC(=Cc1cc(ccc1O)F)C 271570a_100102525489_100000211999 [0,2,0,0,0,0|0,0,2]=4 8926 B12R1.127 CC(=Cc1cc(ccc1O)N)C 271570a_100102525489_100011534360 [0,2,0,0,0,0|0,0,2]=4 8927 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [0,2,0,0,0,0|0,0,2]=4 8928 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100000070787_100011982794 [0,2,0,0,0,0|1,0,1]=4 8929 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200000210301 [0,2,0,0,0,0|1,0,1]=4 8930 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [0,2,0,0,0,0|1,0,1]=4 8931 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000070787_100000733903 [0,2,0,0,0,0|1,0,1]=4 8932 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200000210301 [0,2,0,0,0,0|1,0,1]=4 8933 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000070787_100000736370 [0,2,0,0,0,0|1,0,1]=4 8934 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200000210301 [0,2,0,0,0,0|1,0,1]=4 8935 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [0,2,0,0,0,0|1,0,1]=4 8936 B12R1.127 CC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_200000210301 [0,2,0,0,0,0|1,0,1]=4 8937 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [0,2,0,0,0,0|1,0,1]=4 8938 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [0,2,0,0,0,0|1,0,1]=4 8939 B12R1.127 CC(=O)Cc1cc(ccc1C)Cl 1458a_100000070787_100012186985 [0,2,0,0,0,0|1,0,1]=4 8940 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100000070787_100000709795 [0,2,0,0,0,0|1,0,1]=4 8941 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100011219217_200000210301 [0,2,0,0,0,0|1,0,1]=4 8942 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000070787_100000763347 [0,2,0,0,0,0|1,0,1]=4 8943 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200000210301 [0,2,0,0,0,0|1,0,1]=4 8944 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [0,2,0,0,0,0|1,0,1]=4 8945 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000070787_100000754809 [0,2,0,0,0,0|1,0,1]=4 8946 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200000210301 [0,2,0,0,0,0|1,0,1]=4 8947 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100000070787_100000709952 [0,2,0,0,0,0|1,0,1]=4 8948 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200000210301 [0,2,0,0,0,0|1,0,1]=4 8949 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [0,2,0,0,0,0|1,0,1]=4 8950 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000070787_100000736399 [0,2,0,0,0,0|1,0,1]=4 8951 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200000210301 [0,2,0,0,0,0|1,0,1]=4 8952 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [0,2,0,0,0,0|1,0,1]=4 8953 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [0,2,0,0,0,0|1,0,1]=4 8954 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100000070787_100000716957 [0,2,0,0,0,0|1,0,1]=4 8955 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200000210301 [0,2,0,0,0,0|1,0,1]=4 8956 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000070787_100000741279 [0,2,0,0,0,0|1,0,1]=4 8957 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000762760_200000210301 [0,2,0,0,0,0|1,0,1]=4 8958 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [0,2,0,0,0,0|1,0,1]=4 8959 B12R1.127 CC(=O)Cc1cc(ccc1I)Br 1458a_100000070787_100012362523 [0,2,0,0,0,0|1,0,1]=4 8960 B12R1.127 CC(=O)Cc1cc(ccc1I)Cl 1458a_100000070787_100012348826 [0,2,0,0,0,0|1,0,1]=4 8961 B12R1.127 CC(=O)Cc1cc(ccc1I)F 1458a_100000070787_100010149606 [0,2,0,0,0,0|1,0,1]=4 8962 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [0,2,0,0,0,0|0,0,1]=3 8963 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [0,2,0,0,0,0|0,0,1]=3 8964 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [0,2,0,0,0,0|0,0,1]=3 8965 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [0,2,0,0,0,0|0,0,1]=3 8966 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [0,2,0,0,0,0|1,0,1]=4 8967 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,2,0,0,0,0|1,0,1]=4 8968 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,2,0,0,0,0|1,0,1]=4 8969 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,2,0,0,0,0|1,0,1]=4 8970 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,2,0,0,0,0|1,0,1]=4 8971 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,2,0,0,0,0|1,0,1]=4 8972 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,2,0,0,0,0|1,0,1]=4 8973 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,2,0,0,0,0|1,0,1]=4 8974 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,2,0,0,0,0|1,0,1]=4 8975 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,2,0,0,0,0|1,0,1]=4 8976 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,2,0,0,0,0|1,0,1]=4 8977 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,2,0,0,0,0|1,0,1]=4 8978 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,2,0,0,0,0|1,0,1]=4 8979 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [0,2,0,0,0,0|1,0,1]=4 8980 B12R1.127 CN(C)Cc1cc(ccc1O)Br 2230a_100011602694_200000210301 [0,2,0,0,0,0|1,0,1]=4 8981 B12R1.127 CN(C)Cc1cc(ccc1O)Br 269982a_100011602694_200000210301 [0,2,0,0,0,0|1,0,1]=4 8982 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 2230a_100000712467_200000210301 [0,2,0,0,0,0|1,0,1]=4 8983 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 269982a_100000712467_200000210301 [0,2,0,0,0,0|1,0,1]=4 8984 B12R1.127 CN(C)Cc1cc(ccc1O)F 2230a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 8985 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_100102631434_100010161318 [0,2,0,0,0,0|1,0,1]=4 8986 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 8987 B12R1.127 CN(C)Cc1cc(ccc1O)F 34a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 8988 B12R1.127 CN(C)Cc1cc(ccc1O)O 271570a_203496583355_100011934597 [0,2,0,0,0,0|1,0,1]=4 8989 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 2230a_100011602694_200025704644 [0,2,0,0,0,0|1,0,1]=4 8990 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 269982a_100011602694_200025704644 [0,2,0,0,0,0|1,0,1]=4 8991 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 2230a_100000712467_200025704644 [0,2,0,0,0,0|1,0,1]=4 8992 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 269982a_100000712467_200025704644 [0,2,0,0,0,0|1,0,1]=4 8993 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 2230a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 8994 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 269982a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 8995 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 34a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 8996 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [0,2,0,0,0,0|1,0,1]=4 8997 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [0,2,0,0,0,0|1,0,1]=4 8998 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [0,2,0,0,0,0|1,0,1]=4 8999 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])Br 1458a_100010244045_200025704644 [0,2,0,0,0,0|1,0,1]=4 9000 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])F 1458a_100011219217_200025704644 [0,2,0,0,0,0|1,0,1]=4 9001 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200025704644 [0,2,0,0,0,0|1,0,1]=4 9002 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200025704644 [0,2,0,0,0,0|1,0,1]=4 9003 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200025704644 [0,2,0,0,0,0|1,0,1]=4 9004 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200025704644 [0,2,0,0,0,0|1,0,1]=4 9005 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200025704644 [0,2,0,0,0,0|1,0,1]=4 9006 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200025704644 [0,2,0,0,0,0|1,0,1]=4 9007 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200025704644 [0,2,0,0,0,0|1,0,1]=4 9008 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200025704644 [0,2,0,0,0,0|1,0,1]=4 9009 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)F 1458a_100000762760_200025704644 [0,2,0,0,0,0|1,0,1]=4 9010 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [0,2,0,0,0,0|0,0,1]=3 9011 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [0,2,0,0,0,0|0,0,1]=3 9012 B12R1.151 CC(C)(N)Cc1ccccc1O 271570a_203496583355_100161000475 [0,2,0,0,0,0|0,0,2]=4 9013 B12R1.151 CS(=O)(=O)Cc1ccccc1O 271570a_203496583355_100009814642 [0,2,0,0,0,0|1,0,1]=4 9014 B12R1.151 Oc1ccccc1CC(F)(F)F 271570a_203496583355_100010220485 [0,2,0,0,0,0|1,0,1]=4 9015 B12R1.1009 CC(=Cc1c(cccc1Br)O)C 271570a_100102525489_100010187912 [0,2,0,0,0,0|0,0,2]=4 9016 B12R1.1009 CC(=Cc1c(cccc1Cl)O)C 271570a_100102525489_100000050174 [0,2,0,0,0,0|0,0,2]=4 9017 B12R1.1009 CC(=Cc1c(cccc1F)O)C 271570a_100102525489_100009820682 [0,2,0,0,0,0|0,0,2]=4 9018 B12R1.1009 CC(=Cc1c(cccc1O)C)C 271570a_100102525489_100000686692 [0,2,0,0,0,0|0,0,2]=4 9019 B12R1.1009 CC(=Cc1c(cccc1O)N)C 271570a_100102525489_100012183704 [0,2,0,0,0,0|0,0,2]=4 9020 B12R1.1009 CC(=Cc1c(cccc1O)O)C 271570a_100102525489_100010205330 [0,2,0,0,0,0|0,0,2]=4 9021 B12R1.1009 CC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_200000210301 [0,2,0,0,0,0|1,0,1]=4 9022 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100000070787_100010146847 [0,2,0,0,0,0|1,0,1]=4 9023 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100010147022_200000210301 [0,2,0,0,0,0|1,0,1]=4 9024 B12R1.1009 CC(=O)Cc1c(cccc1Br)Cl 1458a_100000070787_100010138402 [0,2,0,0,0,0|1,0,1]=4 9025 B12R1.1009 CC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_200000210301 [0,2,0,0,0,0|1,0,1]=4 9026 B12R1.1009 CC(=O)Cc1c(cccc1Br)F 1458a_100000070787_100000696636 [0,2,0,0,0,0|1,0,1]=4 9027 B12R1.1009 CC(=O)Cc1c(cccc1Br)F 1458a_100010172741_200000210301 [0,2,0,0,0,0|1,0,1]=4 9028 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000070787_100000758300 [0,2,0,0,0,0|1,0,1]=4 9029 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000689862_200000210301 [0,2,0,0,0,0|1,0,1]=4 9030 B12R1.1009 CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000070787_100000187851 [0,2,0,0,0,0|1,0,1]=4 9031 B12R1.1009 CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_200000210301 [0,2,0,0,0,0|1,0,1]=4 9032 B12R1.1009 CC(=O)Cc1c(cccc1Cl)F 1458a_100000070787_100000187852 [0,2,0,0,0,0|1,0,1]=4 9033 B12R1.1009 CC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_200000210301 [0,2,0,0,0,0|1,0,1]=4 9034 B12R1.1009 CC(=O)Cc1c(cccc1F)C 1458a_100000070787_100009814554 [0,2,0,0,0,0|1,0,1]=4 9035 B12R1.1009 CC(=O)Cc1c(cccc1F)F 1458a_100000070787_100000698325 [0,2,0,0,0,0|1,0,1]=4 9036 B12R1.1009 CC(=O)Cc1c(cccc1F)F 1458a_100000684726_200000210301 [0,2,0,0,0,0|1,0,1]=4 9037 B12R1.1009 CC(=O)Cc1c(cccc1I)Br 1458a_100000070787_100010146611 [0,2,0,0,0,0|1,0,1]=4 9038 B12R1.1009 CC(=O)Cc1c(cccc1I)C 1458a_100000070787_100010150146 [0,2,0,0,0,0|1,0,1]=4 9039 B12R1.1009 CC(=O)Cc1c(cccc1I)F 1458a_100000070787_100010149602 [0,2,0,0,0,0|1,0,1]=4 9040 B12R1.1009 CC(=O)Nc1c(cccc1Br)O 527a_100011934926_100103153847 [0,2,0,0,0,0|1,0,1]=4 9041 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000070787 [0,2,0,0,0,0|1,0,1]=4 9042 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100103153847 [0,2,0,0,0,0|1,0,1]=4 9043 B12R1.1009 CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000070787 [0,2,0,0,0,0|1,0,1]=4 9044 B12R1.1009 CC(=O)Nc1c(cccc1F)O 527a_100020591140_100103153847 [0,2,0,0,0,0|1,0,1]=4 9045 B12R1.1009 CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000070787 [0,2,0,0,0,0|1,0,1]=4 9046 B12R1.1009 CC(=O)Nc1c(cccc1I)O 527a_200000049512_100103153847 [0,2,0,0,0,0|1,0,1]=4 9047 B12R1.1009 CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000070787 [0,2,0,0,0,0|1,0,1]=4 9048 B12R1.1009 CC(=O)Nc1c(cccc1O)C 527a_100000743429_100103153847 [0,2,0,0,0,0|1,0,1]=4 9049 B12R1.1009 CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000070787 [0,2,0,0,0,0|1,0,1]=4 9050 B12R1.1009 CC(=O)Nc1c(cccc1O)O 527a_100011995820_100103153847 [0,2,0,0,0,0|1,0,1]=4 9051 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])Br 1458a_100010147022_200025704644 [0,2,0,0,0,0|1,0,1]=4 9052 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])C 1458a_100000689862_200025704644 [0,2,0,0,0,0|1,0,1]=4 9053 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)Br 1458a_100010209379_200025704644 [0,2,0,0,0,0|1,0,1]=4 9054 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_200025704644 [0,2,0,0,0,0|1,0,1]=4 9055 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)F 1458a_100010172741_200025704644 [0,2,0,0,0,0|1,0,1]=4 9056 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_200025704644 [0,2,0,0,0,0|1,0,1]=4 9057 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Cl)F 1458a_100000185183_200025704644 [0,2,0,0,0,0|1,0,1]=4 9058 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1F)F 1458a_100000684726_200025704644 [0,2,0,0,0,0|1,0,1]=4 9059 B12R1.270 C=C=Cc1cc(ccc1O)C#N 271570a_100015277604_100000725478 [0,2,0,0,0,0|0,0,2]=4 9060 B12R1.270 C=C=Cc1cc(ccc1O)C=O 271570a_100015277604_100000184552 [0,2,0,0,0,0|0,0,2]=4 9061 B12R1.270 C=C=Cc1cc(ccc1O)CC 271570a_100015277604_100012339963 [0,2,0,0,0,0|0,0,2]=4 9062 B12R1.270 C=C=Cc1cc(ccc1O)CO 271570a_100015277604_100011191544 [0,2,0,0,0,0|0,0,2]=4 9063 B12R1.270 C=C=Cc1cc(ccc1O)OC 271570a_100015277604_100000685887 [0,2,0,0,0,0|0,0,2]=4 9064 B12R1.270 C=Cc1ccc(c(c1)CNC)O 271570a_100011290941_100011602694 [0,2,0,0,0,0|1,0,1]=4 9065 B12R1.270 CC=Cc1cc(ccc1O)C#N 271570a_100016259895_100000725478 [0,2,0,0,0,0|0,0,2]=4 9066 B12R1.270 CC=Cc1cc(ccc1O)C=O 271570a_100016259895_100000184552 [0,2,0,0,0,0|0,0,2]=4 9067 B12R1.270 CC=Cc1cc(ccc1O)CC 271570a_100016259895_100012339963 [0,2,0,0,0,0|0,0,2]=4 9068 B12R1.270 CC=Cc1cc(ccc1O)CO 271570a_100016259895_100011191544 [0,2,0,0,0,0|0,0,2]=4 9069 B12R1.270 CC=Cc1cc(ccc1O)OC 271570a_100016259895_100000685887 [0,2,0,0,0,0|0,0,2]=4 9070 B12R1.270 CNCc1cc(ccc1O)SC 62a_100011602694_200000210301 [0,2,0,0,0,0|1,0,1]=4 9071 B12R1.270 CNCc1cc(ccc1O)SC 62a_200000210301_100011602694 [0,2,0,0,0,0|1,0,1]=4 9072 B12R1.270 CNCc1cc(ccc1O)S[13CH3] 62a_100011602694_200025704644 [0,2,0,0,0,0|1,0,1]=4 9073 B12R1.270 CNCc1cc(ccc1O)S[13CH3] 62a_200025704644_100011602694 [0,2,0,0,0,0|1,0,1]=4 9074 B12R1.270 COc1ccc(c(c1)CC#N)O 271570a_203496583355_100012259381 [0,2,0,0,0,0|1,0,1]=4 9075 B12R1.270 COc1ccc(c(c1)CCO)O 271570a_203496583355_100012259501 [0,2,0,0,0,0|1,0,1]=4 9076 B12R1.354 CNC(C)c1cc(ccc1O)Br 269862a_106832991636_100000212127 [0,2,0,0,0,0|1,0,1]=4 9077 B12R1.354 CNC(C)c1cc(ccc1O)C 269862a_106832991636_100000195442 [0,2,0,0,0,0|1,0,1]=4 9078 B12R1.354 CNC(C)c1cc(ccc1O)Cl 269862a_106832991636_100000185566 [0,2,0,0,0,0|1,0,1]=4 9079 B12R1.354 CNC(C)c1cc(ccc1O)F 269862a_106832991636_100000182812 [0,2,0,0,0,0|1,0,1]=4 9080 B12R1.354 CNC(C)c1cc(ccc1O)I 269862a_106832991636_100010712555 [0,2,0,0,0,0|1,0,1]=4 9081 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 2230a_100160469477_200000210301 [0,2,0,0,0,0|1,0,1]=4 9082 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 34a_100160469477_200000210301 [0,2,0,0,0,0|1,0,1]=4 9083 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 2230a_100011853016_200000210301 [0,2,0,0,0,0|1,0,1]=4 9084 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 34a_100011853016_200000210301 [0,2,0,0,0,0|1,0,1]=4 9085 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 2230a_100011853016_200025704644 [0,2,0,0,0,0|1,0,1]=4 9086 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 34a_100011853016_200025704644 [0,2,0,0,0,0|1,0,1]=4 9087 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 2230a_100160469477_200025704644 [0,2,0,0,0,0|1,0,1]=4 9088 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 34a_100160469477_200025704644 [0,2,0,0,0,0|1,0,1]=4 9089 B12R1.195 CC(C)(C#N)c1ccccc1O 271570a_203496583355_100000716882 [0,2,0,0,0,0|1,0,1]=4 9090 B12R1.243 COC(OC)c1ccccc1O 271570a_203496583355_100010185899 [0,2,0,0,0,0|1,0,1]=4 9091 B10R1.172 C=Cc1cccc(c1)C=O 271570a_100011290941_100000014684 [0,0,1,1,0,0|0,0,2]=4 9092 B10R1.172 C=Cc1cccc(c1)CO 271570a_100011290941_100000687537 [0,0,1,1,0,0|0,0,2]=4 9093 B10R1.172 C=Cc1ccnc(c1)C=O 271570a_100011290941_100011998288 [0,0,1,1,0,0|1,0,1]=4 9094 B10R1.172 C=Cc1ccnc(c1)CO 271570a_100011290941_100009819072 [0,0,1,1,0,0|1,0,1]=4 9095 B10R1.21 C=CCCSc1ccco1 62a_100000754431_100009814098 [0,0,1,1,0,0|1,0,1]=4 9096 B10R1.21 C=CCCSc1ccco1 62a_100009814098_100000754431 [0,0,1,1,0,0|1,0,1]=4 9097 B10R1.21 C=CCNCc1ccco1 2230a_100000185738_100000210623 [0,0,1,1,0,0|1,0,1]=4 9098 B10R1.21 C=CCNCc1ccco1 270004a_100020586998_100000186105 [0,0,1,1,0,0|1,0,1]=4 9099 B10R1.21 C=CCNCc1ccco1 34a_100000185738_100015514636 [0,0,1,1,0,0|1,0,1]=4 9100 B10R1.21 C=CCOCc1ccco1 34a_100000210059_100015514636 [0,0,1,1,0,0|1,0,1]=4 9101 B10R1.21 CCCC=Cc1ccco1 271570a_100016258520_100009814098 [0,0,1,1,0,0|0,0,2]=4 9102 B10R1.21 CNCC=Cc1ccco1 270004a_106832991635_100000185671 [0,0,1,1,0,0|1,0,1]=4 9103 B10R1.21 COCC=Cc1ccco1 271570a_100016286323_100009814098 [0,0,1,1,0,0|1,0,1]=4 9104 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|0,0,2]=4 9105 B10R2.32 Oc1csc2c1scc2 271570a_203496583355_100009817191 [0,0,0,1,1,0|2,0,0]=4 9106 B12R2.81 Cc1cccc(c1O)C2CC2 271570a_100011220607_100009817157 [0,1,0,1,0,0|0,0,2]=4 9107 B12R2.81 Nc1cccc(c1O)C2CC2 271570a_100011220607_100011934915 [0,1,0,1,0,0|0,0,2]=4 9108 B12R2.81 Oc1c(cccc1C2CC2)Br 271570a_100011220607_100010084509 [0,1,0,1,0,0|0,0,2]=4 9109 B12R2.81 Oc1c(cccc1C2CC2)Cl 271570a_100011220607_100010202889 [0,1,0,1,0,0|0,0,2]=4 9110 B12R2.81 Oc1c(cccc1C2CC2)F 271570a_100011220607_100009813666 [0,1,0,1,0,0|0,0,2]=4 9111 B12R2.81 Oc1cccc(c1O)C2CC2 271570a_100011220607_100009815950 [0,1,0,1,0,0|0,0,2]=4 9112 B12R2.81 Oc1cccc(c1O)C2CC2 271570a_203496583355_100010664954 [0,1,0,1,0,0|0,0,2]=4 9113 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [0,1,0,1,0,0|2,0,0]=4 9114 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [0,1,0,1,0,0|1,0,1]=4 9115 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,1,0,1,0,0|1,0,0]=3 9116 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [0,1,0,1,0,0|2,0,0]=4 9117 B12R2.82 Nc1ccc2[nH]cnc2c1O 271570a_203496583355_100009816657 [0,1,0,1,0,0|2,0,0]=4 9118 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [0,1,0,1,0,0|2,0,0]=4 9119 B12R2.82 Nc1ccc2scnc2c1O 271570a_203496583355_100009816736 [0,1,0,1,0,0|2,0,0]=4 9120 B12R2.82 Oc1c(ccc2c1[nH]nc2)F 271570a_203496583355_100010762478 [0,1,0,1,0,0|2,0,0]=4 9121 B12R2.82 Oc1c(ccc2c1cc[nH]2)F 271570a_203496583355_100102525403 [0,1,0,1,0,0|1,0,1]=4 9122 B12R2.82 Oc1c(ccc2c1nc[nH]2)F 271570a_203496583355_200010369618 [0,1,0,1,0,0|2,0,0]=4 9123 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [0,1,0,1,0,0|2,0,0]=4 9124 B12R2.82 Oc1c(cnc2c1[nH]cc2)F 271570a_203496583355_100009883597 [0,1,0,1,0,0|2,0,0]=4 9125 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [0,1,0,1,0,0|0,0,2]=4 9126 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,1,0,0|0,0,0]=2 9127 B12R2.202 CN1Cc2cccc(c2C1)O 269982a_100015191671_200000210301 [0,1,0,1,0,0|1,0,1]=4 9128 B12R2.202 CN1Cc2cccc(c2C1)O 34a_100015191671_200000210301 [0,1,0,1,0,0|1,0,1]=4 9129 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,1,0,0|0,0,2]=4 9130 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,1,0,0|1,0,1]=4 9131 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,1,0,0|1,0,1]=4 9132 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,1,0,0|1,0,1]=4 9133 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,1,0,0|1,0,1]=4 9134 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,1,0,0|1,0,1]=4 9135 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,1,0,1,0,0|2,0,0]=4 9136 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,1,0,0|1,0,0]=3 9137 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,1,0,1,0,0|2,0,0]=4 9138 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [0,1,0,1,0,0|2,0,0]=4 9139 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,1,0,1,0,0|2,0,0]=4 9140 B12R2.202 Nc1nc2cccc(c2s1)O 271570a_203496583355_100010235960 [0,1,0,1,0,0|2,0,0]=4 9141 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,1,0,0|1,0,0]=3 9142 B12R2.202 O=C1Cc2c(ccnc2N1)O 271570a_203496583355_100000104061 [0,1,0,1,0,0|2,0,0]=4 9143 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,1,0,0|0,0,1]=3 9144 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,1,0,0|1,0,1]=4 9145 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,1,0,1,0,0|2,0,0]=4 9146 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,1,0,0|2,0,0]=4 9147 B12R2.202 Oc1cccc2c1CC(C2)O 271570a_203496583355_100010752598 [0,1,0,1,0,0|0,0,2]=4 9148 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,1,0,1,0,0|2,0,0]=4 9149 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 269982a_100015191671_200025704644 [0,1,0,1,0,0|1,0,1]=4 9150 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 34a_100015191671_200025704644 [0,1,0,1,0,0|1,0,1]=4 9151 B12R2.1081 Oc1cccc2c1CCCC2 271570a_203496583355_100012354034 [0,1,0,1,0,0|0,0,2]=4 9152 B12R2.1081 Oc1cccc2c1CCCN2 271570a_203496583355_100010196365 [0,1,0,1,0,0|0,0,2]=4 9153 B12R2.1081 Oc1cccc2c1CCCO2 271570a_203496583355_100010188023 [0,1,0,1,0,0|0,0,2]=4 9154 B12R2.1081 Oc1cccc2c1CCN=C2 271570a_203496583355_100010982778 [0,1,0,1,0,0|0,0,1]=3 9155 B12R2.1081 Oc1cccc2c1CCNC2 271570a_203496583355_100000756787 [0,1,0,1,0,0|0,0,2]=4 9156 B12R2.1081 Oc1cccc2c1CNCC2 271570a_203496583355_100000687140 [0,1,0,1,0,0|0,0,2]=4 9157 B12R2.1081 Oc1cccc2c1NCCO2 271570a_203496583355_100015018771 [0,1,0,1,0,0|1,0,1]=4 9158 B12R2.1081 Oc1cccc2c1OCCC2 271570a_203496583355_100010204675 [0,1,0,1,0,0|0,0,2]=4 9159 B12R2.1081 Oc1cccc2c1OCCN2 271570a_203496583355_100000726803 [0,1,0,1,0,0|1,0,1]=4 9160 B12R2.1081 Oc1cccc2c1OCCO2 271570a_203496583355_100009815980 [0,1,0,1,0,0|1,0,1]=4 9161 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [0,1,0,1,0,0|0,0,1]=3 9162 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [0,1,0,1,0,0|0,0,1]=3 9163 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [0,1,0,1,0,0|0,0,1]=3 9164 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [0,1,0,1,0,0|0,0,1]=3 9165 B12R2.1081 Oc1cccc2c1cncn2 271570a_203496583355_100009814520 [0,1,0,1,0,0|1,0,1]=4 9166 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [0,1,0,1,0,0|0,0,1]=3 9167 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [0,1,0,1,0,0|1,0,0]=3 9168 B12R2.1081 Oc1cccc2c1ncnc2 271570a_203496583355_100010246313 [0,1,0,1,0,0|1,0,0]=3 9169 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [0,1,0,1,0,0|1,0,0]=3 9170 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [0,1,0,1,0,0|1,0,1]=4 9171 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [0,1,0,1,0,0|1,0,1]=4 9172 B12R2.1081 Oc1ccnc2c1nccn2 271570a_203496583355_100010783457 [0,1,0,1,0,0|2,0,0]=4 9173 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [0,1,0,1,0,0|1,0,1]=4 9174 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [0,1,0,1,0,0|1,0,1]=4 9175 B12R2.1081 Oc1cncc2c1ccnc2 271570a_203496583355_100010134378 [0,1,0,1,0,0|1,0,1]=4 9176 B12R2.1081 Oc1cncc2c1nccn2 271570a_203496583355_200010209543 [0,1,0,1,0,0|2,0,0]=4 9177 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [0,1,0,1,0,0|2,0,0]=4 9178 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [0,1,0,1,0,0|1,0,1]=4 9179 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [0,1,0,1,0,0|1,0,1]=4 9180 B12R2.1081 Oc1nccc2c1cncc2 271570a_203496583355_100000116921 [0,1,0,1,0,0|1,0,1]=4 9181 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [0,1,0,1,0,0|1,0,1]=4 9182 B12R2.1081 Oc1nccc2c1nccn2 271570a_203496583355_100010063732 [0,1,0,1,0,0|2,0,0]=4 9183 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [0,1,0,1,0,0|2,0,0]=4 9184 B12R2.24 Oc1ccc2c(c1)CCCO2 271570a_203496583355_100011393166 [0,1,0,1,0,0|0,0,2]=4 9185 B12R2.24 Oc1ccc2c(c1)OCCC2 271570a_203496583355_100010700467 [0,1,0,1,0,0|0,0,2]=4 9186 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,1,0,1,0,0|1,0,1]=4 9187 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,1,0,1,0,0|1,0,1]=4 9188 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [0,1,0,1,0,0|1,0,1]=4 9189 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [0,1,0,1,0,0|1,0,1]=4 9190 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [0,1,0,1,0,0|2,0,0]=4 9191 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,1,0,1,0,0|1,0,1]=4 9192 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,1,0,1,0,0|2,0,0]=4 9193 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [0,1,0,1,0,0|1,0,1]=4 9194 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [0,1,0,1,0,0|0,0,1]=3 9195 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [0,1,0,1,0,0|0,1,1]=4 9196 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,1,0,1,0,0|1,0,1]=4 9197 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,1,0,1,0,0|0,1,1]=4 9198 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,1,0,0|0,0,2]=4 9199 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,1,0,0|0,0,2]=4 9200 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,1,0,0|1,0,0]=3 9201 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,1,0,1,0,0|1,0,1]=4 9202 B12R2.196 Cn1ccc2c1cccc2O 271570a_203496583355_200011934935 [0,1,0,1,0,0|0,0,2]=4 9203 B12R2.196 Cn1cnc2c1cccc2O 271570a_203496583355_100000696766 [0,1,0,1,0,0|1,0,1]=4 9204 B12R2.196 NC1CCc2c1cccc2O 271570a_203496583355_100000751068 [0,1,0,1,0,0|0,0,2]=4 9205 B12R2.196 NC1COc2c1cccc2O 271570a_203496583355_100025715106 [0,1,0,1,0,0|1,0,1]=4 9206 B12R2.196 Nc1n[nH]c2c1cccc2O 271570a_203496583355_100010069757 [0,1,0,1,0,0|2,0,0]=4 9207 B12R2.196 Nc1noc2c1cccc2O 271570a_203496583355_100010069758 [0,1,0,1,0,0|2,0,0]=4 9208 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,1,0,0|0,0,1]=3 9209 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,1,0,0|1,0,0]=3 9210 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,1,0,0|1,0,0]=3 9211 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,1,0,0|1,0,0]=3 9212 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,1,0,1,0,0|2,0,0]=4 9213 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [0,1,0,1,0,0|0,0,2]=4 9214 B12R2.196 Oc1cccn2c1ncc2O 271570a_203496583355_200020799507 [0,1,0,1,0,0|2,0,0]=4 9215 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [0,1,0,1,0,0|2,0,0]=4 9216 B12R2.225 Oc1ccccc1NC2CC2 34a_100000185747_100000211595 [0,1,0,1,0,0|0,0,2]=4 9217 B12R2.225 Oc1ccccc1OC2CC2 271570a_203496583355_100012344913 [0,1,0,1,0,0|0,0,2]=4 9218 B12R2.225 Oc1ccccc1SC2CC2 62a_100000739446_100000211595 [0,1,0,1,0,0|0,0,2]=4 9219 B12R2.1 C=Cc1coc2c1cccc2 271570a_100011290941_100009812202 [0,1,0,1,0,0|0,0,1]=3 9220 B12R2.1 C=Cc1coc2c1nccc2 271570a_100011290941_100009889148 [0,1,0,1,0,0|1,0,1]=4 9221 B12R2.1 C=Cc1csc2c1cccc2 271570a_100011290941_100009813928 [0,1,0,1,0,0|0,1,1]=4 9222 B12R2.1 C=Cc1n[nH]c2c1cccc2 271570a_100011290941_100000050141 [0,1,0,1,0,0|1,0,1]=4 9223 B12R2.1 CNC1COc2c1cccc2 2230a_100000747519_200000210301 [0,1,0,1,0,0|1,0,1]=4 9224 B12R2.1 [13CH3]NC1COc2c1cccc2 2230a_100000747519_200025704644 [0,1,0,1,0,0|1,0,1]=4 9225 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,1,0,0|0,0,2]=4 9226 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,1,0,0|1,0,1]=4 9227 B12R2.315 C=Cc1cccc2c1CC=C2 271570a_100011290941_100009844718 [0,1,0,1,0,0|1,0,0]=3 9228 B12R2.315 C=Cc1cccc2c1[nH]cc2 271570a_100011290941_100009813418 [0,1,0,1,0,0|2,0,0]=4 9229 B12R2.315 C=Cc1cccc2c1occ2 271570a_100011290941_100011935138 [0,1,0,1,0,0|2,0,0]=4 9230 B12R2.315 C=Cc1cccc2c1scc2 271570a_100011290941_100000766737 [0,1,0,1,0,0|2,0,0]=4 9231 B12R2.315 COc1cccc2c1CCC2 34a_100000074356_200000210301 [0,1,0,1,0,0|0,0,2]=4 9232 B12R2.315 COc1cccc2c1CCC2 7a_100000074356_200000210301 [0,1,0,1,0,0|0,0,2]=4 9233 B12R2.315 COc1cccc2c1CCN2 34a_100000703684_200000210301 [0,1,0,1,0,0|1,0,1]=4 9234 B12R2.315 COc1cccc2c1CCO2 34a_100000090053_200000210301 [0,1,0,1,0,0|1,0,1]=4 9235 B12R2.315 COc1cccc2c1CCO2 7a_100000090053_200000210301 [0,1,0,1,0,0|1,0,1]=4 9236 B12R2.315 COc1cccc2c1CNC2 34a_100015191671_200000210301 [0,1,0,1,0,0|1,0,1]=4 9237 B12R2.315 COc1cccc2c1cc[nH]2 34a_100000763377_200000210301 [0,1,0,1,0,0|1,0,1]=4 9238 B12R2.315 COc1cccc2c1ccs2 34a_100000077759_200000210301 [0,1,0,1,0,0|1,0,1]=4 9239 B12R2.315 COc1cccc2c1ccs2 7a_100000077759_200000210301 [0,1,0,1,0,0|1,0,1]=4 9240 B12R2.315 COc1cccc2c1ncs2 34a_100000101385_200000210301 [0,1,0,1,0,0|2,0,0]=4 9241 B12R2.315 COc1cccc2c1ncs2 7a_100000101385_200000210301 [0,1,0,1,0,0|2,0,0]=4 9242 B12R2.315 COc1cccn2c1ncc2 34a_100000068405_200000210301 [0,1,0,1,0,0|2,0,0]=4 9243 B12R2.315 COc1cccn2c1ncc2 7a_100000068405_200000210301 [0,1,0,1,0,0|2,0,0]=4 9244 B12R2.315 COc1ccnc2c1scc2 34a_100000759877_200000210301 [0,1,0,1,0,0|2,0,0]=4 9245 B12R2.315 CSc1cccc2c1CC=C2 62a_100009844718_200000210301 [0,1,0,1,0,0|0,1,0]=3 9246 B12R2.315 CSc1cccc2c1CC=C2 62a_200000210301_100009844718 [0,1,0,1,0,0|0,1,0]=3 9247 B12R2.315 CSc1cccc2c1[nH]cc2 62a_200000210301_100009813418 [0,1,0,1,0,0|1,1,0]=4 9248 B12R2.315 CSc1cccc2c1occ2 62a_200000210301_100011935138 [0,1,0,1,0,0|1,1,0]=4 9249 B12R2.315 CSc1cccc2c1scc2 62a_200000210301_100000766737 [0,1,0,1,0,0|1,1,0]=4 9250 B12R2.315 [13CH3]Oc1cccc2c1CCC2 34a_100000074356_200025704644 [0,1,0,1,0,0|0,0,2]=4 9251 B12R2.315 [13CH3]Oc1cccc2c1CCC2 7a_100000074356_200025704644 [0,1,0,1,0,0|0,0,2]=4 9252 B12R2.315 [13CH3]Oc1cccc2c1CCN2 34a_100000703684_200025704644 [0,1,0,1,0,0|1,0,1]=4 9253 B12R2.315 [13CH3]Oc1cccc2c1CCO2 34a_100000090053_200025704644 [0,1,0,1,0,0|1,0,1]=4 9254 B12R2.315 [13CH3]Oc1cccc2c1CCO2 7a_100000090053_200025704644 [0,1,0,1,0,0|1,0,1]=4 9255 B12R2.315 [13CH3]Oc1cccc2c1CNC2 34a_100015191671_200025704644 [0,1,0,1,0,0|1,0,1]=4 9256 B12R2.315 [13CH3]Oc1cccc2c1cc[nH]2 34a_100000763377_200025704644 [0,1,0,1,0,0|1,0,1]=4 9257 B12R2.315 [13CH3]Oc1cccc2c1ccs2 34a_100000077759_200025704644 [0,1,0,1,0,0|1,0,1]=4 9258 B12R2.315 [13CH3]Oc1cccc2c1ccs2 7a_100000077759_200025704644 [0,1,0,1,0,0|1,0,1]=4 9259 B12R2.315 [13CH3]Oc1cccc2c1ncs2 34a_100000101385_200025704644 [0,1,0,1,0,0|2,0,0]=4 9260 B12R2.315 [13CH3]Oc1cccc2c1ncs2 7a_100000101385_200025704644 [0,1,0,1,0,0|2,0,0]=4 9261 B12R2.315 [13CH3]Oc1cccn2c1ncc2 34a_100000068405_200025704644 [0,1,0,1,0,0|2,0,0]=4 9262 B12R2.315 [13CH3]Oc1cccn2c1ncc2 7a_100000068405_200025704644 [0,1,0,1,0,0|2,0,0]=4 9263 B12R2.315 [13CH3]Oc1ccnc2c1scc2 34a_100000759877_200025704644 [0,1,0,1,0,0|2,0,0]=4 9264 B12R2.315 [13CH3]Sc1cccc2c1CC=C2 62a_100009844718_200025704644 [0,1,0,1,0,0|0,1,0]=3 9265 B12R2.315 [13CH3]Sc1cccc2c1CC=C2 62a_200025704644_100009844718 [0,1,0,1,0,0|0,1,0]=3 9266 B12R2.315 [13CH3]Sc1cccc2c1[nH]cc2 62a_200025704644_100009813418 [0,1,0,1,0,0|1,1,0]=4 9267 B12R2.315 [13CH3]Sc1cccc2c1occ2 62a_200025704644_100011935138 [0,1,0,1,0,0|1,1,0]=4 9268 B12R2.315 [13CH3]Sc1cccc2c1scc2 62a_200025704644_100000766737 [0,1,0,1,0,0|1,1,0]=4 9269 B12R2.2048 COc1ccccc1C2CC2 271570a_100011220607_100000174000 [0,1,0,1,0,0|0,0,2]=4 9270 B12R2.2048 OCc1ccccc1C2CC2 271570a_100011220607_100000187465 [0,1,0,1,0,0|0,0,2]=4 9271 B12R2.246 Cc1cc(c2[nH]cnc2c1)O 271570a_203496583355_100010107307 [0,1,0,1,0,0|2,0,0]=4 9272 B12R2.246 Cc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100009816732 [0,1,0,1,0,0|2,0,0]=4 9273 B12R2.246 Cc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010186026 [0,1,0,1,0,0|1,0,1]=4 9274 B12R2.246 Cc1cc(c2nccn2c1)O 271570a_203496583355_100025775375 [0,1,0,1,0,0|2,0,0]=4 9275 B12R2.246 Cc1cc(c2occc2c1)O 271570a_203496583355_100012361857 [0,1,0,1,0,0|1,0,0]=3 9276 B12R2.246 Cc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009817142 [0,1,0,1,0,0|2,0,0]=4 9277 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [0,1,0,1,0,0|2,0,0]=4 9278 B12R2.246 Nc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100010188536 [0,1,0,1,0,0|2,0,0]=4 9279 B12R2.246 Nc1cc(c2cc[nH]c2c1)O 271570a_203496583355_100010006569 [0,1,0,1,0,0|1,0,1]=4 9280 B12R2.246 Nc1cc(c2scnc2c1)O 271570a_203496583355_200010333430 [0,1,0,1,0,0|2,0,0]=4 9281 B12R2.246 Nc1cc(cc2c1[nH]cc2)O 271570a_203496583355_100009813507 [0,1,0,1,0,0|2,0,0]=4 9282 B12R2.246 Oc1cc(c2[nH]ccc2c1)F 271570a_203496583355_100010138380 [0,1,0,1,0,0|2,0,0]=4 9283 B12R2.246 Oc1cc(c2[nH]ncc2c1)O 271570a_203496583355_100015619115 [0,1,0,1,0,0|2,0,0]=4 9284 B12R2.246 Oc1cc(c2nccn2c1)O 271570a_203496583355_100010074634 [0,1,0,1,0,0|2,0,0]=4 9285 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [0,1,0,1,0,0|2,0,0]=4 9286 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [0,1,0,1,0,0|1,0,0]=3 9287 B12R2.246 Oc1cc(cc2c1[nH]cc2)F 271570a_203496583355_100010138379 [0,1,0,1,0,0|1,0,0]=3 9288 B12R2.246 Oc1cc(cc2c1[nH]nc2)Br 271570a_203496583355_100000729393 [0,1,0,1,0,0|2,0,0]=4 9289 B12R2.246 Oc1cc(cc2c1cc[nH]2)Br 271570a_203496583355_100009814761 [0,1,0,1,0,0|1,0,1]=4 9290 B12R2.246 Oc1cc(cc2c1cc[nH]2)F 271570a_203496583355_100010188273 [0,1,0,1,0,0|1,0,1]=4 9291 B12R2.246 Oc1cc(cc2c1nc[nH]2)F 271570a_203496583355_100010192642 [0,1,0,1,0,0|2,0,0]=4 9292 B12R2.246 Oc1cc(cc2c1nco2)F 271570a_203496583355_100016120941 [0,1,0,1,0,0|2,0,0]=4 9293 B12R2.246 Oc1cc(cc2c1occ2)F 271570a_203496583355_100011935139 [0,1,0,1,0,0|1,0,0]=3 9294 B12R2.246 Oc1cc(cn2c1ncc2)Br 271570a_203496583355_100000687079 [0,1,0,1,0,0|2,0,0]=4 9295 B12R2.246 Oc1cc(cn2c1ncc2)Cl 271570a_203496583355_100010232167 [0,1,0,1,0,0|2,0,0]=4 9296 B12R2.246 Oc1cc(cn2c1ncc2)F 271570a_203496583355_100010289905 [0,1,0,1,0,0|2,0,0]=4 9297 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,1,0,1,0,0|1,0,1]=4 9298 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,1,0,0|1,0,1]=4 9299 B12R2.606 Nc1nc2cc(ccc2o1)O 271570a_203496583355_100000737949 [0,1,0,1,0,0|2,0,0]=4 9300 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [0,1,0,1,0,0|2,0,0]=4 9301 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,1,0,0|2,0,0]=4 9302 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,1,0,0|2,0,0]=4 9303 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,1,0,1,0,0|2,0,0]=4 9304 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,1,0,1,0,0|2,0,0]=4 9305 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,1,0,1,0,0|2,0,0]=4 9306 B12R2.1317 Cc1ccc(c(c1)O)C2CC2 271570a_100011220607_100012002257 [0,1,0,1,0,0|0,0,2]=4 9307 B12R2.1317 Oc1cc(ccc1C2CC2)Br 271570a_100011220607_100012344904 [0,1,0,1,0,0|0,0,2]=4 9308 B12R2.1317 Oc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000050036 [0,1,0,1,0,0|0,0,2]=4 9309 B12R2.1317 Oc1cc(ccc1C2CC2)F 271570a_100011220607_100000690578 [0,1,0,1,0,0|0,0,2]=4 9310 B12R2.1317 Oc1ccc(c(c1)O)C2CC2 271570a_100011220607_100009813921 [0,1,0,1,0,0|0,0,2]=4 9311 B12R2.3190 CC(=O)C1Cc2c1cccc2 1458a_200000238571_200000210301 [0,1,0,1,0,0|1,0,1]=4 9312 B12R2.3190 [13CH3]C(=O)C1Cc2c1cccc2 1458a_200000238571_200025704644 [0,1,0,1,0,0|1,0,1]=4 9313 B12R2.221 Cc1ccc(c2c1[nH]cc2)O 271570a_203496583355_100009820812 [0,1,0,1,0,0|1,0,1]=4 9314 B12R2.221 Cc1ccc(c2c1cc[nH]2)O 271570a_203496583355_100010219157 [0,1,0,1,0,0|1,0,0]=3 9315 B12R2.221 Cc1ccc(c2c1cco2)O 271570a_203496583355_100010253976 [0,1,0,1,0,0|1,0,0]=3 9316 B12R2.221 Cc1ccc(c2n1ccn2)O 271570a_203496583355_200015695500 [0,1,0,1,0,0|2,0,0]=4 9317 B12R2.221 Cc1ncc(c2c1cc[nH]2)O 271570a_203496583355_100010244396 [0,1,0,1,0,0|2,0,0]=4 9318 B12R2.221 Nc1ccc(c2c1CCC2)O 271570a_203496583355_200010751103 [0,1,0,1,0,0|0,0,2]=4 9319 B12R2.221 O=c1[nH]cc(c2c1cco2)O 271570a_203496583355_100010244693 [0,1,0,1,0,0|2,0,0]=4 9320 B12R2.221 O=c1[nH]cc(c2c1ccs2)O 271570a_203496583355_100000692125 [0,1,0,1,0,0|2,0,0]=4 9321 B12R2.221 Oc1ccc(c2c1[nH]cc2)F 271570a_203496583355_100010138378 [0,1,0,1,0,0|1,0,0]=3 9322 B12R2.221 Oc1ccc(c2c1[nH]nc2)F 271570a_203496583355_100010206778 [0,1,0,1,0,0|2,0,0]=4 9323 B12R2.221 Oc1ccc(c2c1cc[nH]2)F 271570a_203496583355_100010006601 [0,1,0,1,0,0|1,0,1]=4 9324 B12R2.221 Oc1ccc(c2c1cco2)F 271570a_203496583355_100010248603 [0,1,0,1,0,0|1,0,1]=4 9325 B12R2.221 Oc1ccc(c2c1cco2)O 271570a_203496583355_200020711608 [0,1,0,1,0,0|1,0,0]=3 9326 B12R2.221 Oc1ccc(c2c1occ2)F 271570a_203496583355_100012355473 [0,1,0,1,0,0|1,0,0]=3 9327 B12R2.221 Oc1ccc(n2c1ncc2)Cl 271570a_203496583355_100010184985 [0,1,0,1,0,0|2,0,0]=4 9328 B12R2.1316 Cc1ccc(c(c1)C2CC2)O 271570a_100011220607_100000765521 [0,1,0,1,0,0|0,0,2]=4 9329 B12R2.1316 Nc1ccc(c(c1)C2CC2)O 271570a_100011220607_100011534360 [0,1,0,1,0,0|0,0,2]=4 9330 B12R2.1316 Nc1ccc(c(c1)C2CC2)O 271570a_203496583355_100010281208 [0,1,0,1,0,0|0,0,2]=4 9331 B12R2.1316 Oc1ccc(c(c1)C2CC2)O 271570a_100011220607_100009813629 [0,1,0,1,0,0|0,0,2]=4 9332 B12R2.1316 Oc1ccc(cc1C2CC2)Br 271570a_100011220607_100012355227 [0,1,0,1,0,0|0,0,2]=4 9333 B12R2.1316 Oc1ccc(cc1C2CC2)Cl 271570a_100011220607_100011356953 [0,1,0,1,0,0|0,0,2]=4 9334 B12R2.1316 Oc1ccc(cc1C2CC2)F 271570a_100011220607_100000211999 [0,1,0,1,0,0|0,0,2]=4 9335 B12R2.88 NC1(CC1)c2ccccc2O 271570a_203496583355_200000691159 [0,1,0,1,0,0|0,0,2]=4 9336 B12R2.203 Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010194227 [0,1,0,1,0,0|1,0,1]=4 9337 B12R2.203 Cn1ccc2c1c(ccc2)O 271570a_203496583355_100009817156 [0,1,0,1,0,0|1,0,0]=3 9338 B12R2.203 Cn1cnc2c1c(ccc2)O 271570a_203496583355_100010749505 [0,1,0,1,0,0|2,0,0]=4 9339 B12R2.203 Cn1ncc2c1c(ccc2)O 271570a_203496583355_100009817178 [0,1,0,1,0,0|2,0,0]=4 9340 B12R2.203 NC1CCc2c1c(ccc2)O 271570a_203496583355_100103168669 [0,1,0,1,0,0|0,0,2]=4 9341 B12R2.203 Oc1cccc2c1C(CS2)O 271570a_203496583355_200010991195 [0,1,0,1,0,0|1,0,1]=4 9342 B12R2.240 Cc1cccc(c1C2CC2)O 271570a_100011220607_100000686692 [0,1,0,1,0,0|0,0,2]=4 9343 B12R2.240 Nc1cccc(c1C2CC2)O 271570a_100011220607_100012183704 [0,1,0,1,0,0|0,0,2]=4 9344 B12R2.240 Oc1cccc(c1C2CC2)Br 271570a_100011220607_100010187912 [0,1,0,1,0,0|0,0,2]=4 9345 B12R2.240 Oc1cccc(c1C2CC2)Cl 271570a_100011220607_100000050174 [0,1,0,1,0,0|0,0,2]=4 9346 B12R2.240 Oc1cccc(c1C2CC2)F 271570a_100011220607_100009820682 [0,1,0,1,0,0|0,0,2]=4 9347 B12R2.240 Oc1cccc(c1C2CC2)F 271570a_203496583355_100010780639 [0,1,0,1,0,0|0,0,2]=4 9348 B12R2.240 Oc1cccc(c1C2CC2)O 271570a_100011220607_100010205330 [0,1,0,1,0,0|0,0,2]=4 9349 B8R1.11 C=Cc1ccsc1C 271570a_100011290941_100000684487 [1,0,0,0,1,0|2,0,0]=4 9350 B8R1.11 C=Cc1cscc1Br 271570a_100011290941_100010143727 [1,0,0,0,1,0|2,0,0]=4 9351 B8R1.11 C=Cc1cscc1C 271570a_100011290941_100000759966 [1,0,0,0,1,0|2,0,0]=4 9352 B8R1.11 C=Cc1sccc1Br 271570a_100011290941_100012361411 [1,0,0,0,1,0|2,0,0]=4 9353 B8R1.11 C=Cc1sccc1C 271570a_100011290941_100000742657 [1,0,0,0,1,0|2,0,0]=4 9354 B8R1.11 CCc1ccsc1O 271570a_203496583355_200009875468 [1,0,0,0,1,0|1,0,1]=4 9355 B8R1.11 CCc1cscc1O 271570a_203496583355_100011068457 [1,0,0,0,1,0|1,0,1]=4 9356 B8R1.11 NCc1ccsc1O 271570a_203496583355_100000727803 [1,0,0,0,1,0|2,0,0]=4 9357 B8R1.11 O=Cc1ccsc1O 271570a_203496583355_100009816921 [1,0,0,0,1,0|2,0,0]=4 9358 B8R1.11 O=Cc1cscc1O 271570a_203496583355_100000685484 [1,0,0,0,1,0|2,0,0]=4 9359 B8R1.11 O=Cc1occc1O 271570a_203496583355_100000756499 [1,0,0,0,1,0|2,0,0]=4 9360 B8R1.11 O=Cc1sccc1O 271570a_203496583355_100000766043 [1,0,0,0,1,0|2,0,0]=4 9361 B8R1.11 OCc1ccsc1O 271570a_203496583355_100009816922 [1,0,0,0,1,0|2,0,0]=4 9362 B8R1.11 OCc1cscc1O 271570a_203496583355_100000724555 [1,0,0,0,1,0|2,0,0]=4 9363 B8R1.11 OCc1sccc1O 271570a_203496583355_100000702026 [1,0,0,0,1,0|2,0,0]=4