0 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [0,0,0,0,0,0|1,0,1]=2 1 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.1 C=C=Cc1ccc(cn1)O 271570a_100015277604_100000685995 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.1 CC=Cc1cc[n+](cc1)[O-] 271570a_100016259895_100000039755 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.1 CC=Cc1ccc(=O)[nH]c1 271570a_100016259895_100000212171 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [0,0,0,0,0,0|1,0,1]=2 16 B10R1.1 CC=Cc1ccc(cn1)Br 271570a_100016259895_100000686858 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.1 CC=Cc1ccc(cn1)Cl 271570a_100016259895_100011356976 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.1 CC=Cc1ccc(cn1)F 271570a_100016259895_100000744514 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.1 CC=Cc1ccc(cn1)N 271570a_100016259895_100000744251 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.1 CC=Cc1ccc(nc1)Br 271570a_100016259895_100009814638 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.1 CC=Cc1ccc(nc1)Cl 271570a_100016259895_100000034144 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.1 CC=Cc1ccc(nc1)F 271570a_100016259895_100000748661 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.1 CC=Cc1ccc(nc1)N 271570a_100016259895_100000187370 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.1 CC=Cc1ncc(cn1)O 271570a_100016259895_100000730009 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [0,0,0,0,0,0|1,0,0]=1 29 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [0,0,0,0,0,0|1,0,0]=1 38 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.1 CCNc1ccc(cn1)Br 27a_100015525214_100000686858 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.1 CCNc1ccc(nn1)C 27a_100015525214_100000744512 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.1 CCNc1ccc(nn1)O 271570a_203496583355_100000215268 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.1 CCNc1cnc(cn1)Br 27a_100015525214_100010187541 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.1 CCNc1cnc(cn1)C 27a_100015525214_100000074397 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.1 CCNc1cnc(cn1)F 27a_100015525214_100009856528 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.1 CCNc1ncc(cn1)Br 27a_100015525214_100000690281 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.1 CCNc1ncc(cn1)C 27a_100015525214_100000061069 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.1 CCNc1ncc(cn1)Cl 27a_100015525214_100011356929 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.1 CCNc1ncc(cn1)F 27a_100015525214_100000685220 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.1 CCOc1ccc(=O)[nH]c1 34a_100000075641_100000210202 [0,0,0,0,0,0|1,0,1]=2 51 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [0,0,0,0,0,0|1,0,0]=1 52 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [0,0,0,0,0,0|1,0,0]=1 53 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [0,0,0,0,0,0|1,0,0]=1 54 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [0,0,0,0,0,0|1,0,0]=1 55 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [0,0,0,0,0,0|1,0,0]=1 56 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [0,0,0,0,0,0|1,0,0]=1 57 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [0,0,0,0,0,0|1,0,0]=1 58 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [0,0,0,0,0,0|1,0,0]=1 59 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [0,0,0,0,0,0|1,0,0]=1 60 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [0,0,0,0,0,0|1,0,0]=1 61 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [0,0,0,0,0,0|0,0,0]=0 62 B10R1.1 CCOc1ccc(cn1)C 34a_100000759353_100000210202 [0,0,0,0,0,0|2,0,0]=2 63 B10R1.1 CCOc1ccc(cn1)Cl 34a_100011215309_100000210202 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.1 CCOc1ccc(cn1)F 34a_100000742473_100000210202 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.1 CCOc1ccc(cn1)N 34a_100000729260_100000210202 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [0,0,0,0,0,0|1,0,0]=1 67 B10R1.1 CCOc1ccc(nc1)Br 34a_100000685995_100000210202 [0,0,0,0,0,0|2,0,0]=2 68 B10R1.1 CCOc1ccc(nc1)Br 7a_100000685995_100000210202 [0,0,0,0,0,0|2,0,0]=2 69 B10R1.1 CCOc1ccc(nc1)C 34a_100000745506_100000210202 [0,0,0,0,0,0|2,0,0]=2 70 B10R1.1 CCOc1ccc(nc1)C 7a_100000745506_100000210202 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.1 CCOc1ccc(nc1)Cl 34a_100000744096_100000210202 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.1 CCOc1ccc(nc1)Cl 7a_100000744096_100000210202 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.1 CCOc1ccc(nc1)F 34a_100000688820_100000210202 [0,0,0,0,0,0|2,0,0]=2 74 B10R1.1 CCOc1ccc(nc1)F 7a_100000688820_100000210202 [0,0,0,0,0,0|2,0,0]=2 75 B10R1.1 CCOc1ccc(nc1)I 34a_100000687607_100000210202 [0,0,0,0,0,0|2,0,0]=2 76 B10R1.1 CCOc1ccc(nc1)I 7a_100000687607_100000210202 [0,0,0,0,0,0|2,0,0]=2 77 B10R1.1 CCOc1ccc(nc1)N 34a_100015188713_100000210202 [0,0,0,0,0,0|2,0,0]=2 78 B10R1.1 CCOc1ccc(nc1)N 7a_100015188713_100000210202 [0,0,0,0,0,0|2,0,0]=2 79 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [0,0,0,0,0,0|1,0,0]=1 80 B10R1.1 CCOc1ccc(nn1)O 271570a_203496583355_100000757289 [0,0,0,0,0,0|2,0,0]=2 81 B10R1.1 CCOc1cnc(cn1)Br 34a_100011934580_100000210202 [0,0,0,0,0,0|3,0,0]=3 82 B10R1.1 CCOc1cnc(cn1)Cl 34a_100015839800_100000210202 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.1 CCOc1cnc(cn1)O 271570a_203496583355_200012356188 [0,0,0,0,0,0|2,0,0]=2 84 B10R1.1 CCOc1cnc(nc1)Br 34a_100000730009_100000210202 [0,0,0,0,0,0|3,0,0]=3 85 B10R1.1 CCOc1cnc(nc1)Br 7a_100000730009_100000210202 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.1 CCOc1cnc(nc1)C 34a_100000062939_100000210202 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.1 CCOc1cnc(nc1)C 7a_100000062939_100000210202 [0,0,0,0,0,0|3,0,0]=3 88 B10R1.1 CCOc1cnc(nc1)Cl 34a_100000092845_100000210202 [0,0,0,0,0,0|3,0,0]=3 89 B10R1.1 CCOc1cnc(nc1)Cl 7a_100000092845_100000210202 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.1 CCOc1cnc(nc1)F 34a_200009874573_100000210202 [0,0,0,0,0,0|3,0,0]=3 91 B10R1.1 CCOc1cnc(nc1)F 7a_200009874573_100000210202 [0,0,0,0,0,0|3,0,0]=3 92 B10R1.1 CCOc1cnc(nc1)N 34a_100000087137_100000210202 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.1 CCOc1cnc(nc1)N 7a_100000087137_100000210202 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.1 CCOc1cnc(nc1)O 271570a_203496583355_100000099823 [0,0,0,0,0,0|2,0,0]=2 95 B10R1.1 CCOc1ncc(cn1)F 34a_100011934040_100000210202 [0,0,0,0,0,0|3,0,0]=3 96 B10R1.1 CCOc1ncc(cn1)O 271570a_203496583355_100011934766 [0,0,0,0,0,0|2,0,0]=2 97 B10R1.1 CCSc1cc[n+](cc1)[O-] 62a_100000210202_100000039755 [0,0,0,0,0,0|1,1,1]=3 98 B10R1.1 CCSc1ccc(=O)[nH]c1 62a_100000210202_100000212171 [0,0,0,0,0,0|1,1,1]=3 99 B10R1.1 CCSc1ccc(=O)[nH]c1 62a_100000212171_100000210202 [0,0,0,0,0,0|1,1,1]=3 100 B10R1.1 CCSc1ccc(=O)[nH]n1 62a_100000210202_100009820020 [0,0,0,0,0,0|2,1,1]=4 101 B10R1.1 CCSc1ccc(=O)[nH]n1 62a_100009820020_100000210202 [0,0,0,0,0,0|2,1,1]=4 102 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [0,0,0,0,0,0|1,1,0]=2 103 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [0,0,0,0,0,0|1,1,0]=2 104 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [0,0,0,0,0,0|1,1,0]=2 105 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [0,0,0,0,0,0|1,1,0]=2 106 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [0,0,0,0,0,0|1,1,0]=2 107 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [0,0,0,0,0,0|1,1,0]=2 108 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [0,0,0,0,0,0|1,1,0]=2 109 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [0,0,0,0,0,0|1,1,0]=2 110 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [0,0,0,0,0,0|1,1,0]=2 111 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [0,0,0,0,0,0|1,1,0]=2 112 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [0,0,0,0,0,0|0,1,0]=1 113 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [0,0,0,0,0,0|0,1,0]=1 114 B10R1.1 CCSc1ccc(cn1)Br 62a_100000210202_100000686858 [0,0,0,0,0,0|2,1,0]=3 115 B10R1.1 CCSc1ccc(cn1)Br 62a_100000686858_100000210202 [0,0,0,0,0,0|2,1,0]=3 116 B10R1.1 CCSc1ccc(cn1)C 62a_100000210202_100000754016 [0,0,0,0,0,0|2,1,0]=3 117 B10R1.1 CCSc1ccc(cn1)C 62a_100011192072_100000210202 [0,0,0,0,0,0|2,1,0]=3 118 B10R1.1 CCSc1ccc(cn1)Cl 62a_100000210202_100011356976 [0,0,0,0,0,0|2,1,0]=3 119 B10R1.1 CCSc1ccc(cn1)Cl 62a_100011356976_100000210202 [0,0,0,0,0,0|2,1,0]=3 120 B10R1.1 CCSc1ccc(cn1)F 62a_100000210202_100000744514 [0,0,0,0,0,0|2,1,0]=3 121 B10R1.1 CCSc1ccc(cn1)F 62a_100000744514_100000210202 [0,0,0,0,0,0|2,1,0]=3 122 B10R1.1 CCSc1ccc(cn1)N 62a_100000210202_100000737798 [0,0,0,0,0,0|2,1,0]=3 123 B10R1.1 CCSc1ccc(cn1)N 62a_100000737798_100000210202 [0,0,0,0,0,0|2,1,0]=3 124 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [0,0,0,0,0,0|1,1,0]=2 125 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [0,0,0,0,0,0|1,1,0]=2 126 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [0,0,0,0,0,0|1,1,0]=2 127 B10R1.1 CCSc1ccc(nc1)Br 62a_100000210202_100009814638 [0,0,0,0,0,0|2,1,0]=3 128 B10R1.1 CCSc1ccc(nc1)Br 62a_100009814638_100000210202 [0,0,0,0,0,0|2,1,0]=3 129 B10R1.1 CCSc1ccc(nc1)C 62a_100000210202_100000751577 [0,0,0,0,0,0|2,1,0]=3 130 B10R1.1 CCSc1ccc(nc1)C 62a_100000751577_100000210202 [0,0,0,0,0,0|2,1,0]=3 131 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000034144_100000210202 [0,0,0,0,0,0|2,1,0]=3 132 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000210202_100000034144 [0,0,0,0,0,0|2,1,0]=3 133 B10R1.1 CCSc1ccc(nc1)F 62a_100000042367_100000210202 [0,0,0,0,0,0|2,1,0]=3 134 B10R1.1 CCSc1ccc(nc1)F 62a_100000210202_100000042367 [0,0,0,0,0,0|2,1,0]=3 135 B10R1.1 CCSc1ccc(nc1)N 62a_100000187370_100000210202 [0,0,0,0,0,0|2,1,0]=3 136 B10R1.1 CCSc1ccc(nc1)N 62a_100000210202_100000187370 [0,0,0,0,0,0|2,1,0]=3 137 B10R1.1 CCSc1ccc(nn1)C 62a_100000210202_100000744512 [0,0,0,0,0,0|3,1,0]=4 138 B10R1.1 CCSc1ccc(nn1)C 62a_100000744512_100000210202 [0,0,0,0,0,0|3,1,0]=4 139 B10R1.1 CCSc1ccc(nn1)Cl 62a_100000068654_100000210202 [0,0,0,0,0,0|3,1,0]=4 140 B10R1.1 CCSc1ccc(nn1)Cl 62a_100000210202_100000068654 [0,0,0,0,0,0|3,1,0]=4 141 B10R1.1 CCSc1ccc(nn1)N 62a_100000210202_100010219413 [0,0,0,0,0,0|3,1,0]=4 142 B10R1.1 CCSc1ccc(nn1)N 62a_100010219413_100000210202 [0,0,0,0,0,0|3,1,0]=4 143 B10R1.1 CCSc1cnc(=O)[nH]c1 62a_100000210202_102495366499 [0,0,0,0,0,0|2,1,1]=4 144 B10R1.1 CCSc1cnc(=O)[nH]c1 62a_102495366499_100000210202 [0,0,0,0,0,0|2,1,1]=4 145 B10R1.1 CCSc1cnc(cn1)Br 62a_100000210202_100010187541 [0,0,0,0,0,0|3,1,0]=4 146 B10R1.1 CCSc1cnc(cn1)Br 62a_100010187541_100000210202 [0,0,0,0,0,0|3,1,0]=4 147 B10R1.1 CCSc1cnc(cn1)C 62a_100000210202_100011999403 [0,0,0,0,0,0|3,1,0]=4 148 B10R1.1 CCSc1cnc(cn1)C 62a_100011999403_100000210202 [0,0,0,0,0,0|3,1,0]=4 149 B10R1.1 CCSc1cnc(cn1)Cl 62a_100000210202_100010214907 [0,0,0,0,0,0|3,1,0]=4 150 B10R1.1 CCSc1cnc(cn1)Cl 62a_100010214907_100000210202 [0,0,0,0,0,0|3,1,0]=4 151 B10R1.1 CCSc1cnc(cn1)F 62a_100000210202_100009856528 [0,0,0,0,0,0|3,1,0]=4 152 B10R1.1 CCSc1cnc(cn1)F 62a_100009856528_100000210202 [0,0,0,0,0,0|3,1,0]=4 153 B10R1.1 CCSc1cnc(cn1)N 62a_100000210202_100000744751 [0,0,0,0,0,0|3,1,0]=4 154 B10R1.1 CCSc1cnc(cn1)N 62a_100000744751_100000210202 [0,0,0,0,0,0|3,1,0]=4 155 B10R1.1 CCSc1cnc(cn1)O 62a_100000210202_100015839800 [0,0,0,0,0,0|2,1,0]=3 156 B10R1.1 CCSc1cnc(cn1)O 62a_100011934580_100000210202 [0,0,0,0,0,0|2,1,0]=3 157 B10R1.1 CCSc1cnc(nc1)Br 62a_100000210202_200012349914 [0,0,0,0,0,0|3,1,0]=4 158 B10R1.1 CCSc1cnc(nc1)Br 62a_200012349914_100000210202 [0,0,0,0,0,0|3,1,0]=4 159 B10R1.1 CCSc1cnc(nc1)C 62a_100000210202_100000686985 [0,0,0,0,0,0|3,1,0]=4 160 B10R1.1 CCSc1cnc(nc1)C 62a_100000686985_100000210202 [0,0,0,0,0,0|3,1,0]=4 161 B10R1.1 CCSc1cnc(nc1)Cl 62a_100000059775_100000210202 [0,0,0,0,0,0|3,1,0]=4 162 B10R1.1 CCSc1cnc(nc1)Cl 62a_100000210202_100000059775 [0,0,0,0,0,0|3,1,0]=4 163 B10R1.1 CCSc1cnc(nc1)F 62a_100000210202_100000685262 [0,0,0,0,0,0|3,1,0]=4 164 B10R1.1 CCSc1cnc(nc1)F 62a_100000685262_100000210202 [0,0,0,0,0,0|3,1,0]=4 165 B10R1.1 CCSc1cnc(nc1)N 62a_100000210202_100000766020 [0,0,0,0,0,0|3,1,0]=4 166 B10R1.1 CCSc1cnc(nc1)N 62a_100000766020_100000210202 [0,0,0,0,0,0|3,1,0]=4 167 B10R1.1 CCSc1ncc(cn1)Br 62a_100000210202_100000690281 [0,0,0,0,0,0|3,1,0]=4 168 B10R1.1 CCSc1ncc(cn1)Br 62a_100000690281_100000210202 [0,0,0,0,0,0|3,1,0]=4 169 B10R1.1 CCSc1ncc(cn1)C 62a_100000061069_100000210202 [0,0,0,0,0,0|3,1,0]=4 170 B10R1.1 CCSc1ncc(cn1)C 62a_100000210202_100000061069 [0,0,0,0,0,0|3,1,0]=4 171 B10R1.1 CCSc1ncc(cn1)Cl 62a_100000210202_100011356929 [0,0,0,0,0,0|3,1,0]=4 172 B10R1.1 CCSc1ncc(cn1)Cl 62a_100011356929_100000210202 [0,0,0,0,0,0|3,1,0]=4 173 B10R1.1 CCSc1ncc(cn1)F 62a_100000210202_100000685220 [0,0,0,0,0,0|3,1,0]=4 174 B10R1.1 CCSc1ncc(cn1)F 62a_100000685220_100000210202 [0,0,0,0,0,0|3,1,0]=4 175 B10R1.1 CCSc1ncc(cn1)N 62a_100000068403_100000210202 [0,0,0,0,0,0|3,1,0]=4 176 B10R1.1 CCSc1ncc(cn1)N 62a_100000210202_100000068403 [0,0,0,0,0,0|3,1,0]=4 177 B10R1.1 CCSc1ncc(cn1)O 271570a_203496583355_200011939514 [0,0,0,0,0,0|2,1,0]=3 178 B10R1.1 CCSc1ncc(cn1)O 62a_100000210202_100000092845 [0,0,0,0,0,0|2,1,0]=3 179 B10R1.1 CCSc1ncc(cn1)O 62a_100000730009_100000210202 [0,0,0,0,0,0|2,1,0]=3 180 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [0,0,0,0,0,0|3,0,0]=3 181 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [0,0,0,0,0,0|3,0,0]=3 182 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [0,0,0,0,0,0|3,0,0]=3 183 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [0,0,0,0,0,0|3,0,0]=3 184 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [0,0,0,0,0,0|3,0,0]=3 185 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [0,0,0,0,0,0|3,0,0]=3 186 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [0,0,0,0,0,0|3,0,0]=3 187 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [0,0,0,0,0,0|3,0,0]=3 188 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [0,0,0,0,0,0|3,0,0]=3 189 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [0,0,0,0,0,0|3,0,0]=3 190 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [0,0,0,0,0,0|3,0,0]=3 191 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [0,0,0,0,0,0|3,0,0]=3 192 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [0,0,0,0,0,0|3,0,0]=3 193 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [0,0,0,0,0,0|3,0,0]=3 194 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [0,0,0,0,0,0|3,0,0]=3 195 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [0,0,0,0,0,0|3,0,0]=3 196 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [0,0,0,0,0,0|3,0,0]=3 197 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [0,0,0,0,0,0|3,0,0]=3 198 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [0,0,0,0,0,0|3,0,0]=3 199 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [0,0,0,0,0,0|3,0,0]=3 200 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [0,0,0,0,0,0|3,0,0]=3 201 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [0,0,0,0,0,0|3,0,0]=3 202 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [0,0,0,0,0,0|3,0,0]=3 203 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [0,0,0,0,0,0|3,0,0]=3 204 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [0,0,0,0,0,0|3,0,0]=3 205 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [0,0,0,0,0,0|3,0,0]=3 206 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [0,0,0,0,0,0|3,0,0]=3 207 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [0,0,0,0,0,0|3,0,0]=3 208 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [0,0,0,0,0,0|3,0,0]=3 209 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [0,0,0,0,0,0|3,0,0]=3 210 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [0,0,0,0,0,0|3,0,0]=3 211 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [0,0,0,0,0,0|3,0,0]=3 212 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [0,0,0,0,0,0|3,0,0]=3 213 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [0,0,0,0,0,0|3,0,0]=3 214 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [0,0,0,0,0,0|3,0,0]=3 215 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [0,0,0,0,0,0|3,0,0]=3 216 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [0,0,0,0,0,0|2,0,0]=2 217 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [0,0,0,0,0,0|2,0,0]=2 218 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [0,0,0,0,0,0|4,0,0]=4 219 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [0,0,0,0,0,0|4,0,0]=4 220 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [0,0,0,0,0,0|4,0,0]=4 221 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [0,0,0,0,0,0|4,0,0]=4 222 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [0,0,0,0,0,0|4,0,0]=4 223 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [0,0,0,0,0,0|4,0,0]=4 224 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [0,0,0,0,0,0|4,0,0]=4 225 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [0,0,0,0,0,0|4,0,0]=4 226 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [0,0,0,0,0,0|4,0,0]=4 227 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [0,0,0,0,0,0|4,0,0]=4 228 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [0,0,0,0,0,0|4,0,0]=4 229 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [0,0,0,0,0,0|4,0,0]=4 230 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [0,0,0,0,0,0|4,0,0]=4 231 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [0,0,0,0,0,0|4,0,0]=4 232 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [0,0,0,0,0,0|4,0,0]=4 233 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [0,0,0,0,0,0|4,0,0]=4 234 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [0,0,0,0,0,0|4,0,0]=4 235 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [0,0,0,0,0,0|4,0,0]=4 236 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [0,0,0,0,0,0|4,0,0]=4 237 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [0,0,0,0,0,0|4,0,0]=4 238 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [0,0,0,0,0,0|4,0,0]=4 239 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [0,0,0,0,0,0|4,0,0]=4 240 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [0,0,0,0,0,0|4,0,0]=4 241 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [0,0,0,0,0,0|4,0,0]=4 242 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [0,0,0,0,0,0|4,0,0]=4 243 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [0,0,0,0,0,0|4,0,0]=4 244 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [0,0,0,0,0,0|4,0,0]=4 245 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [0,0,0,0,0,0|4,0,0]=4 246 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [0,0,0,0,0,0|4,0,0]=4 247 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [0,0,0,0,0,0|4,0,0]=4 248 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [0,0,0,0,0,0|4,0,0]=4 249 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [0,0,0,0,0,0|4,0,0]=4 250 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [0,0,0,0,0,0|4,0,0]=4 251 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [0,0,0,0,0,0|4,0,0]=4 252 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [0,0,0,0,0,0|4,0,0]=4 253 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [0,0,0,0,0,0|4,0,0]=4 254 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [0,0,0,0,0,0|4,0,0]=4 255 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [0,0,0,0,0,0|4,0,0]=4 256 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [0,0,0,0,0,0|4,0,0]=4 257 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [0,0,0,0,0,0|4,0,0]=4 258 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [0,0,0,0,0,0|4,0,0]=4 259 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [0,0,0,0,0,0|4,0,0]=4 260 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [0,0,0,0,0,0|4,0,0]=4 261 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [0,0,0,0,0,0|4,0,0]=4 262 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [0,0,0,0,0,0|3,0,0]=3 263 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [0,0,0,0,0,0|3,0,0]=3 264 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [0,0,0,0,0,0|3,0,0]=3 265 B10R1.1 COCc1cc[n+](cc1)C 34a_100009831711_200000210301 [0,0,0,0,0,0|4,0,0]=4 266 B10R1.1 COCc1cc[n+](cc1)[O-] 34a_100000031831_200000210301 [0,0,0,0,0,0|3,0,1]=4 267 B10R1.1 COCc1cc[n+](cc1)[O-] 7a_100000031831_200000210301 [0,0,0,0,0,0|3,0,1]=4 268 B10R1.1 COCc1ccc(=O)[nH]c1 34a_100011999846_200000210301 [0,0,0,0,0,0|3,0,1]=4 269 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [0,0,0,0,0,0|3,0,0]=3 270 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [0,0,0,0,0,0|3,0,0]=3 271 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [0,0,0,0,0,0|3,0,0]=3 272 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [0,0,0,0,0,0|3,0,0]=3 273 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [0,0,0,0,0,0|3,0,0]=3 274 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [0,0,0,0,0,0|3,0,0]=3 275 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [0,0,0,0,0,0|3,0,0]=3 276 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [0,0,0,0,0,0|3,0,0]=3 277 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [0,0,0,0,0,0|3,0,0]=3 278 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [0,0,0,0,0,0|3,0,0]=3 279 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [0,0,0,0,0,0|3,0,0]=3 280 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [0,0,0,0,0,0|3,0,0]=3 281 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [0,0,0,0,0,0|3,0,0]=3 282 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [0,0,0,0,0,0|3,0,0]=3 283 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [0,0,0,0,0,0|3,0,0]=3 284 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [0,0,0,0,0,0|2,0,0]=2 285 B10R1.1 COCc1ccc(cn1)Br 34a_100000754261_200000210301 [0,0,0,0,0,0|4,0,0]=4 286 B10R1.1 COCc1ccc(cn1)Br 34a_100138415774_100000702658 [0,0,0,0,0,0|4,0,0]=4 287 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [0,0,0,0,0,0|4,0,0]=4 288 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [0,0,0,0,0,0|4,0,0]=4 289 B10R1.1 COCc1ccc(cn1)Cl 34a_100000703999_200000210301 [0,0,0,0,0,0|4,0,0]=4 290 B10R1.1 COCc1ccc(cn1)Cl 34a_100138415774_100012066911 [0,0,0,0,0,0|4,0,0]=4 291 B10R1.1 COCc1ccc(cn1)F 34a_100011999454_200000210301 [0,0,0,0,0,0|4,0,0]=4 292 B10R1.1 COCc1ccc(cn1)F 34a_100138415774_100000703193 [0,0,0,0,0,0|4,0,0]=4 293 B10R1.1 COCc1ccc(cn1)N 34a_100011998161_200000210301 [0,0,0,0,0,0|4,0,0]=4 294 B10R1.1 COCc1ccc(nc1)Br 34a_100009816760_200000210301 [0,0,0,0,0,0|4,0,0]=4 295 B10R1.1 COCc1ccc(nc1)Br 34a_100138415774_100009831999 [0,0,0,0,0,0|4,0,0]=4 296 B10R1.1 COCc1ccc(nc1)Br 7a_100009816760_200000210301 [0,0,0,0,0,0|4,0,0]=4 297 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [0,0,0,0,0,0|4,0,0]=4 298 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [0,0,0,0,0,0|4,0,0]=4 299 B10R1.1 COCc1ccc(nc1)Cl 34a_100000755211_200000210301 [0,0,0,0,0,0|4,0,0]=4 300 B10R1.1 COCc1ccc(nc1)Cl 34a_100138415774_100000735431 [0,0,0,0,0,0|4,0,0]=4 301 B10R1.1 COCc1ccc(nc1)Cl 7a_100000755211_200000210301 [0,0,0,0,0,0|4,0,0]=4 302 B10R1.1 COCc1ccc(nc1)F 34a_100000079959_200000210301 [0,0,0,0,0,0|4,0,0]=4 303 B10R1.1 COCc1ccc(nc1)F 34a_100138415774_100000099788 [0,0,0,0,0,0|4,0,0]=4 304 B10R1.1 COCc1ccc(nc1)N 34a_100000704267_200000210301 [0,0,0,0,0,0|4,0,0]=4 305 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [0,0,0,0,0,0|3,0,0]=3 306 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [0,0,0,0,0,0|3,0,0]=3 307 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [0,0,0,0,0,0|3,0,0]=3 308 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [0,0,0,0,0,0|3,0,0]=3 309 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [0,0,0,0,0,0|3,0,0]=3 310 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [0,0,0,0,0,0|3,0,0]=3 311 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [0,0,0,0,0,0|3,0,0]=3 312 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [0,0,0,0,0,0|3,0,0]=3 313 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [0,0,0,0,0,0|3,0,0]=3 314 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [0,0,0,0,0,0|3,0,0]=3 315 B10R1.1 CSCc1ccc(cn1)Br 62a_100000702658_200000210301 [0,0,0,0,0,0|4,0,0]=4 316 B10R1.1 CSCc1ccc(cn1)Br 62a_200000210301_100000702658 [0,0,0,0,0,0|4,0,0]=4 317 B10R1.1 CSCc1ccc(cn1)C 62a_100000691093_200000210301 [0,0,0,0,0,0|4,0,0]=4 318 B10R1.1 CSCc1ccc(cn1)C 62a_200000210301_100000691093 [0,0,0,0,0,0|4,0,0]=4 319 B10R1.1 CSCc1ccc(cn1)Cl 62a_100012066911_200000210301 [0,0,0,0,0,0|4,0,0]=4 320 B10R1.1 CSCc1ccc(cn1)Cl 62a_200000210301_100000697101 [0,0,0,0,0,0|4,0,0]=4 321 B10R1.1 CSCc1ccc(cn1)F 62a_100000703193_200000210301 [0,0,0,0,0,0|4,0,0]=4 322 B10R1.1 CSCc1ccc(cn1)F 62a_200000210301_100000703193 [0,0,0,0,0,0|4,0,0]=4 323 B10R1.1 CSCc1ccc(nc1)Br 62a_100009831999_200000210301 [0,0,0,0,0,0|4,0,0]=4 324 B10R1.1 CSCc1ccc(nc1)Br 62a_200000210301_100009831999 [0,0,0,0,0,0|4,0,0]=4 325 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [0,0,0,0,0,0|4,0,0]=4 326 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [0,0,0,0,0,0|4,0,0]=4 327 B10R1.1 CSCc1ccc(nc1)Cl 62a_100000735431_200000210301 [0,0,0,0,0,0|4,0,0]=4 328 B10R1.1 CSCc1ccc(nc1)Cl 62a_200000210301_100000735431 [0,0,0,0,0,0|4,0,0]=4 329 B10R1.1 CSCc1ccc(nc1)F 62a_100009820150_200000210301 [0,0,0,0,0,0|4,0,0]=4 330 B10R1.1 CSCc1ccc(nc1)F 62a_200000210301_100000099788 [0,0,0,0,0,0|4,0,0]=4 331 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [0,0,0,0,0,0|3,0,0]=3 332 B10R1.1 C[n+]1ccc(cc1)CO[13CH3] 34a_100009831711_200025704644 [0,0,0,0,0,0|4,0,0]=4 333 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [0,0,0,0,0,0|3,0,0]=3 334 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [0,0,0,0,0,0|3,0,0]=3 335 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [0,0,0,0,0,0|3,0,0]=3 336 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [0,0,0,0,0,0|3,0,0]=3 337 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [0,0,0,0,0,0|3,0,0]=3 338 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [0,0,0,0,0,0|3,0,0]=3 339 B10R1.1 Cc1ccc(cc1)NCF 34a_100000124888_100015361967 [0,0,0,0,0,0|3,0,0]=3 340 B10R1.1 Cc1ccc(cc1)OCF 34a_100000210336_100015361967 [0,0,0,0,0,0|2,0,0]=2 341 B10R1.1 Cc1ccc(cc1)OCF 7a_100000210336_100015361967 [0,0,0,0,0,0|2,0,0]=2 342 B10R1.1 Cc1ccc(cc1)SCF 62a_100000186775_100015361967 [0,0,0,0,0,0|2,1,0]=3 343 B10R1.1 Cc1ccc(cc1)SCF 62a_100015361967_100000186775 [0,0,0,0,0,0|2,1,0]=3 344 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [0,0,0,0,0,0|4,0,0]=4 345 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [0,0,0,0,0,0|4,0,0]=4 346 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [0,0,0,0,0,0|4,0,0]=4 347 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [0,0,0,0,0,0|4,0,0]=4 348 B10R1.1 Cc1ccc(cn1)OCF 34a_100000745506_100015361967 [0,0,0,0,0,0|3,0,0]=3 349 B10R1.1 Cc1ccc(cn1)OCF 7a_100000745506_100015361967 [0,0,0,0,0,0|3,0,0]=3 350 B10R1.1 Cc1ccc(cn1)SCF 62a_100000751577_100015361967 [0,0,0,0,0,0|3,1,0]=4 351 B10R1.1 Cc1ccc(cn1)SCF 62a_100015361967_100000751577 [0,0,0,0,0,0|3,1,0]=4 352 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [0,0,0,0,0,0|4,0,0]=4 353 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [0,0,0,0,0,0|4,0,0]=4 354 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_100000691093_200025704644 [0,0,0,0,0,0|4,0,0]=4 355 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_200025704644_100000691093 [0,0,0,0,0,0|4,0,0]=4 356 B10R1.1 Cc1ccc(nc1)OCF 34a_100000759353_100015361967 [0,0,0,0,0,0|3,0,0]=3 357 B10R1.1 Cc1ccc(nc1)SCF 62a_100011192072_100015361967 [0,0,0,0,0,0|3,1,0]=4 358 B10R1.1 Cc1ccc(nc1)SCF 62a_100015361967_100000754016 [0,0,0,0,0,0|3,1,0]=4 359 B10R1.1 Cc1ncc(cn1)OCF 34a_100000062939_100015361967 [0,0,0,0,0,0|4,0,0]=4 360 B10R1.1 Cc1ncc(cn1)OCF 7a_100000062939_100015361967 [0,0,0,0,0,0|4,0,0]=4 361 B10R1.1 FCNc1ccc(cc1)Br 34a_100000210018_100015361967 [0,0,0,0,0,0|3,0,0]=3 362 B10R1.1 FCNc1ccc(cc1)Cl 34a_100000210052_100015361967 [0,0,0,0,0,0|3,0,0]=3 363 B10R1.1 FCNc1ccc(cc1)F 34a_100000185862_100015361967 [0,0,0,0,0,0|3,0,0]=3 364 B10R1.1 FCNc1ccc(cc1)I 34a_100000185761_100015361967 [0,0,0,0,0,0|3,0,0]=3 365 B10R1.1 FCOc1ccc(cc1)Br 34a_100000185759_100015361967 [0,0,0,0,0,0|2,0,0]=2 366 B10R1.1 FCOc1ccc(cc1)Br 7a_100000185759_100015361967 [0,0,0,0,0,0|2,0,0]=2 367 B10R1.1 FCOc1ccc(cc1)Cl 34a_100000210216_100015361967 [0,0,0,0,0,0|2,0,0]=2 368 B10R1.1 FCOc1ccc(cc1)Cl 7a_100000210216_100015361967 [0,0,0,0,0,0|2,0,0]=2 369 B10R1.1 FCOc1ccc(cc1)F 34a_100000210339_100015361967 [0,0,0,0,0,0|2,0,0]=2 370 B10R1.1 FCOc1ccc(cc1)I 34a_100000212066_100015361967 [0,0,0,0,0,0|2,0,0]=2 371 B10R1.1 FCOc1ccc(cc1)I 7a_100000212066_100015361967 [0,0,0,0,0,0|2,0,0]=2 372 B10R1.1 FCOc1ccc(cn1)Cl 34a_100011215309_100015361967 [0,0,0,0,0,0|3,0,0]=3 373 B10R1.1 FCOc1ccc(cn1)F 34a_100000742473_100015361967 [0,0,0,0,0,0|3,0,0]=3 374 B10R1.1 FCOc1ccc(nc1)Br 34a_100000685995_100015361967 [0,0,0,0,0,0|3,0,0]=3 375 B10R1.1 FCOc1ccc(nc1)Br 7a_100000685995_100015361967 [0,0,0,0,0,0|3,0,0]=3 376 B10R1.1 FCOc1ccc(nc1)Cl 34a_100000744096_100015361967 [0,0,0,0,0,0|3,0,0]=3 377 B10R1.1 FCOc1ccc(nc1)Cl 7a_100000744096_100015361967 [0,0,0,0,0,0|3,0,0]=3 378 B10R1.1 FCOc1ccc(nc1)F 34a_100000688820_100015361967 [0,0,0,0,0,0|3,0,0]=3 379 B10R1.1 FCOc1ccc(nc1)F 7a_100000688820_100015361967 [0,0,0,0,0,0|3,0,0]=3 380 B10R1.1 FCOc1ccc(nc1)I 34a_100000687607_100015361967 [0,0,0,0,0,0|3,0,0]=3 381 B10R1.1 FCOc1ccc(nc1)I 7a_100000687607_100015361967 [0,0,0,0,0,0|3,0,0]=3 382 B10R1.1 FCOc1cnc(cn1)Br 34a_100011934580_100015361967 [0,0,0,0,0,0|4,0,0]=4 383 B10R1.1 FCOc1cnc(cn1)Cl 34a_100015839800_100015361967 [0,0,0,0,0,0|4,0,0]=4 384 B10R1.1 FCOc1cnc(nc1)Br 34a_100000730009_100015361967 [0,0,0,0,0,0|4,0,0]=4 385 B10R1.1 FCOc1cnc(nc1)Br 7a_100000730009_100015361967 [0,0,0,0,0,0|4,0,0]=4 386 B10R1.1 FCOc1cnc(nc1)Cl 34a_100000092845_100015361967 [0,0,0,0,0,0|4,0,0]=4 387 B10R1.1 FCOc1cnc(nc1)Cl 7a_100000092845_100015361967 [0,0,0,0,0,0|4,0,0]=4 388 B10R1.1 FCOc1cnc(nc1)F 34a_200009874573_100015361967 [0,0,0,0,0,0|4,0,0]=4 389 B10R1.1 FCOc1cnc(nc1)F 7a_200009874573_100015361967 [0,0,0,0,0,0|4,0,0]=4 390 B10R1.1 FCOc1ncc(cn1)F 34a_100011934040_100015361967 [0,0,0,0,0,0|4,0,0]=4 391 B10R1.1 FCSc1ccc(cc1)Br 62a_100000752885_100015361967 [0,0,0,0,0,0|2,1,0]=3 392 B10R1.1 FCSc1ccc(cc1)Br 62a_100015361967_100000752885 [0,0,0,0,0,0|2,1,0]=3 393 B10R1.1 FCSc1ccc(cc1)Cl 62a_100000755918_100015361967 [0,0,0,0,0,0|2,1,0]=3 394 B10R1.1 FCSc1ccc(cc1)Cl 62a_100015361967_100000755918 [0,0,0,0,0,0|2,1,0]=3 395 B10R1.1 FCSc1ccc(cc1)F 62a_100000211213_100015361967 [0,0,0,0,0,0|2,1,0]=3 396 B10R1.1 FCSc1ccc(cc1)F 62a_100015361967_100000211213 [0,0,0,0,0,0|2,1,0]=3 397 B10R1.1 FCSc1ccc(cn1)Br 62a_100000686858_100015361967 [0,0,0,0,0,0|3,1,0]=4 398 B10R1.1 FCSc1ccc(cn1)Br 62a_100015361967_100000686858 [0,0,0,0,0,0|3,1,0]=4 399 B10R1.1 FCSc1ccc(cn1)Cl 62a_100011356976_100015361967 [0,0,0,0,0,0|3,1,0]=4 400 B10R1.1 FCSc1ccc(cn1)Cl 62a_100015361967_100011356976 [0,0,0,0,0,0|3,1,0]=4 401 B10R1.1 FCSc1ccc(cn1)F 62a_100000744514_100015361967 [0,0,0,0,0,0|3,1,0]=4 402 B10R1.1 FCSc1ccc(cn1)F 62a_100015361967_100000744514 [0,0,0,0,0,0|3,1,0]=4 403 B10R1.1 FCSc1ccc(nc1)Br 62a_100009814638_100015361967 [0,0,0,0,0,0|3,1,0]=4 404 B10R1.1 FCSc1ccc(nc1)Br 62a_100015361967_100009814638 [0,0,0,0,0,0|3,1,0]=4 405 B10R1.1 FCSc1ccc(nc1)Cl 62a_100000034144_100015361967 [0,0,0,0,0,0|3,1,0]=4 406 B10R1.1 FCSc1ccc(nc1)Cl 62a_100015361967_100000034144 [0,0,0,0,0,0|3,1,0]=4 407 B10R1.1 FCSc1ccc(nc1)F 62a_100000042367_100015361967 [0,0,0,0,0,0|3,1,0]=4 408 B10R1.1 FCSc1ccc(nc1)F 62a_100015361967_100000042367 [0,0,0,0,0,0|3,1,0]=4 409 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [0,0,0,0,0,0|2,0,1]=3 410 B10R1.1 N#CCc1ccc(cn1)O 271570a_203496583355_100011824422 [0,0,0,0,0,0|3,0,1]=4 411 B10R1.1 N#CCc1ccc(nc1)O 271570a_203496583355_100000703598 [0,0,0,0,0,0|3,0,1]=4 412 B10R1.1 N#CNc1ccc(cc1)O 271570a_203496583355_100011685341 [0,0,0,0,0,0|2,0,1]=3 413 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [0,0,0,0,0,0|2,0,0]=2 414 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [0,0,0,0,0,0|3,0,0]=3 415 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [0,0,0,0,0,0|4,0,0]=4 416 B10R1.1 Nc1ccc(cc1)OCF 34a_100000185829_100015361967 [0,0,0,0,0,0|2,0,0]=2 417 B10R1.1 Nc1ccc(cc1)SCF 62a_100000185761_100015361967 [0,0,0,0,0,0|2,1,0]=3 418 B10R1.1 Nc1ccc(cc1)SCF 62a_100015361967_100000185761 [0,0,0,0,0,0|2,1,0]=3 419 B10R1.1 Nc1ccc(cn1)OCF 34a_100015188713_100015361967 [0,0,0,0,0,0|3,0,0]=3 420 B10R1.1 Nc1ccc(cn1)OCF 7a_100015188713_100015361967 [0,0,0,0,0,0|3,0,0]=3 421 B10R1.1 Nc1ccc(cn1)SCF 62a_100000187370_100015361967 [0,0,0,0,0,0|3,1,0]=4 422 B10R1.1 Nc1ccc(cn1)SCF 62a_100015361967_100000187370 [0,0,0,0,0,0|3,1,0]=4 423 B10R1.1 Nc1ccc(nc1)OCF 34a_100000729260_100015361967 [0,0,0,0,0,0|3,0,0]=3 424 B10R1.1 Nc1ccc(nc1)SCF 62a_100000737798_100015361967 [0,0,0,0,0,0|3,1,0]=4 425 B10R1.1 Nc1ccc(nc1)SCF 62a_100015361967_100000737798 [0,0,0,0,0,0|3,1,0]=4 426 B10R1.1 Nc1ncc(cn1)OCF 34a_100000087137_100015361967 [0,0,0,0,0,0|4,0,0]=4 427 B10R1.1 Nc1ncc(cn1)OCF 7a_100000087137_100015361967 [0,0,0,0,0,0|4,0,0]=4 428 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [0,0,0,0,0,0|2,0,1]=3 429 B10R1.1 O=c1ccc(c[nH]1)OCF 34a_100000075641_100015361967 [0,0,0,0,0,0|2,0,1]=3 430 B10R1.1 O=c1ccc(c[nH]1)SCF 62a_100000212171_100015361967 [0,0,0,0,0,0|2,1,1]=4 431 B10R1.1 O=c1ccc(c[nH]1)SCF 62a_100015361967_100000212171 [0,0,0,0,0,0|2,1,1]=4 432 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [0,0,0,0,0,0|2,0,0]=2 433 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [0,0,0,0,0,0|3,0,0]=3 434 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [0,0,0,0,0,0|3,0,0]=3 435 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [0,0,0,0,0,0|2,0,1]=3 436 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [0,0,0,0,0,0|2,0,0]=2 437 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [0,0,0,0,0,0|1,1,0]=2 438 B10R1.1 Oc1ccc(nc1)SCF 62a_100000685995_100015361967 [0,0,0,0,0,0|2,1,0]=3 439 B10R1.1 Oc1ccc(nc1)SCF 62a_100015361967_100000744096 [0,0,0,0,0,0|2,1,0]=3 440 B10R1.1 Oc1cnc(cn1)SCF 62a_100011934580_100015361967 [0,0,0,0,0,0|3,1,0]=4 441 B10R1.1 Oc1cnc(cn1)SCF 62a_100015361967_100015839800 [0,0,0,0,0,0|3,1,0]=4 442 B10R1.1 Oc1cnc(nc1)SCF 62a_100000730009_100015361967 [0,0,0,0,0,0|3,1,0]=4 443 B10R1.1 Oc1cnc(nc1)SCF 62a_100015361967_100000092845 [0,0,0,0,0,0|3,1,0]=4 444 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [0,0,0,0,0,0|3,0,0]=3 445 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [0,0,0,0,0,0|3,0,0]=3 446 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [0,0,0,0,0,0|3,0,0]=3 447 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [0,0,0,0,0,0|3,0,0]=3 448 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [0,0,0,0,0,0|3,0,0]=3 449 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [0,0,0,0,0,0|3,0,0]=3 450 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [0,0,0,0,0,0|3,0,0]=3 451 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [0,0,0,0,0,0|3,0,0]=3 452 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [0,0,0,0,0,0|2,0,0]=2 453 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [0,0,0,0,0,0|4,0,0]=4 454 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [0,0,0,0,0,0|4,0,0]=4 455 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [0,0,0,0,0,0|4,0,0]=4 456 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [0,0,0,0,0,0|4,0,0]=4 457 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [0,0,0,0,0,0|4,0,0]=4 458 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [0,0,0,0,0,0|4,0,0]=4 459 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [0,0,0,0,0,0|4,0,0]=4 460 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [0,0,0,0,0,0|4,0,0]=4 461 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [0,0,0,0,0,0|4,0,0]=4 462 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [0,0,0,0,0,0|3,0,0]=3 463 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 34a_100000031831_200025704644 [0,0,0,0,0,0|3,0,1]=4 464 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 7a_100000031831_200025704644 [0,0,0,0,0,0|3,0,1]=4 465 B10R1.1 [13CH3]OCc1ccc(=O)[nH]c1 34a_100011999846_200025704644 [0,0,0,0,0,0|3,0,1]=4 466 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [0,0,0,0,0,0|3,0,0]=3 467 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [0,0,0,0,0,0|3,0,0]=3 468 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [0,0,0,0,0,0|3,0,0]=3 469 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [0,0,0,0,0,0|3,0,0]=3 470 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [0,0,0,0,0,0|3,0,0]=3 471 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [0,0,0,0,0,0|3,0,0]=3 472 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [0,0,0,0,0,0|3,0,0]=3 473 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [0,0,0,0,0,0|3,0,0]=3 474 B10R1.1 [13CH3]OCc1ccc(cn1)Br 34a_100000754261_200025704644 [0,0,0,0,0,0|4,0,0]=4 475 B10R1.1 [13CH3]OCc1ccc(cn1)Cl 34a_100000703999_200025704644 [0,0,0,0,0,0|4,0,0]=4 476 B10R1.1 [13CH3]OCc1ccc(cn1)F 34a_100011999454_200025704644 [0,0,0,0,0,0|4,0,0]=4 477 B10R1.1 [13CH3]OCc1ccc(cn1)N 34a_100011998161_200025704644 [0,0,0,0,0,0|4,0,0]=4 478 B10R1.1 [13CH3]OCc1ccc(nc1)Br 34a_100009816760_200025704644 [0,0,0,0,0,0|4,0,0]=4 479 B10R1.1 [13CH3]OCc1ccc(nc1)Br 7a_100009816760_200025704644 [0,0,0,0,0,0|4,0,0]=4 480 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 34a_100000755211_200025704644 [0,0,0,0,0,0|4,0,0]=4 481 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 7a_100000755211_200025704644 [0,0,0,0,0,0|4,0,0]=4 482 B10R1.1 [13CH3]OCc1ccc(nc1)F 34a_100000079959_200025704644 [0,0,0,0,0,0|4,0,0]=4 483 B10R1.1 [13CH3]OCc1ccc(nc1)N 34a_100000704267_200025704644 [0,0,0,0,0,0|4,0,0]=4 484 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [0,0,0,0,0,0|3,0,0]=3 485 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [0,0,0,0,0,0|3,0,0]=3 486 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [0,0,0,0,0,0|3,0,0]=3 487 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [0,0,0,0,0,0|3,0,0]=3 488 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [0,0,0,0,0,0|3,0,0]=3 489 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [0,0,0,0,0,0|3,0,0]=3 490 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [0,0,0,0,0,0|3,0,0]=3 491 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [0,0,0,0,0,0|3,0,0]=3 492 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_100000702658_200025704644 [0,0,0,0,0,0|4,0,0]=4 493 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_200025704644_100000702658 [0,0,0,0,0,0|4,0,0]=4 494 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_100012066911_200025704644 [0,0,0,0,0,0|4,0,0]=4 495 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_200025704644_100000697101 [0,0,0,0,0,0|4,0,0]=4 496 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_100000703193_200025704644 [0,0,0,0,0,0|4,0,0]=4 497 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_200025704644_100000703193 [0,0,0,0,0,0|4,0,0]=4 498 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_100009831999_200025704644 [0,0,0,0,0,0|4,0,0]=4 499 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_200025704644_100009831999 [0,0,0,0,0,0|4,0,0]=4 500 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_100000735431_200025704644 [0,0,0,0,0,0|4,0,0]=4 501 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_200025704644_100000735431 [0,0,0,0,0,0|4,0,0]=4 502 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_100009820150_200025704644 [0,0,0,0,0,0|4,0,0]=4 503 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_200025704644_100000099788 [0,0,0,0,0,0|4,0,0]=4 504 B10R1.1 [N-]=[N+]=Nc1ccc(cc1)O 271570a_203496583355_100000735661 [0,0,0,0,0,0|3,0,0]=3 505 B10R1.1 [O-][n+]1ccc(cc1)SCF 62a_100015361967_100000039755 [0,0,0,0,0,0|2,1,1]=4 506 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [1,0,0,0,0,0|1,0,2]=4 507 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [1,0,0,0,0,0|1,0,2]=4 508 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [1,0,0,0,0,0|1,0,2]=4 509 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [1,0,0,0,0,0|1,0,2]=4 510 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [1,0,0,0,0,0|1,0,2]=4 511 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [1,0,0,0,0,0|0,0,2]=3 512 B9R1.1 C=Cc1ccc(cn1)O 271570a_100011290941_100000685995 [1,0,0,0,0,0|1,0,2]=4 513 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [1,0,0,0,0,0|0,0,0]=1 514 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [1,0,0,0,0,0|1,0,0]=2 515 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [1,0,0,0,0,0|1,0,0]=2 516 B9R1.1 CCc1cnc(nc1)O 271570a_203496583355_100000033099 [1,0,0,0,0,0|2,0,0]=3 517 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [1,0,0,0,0,0|2,0,0]=3 518 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [1,0,0,0,0,0|2,0,0]=3 519 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [1,0,0,0,0,0|2,0,0]=3 520 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [1,0,0,0,0,0|2,0,0]=3 521 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [1,0,0,0,0,0|2,0,0]=3 522 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [1,0,0,0,0,0|2,0,0]=3 523 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [1,0,0,0,0,0|2,0,0]=3 524 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [1,0,0,0,0,0|1,0,0]=2 525 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [1,0,0,0,0,0|1,0,0]=2 526 B9R1.1 CNc1ccc(cn1)Br 27a_100102657272_100000686858 [1,0,0,0,0,0|3,0,0]=4 527 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [1,0,0,0,0,0|2,0,0]=3 528 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [1,0,0,0,0,0|2,0,0]=3 529 B9R1.1 CNc1ccc(nn1)O 271570a_203496583355_100000215272 [1,0,0,0,0,0|3,0,0]=4 530 B9R1.1 CNc1cnc(cn1)O 271570a_203496583355_100012000640 [1,0,0,0,0,0|3,0,0]=4 531 B9R1.1 CNc1ncc(cn1)O 271570a_203496583355_100000697329 [1,0,0,0,0,0|3,0,0]=4 532 B9R1.1 COc1ccc(=O)[nH]c1 34a_100000075641_200000210301 [1,0,0,0,0,0|1,0,1]=3 533 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [1,0,0,0,0,0|1,0,0]=2 534 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [1,0,0,0,0,0|1,0,0]=2 535 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [1,0,0,0,0,0|1,0,0]=2 536 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [1,0,0,0,0,0|1,0,0]=2 537 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [1,0,0,0,0,0|1,0,0]=2 538 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [1,0,0,0,0,0|1,0,0]=2 539 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [1,0,0,0,0,0|1,0,0]=2 540 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [1,0,0,0,0,0|1,0,0]=2 541 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [1,0,0,0,0,0|1,0,0]=2 542 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [1,0,0,0,0,0|1,0,0]=2 543 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [1,0,0,0,0,0|0,0,0]=1 544 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [1,0,0,0,0,0|2,0,0]=3 545 B9R1.1 COc1ccc(cn1)Cl 34a_100011215309_200000210301 [1,0,0,0,0,0|2,0,0]=3 546 B9R1.1 COc1ccc(cn1)F 34a_100000742473_200000210301 [1,0,0,0,0,0|2,0,0]=3 547 B9R1.1 COc1ccc(cn1)N 34a_100000729260_200000210301 [1,0,0,0,0,0|2,0,0]=3 548 B9R1.1 COc1ccc(cn1)O 271570a_203496583355_100000047065 [1,0,0,0,0,0|1,0,0]=2 549 B9R1.1 COc1ccc(nc1)Br 34a_100000685995_200000210301 [1,0,0,0,0,0|2,0,0]=3 550 B9R1.1 COc1ccc(nc1)Br 7a_100000685995_200000210301 [1,0,0,0,0,0|2,0,0]=3 551 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,0,0,0,0,0|2,0,0]=3 552 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,0,0,0,0,0|2,0,0]=3 553 B9R1.1 COc1ccc(nc1)Cl 34a_100000744096_200000210301 [1,0,0,0,0,0|2,0,0]=3 554 B9R1.1 COc1ccc(nc1)Cl 7a_100000744096_200000210301 [1,0,0,0,0,0|2,0,0]=3 555 B9R1.1 COc1ccc(nc1)F 34a_100000688820_200000210301 [1,0,0,0,0,0|2,0,0]=3 556 B9R1.1 COc1ccc(nc1)F 7a_100000688820_200000210301 [1,0,0,0,0,0|2,0,0]=3 557 B9R1.1 COc1ccc(nc1)I 34a_100000687607_200000210301 [1,0,0,0,0,0|2,0,0]=3 558 B9R1.1 COc1ccc(nc1)I 7a_100000687607_200000210301 [1,0,0,0,0,0|2,0,0]=3 559 B9R1.1 COc1ccc(nc1)N 34a_100015188713_200000210301 [1,0,0,0,0,0|2,0,0]=3 560 B9R1.1 COc1ccc(nc1)N 7a_100015188713_200000210301 [1,0,0,0,0,0|2,0,0]=3 561 B9R1.1 COc1ccc(nc1)O 271570a_203496583355_100000755202 [1,0,0,0,0,0|1,0,0]=2 562 B9R1.1 COc1ccc(nn1)O 271570a_203496583355_100009819040 [1,0,0,0,0,0|2,0,0]=3 563 B9R1.1 COc1cnc(cn1)Br 34a_100011934580_200000210301 [1,0,0,0,0,0|3,0,0]=4 564 B9R1.1 COc1cnc(cn1)Cl 34a_100015839800_200000210301 [1,0,0,0,0,0|3,0,0]=4 565 B9R1.1 COc1cnc(cn1)O 271570a_203496583355_100011998698 [1,0,0,0,0,0|2,0,0]=3 566 B9R1.1 COc1cnc(nc1)Br 34a_100000730009_200000210301 [1,0,0,0,0,0|3,0,0]=4 567 B9R1.1 COc1cnc(nc1)Br 7a_100000730009_200000210301 [1,0,0,0,0,0|3,0,0]=4 568 B9R1.1 COc1cnc(nc1)C 34a_100000062939_200000210301 [1,0,0,0,0,0|3,0,0]=4 569 B9R1.1 COc1cnc(nc1)C 7a_100000062939_200000210301 [1,0,0,0,0,0|3,0,0]=4 570 B9R1.1 COc1cnc(nc1)Cl 34a_100000092845_200000210301 [1,0,0,0,0,0|3,0,0]=4 571 B9R1.1 COc1cnc(nc1)Cl 7a_100000092845_200000210301 [1,0,0,0,0,0|3,0,0]=4 572 B9R1.1 COc1cnc(nc1)F 34a_200009874573_200000210301 [1,0,0,0,0,0|3,0,0]=4 573 B9R1.1 COc1cnc(nc1)F 7a_200009874573_200000210301 [1,0,0,0,0,0|3,0,0]=4 574 B9R1.1 COc1cnc(nc1)N 34a_100000087137_200000210301 [1,0,0,0,0,0|3,0,0]=4 575 B9R1.1 COc1cnc(nc1)N 7a_100000087137_200000210301 [1,0,0,0,0,0|3,0,0]=4 576 B9R1.1 COc1cnc(nc1)O 271570a_203496583355_100000069167 [1,0,0,0,0,0|2,0,0]=3 577 B9R1.1 COc1ncc(cn1)F 34a_100011934040_200000210301 [1,0,0,0,0,0|3,0,0]=4 578 B9R1.1 COc1ncc(cn1)O 271570a_203496583355_100000686852 [1,0,0,0,0,0|2,0,0]=3 579 B9R1.1 CSc1cc[n+](cc1)[O-] 62a_200000210301_100000039755 [1,0,0,0,0,0|1,1,1]=4 580 B9R1.1 CSc1ccc(=O)[nH]c1 62a_100000212171_200000210301 [1,0,0,0,0,0|1,1,1]=4 581 B9R1.1 CSc1ccc(=O)[nH]c1 62a_200000210301_100000212171 [1,0,0,0,0,0|1,1,1]=4 582 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [1,0,0,0,0,0|1,1,0]=3 583 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [1,0,0,0,0,0|1,1,0]=3 584 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [1,0,0,0,0,0|1,1,0]=3 585 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [1,0,0,0,0,0|1,1,0]=3 586 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [1,0,0,0,0,0|1,1,0]=3 587 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [1,0,0,0,0,0|1,1,0]=3 588 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [1,0,0,0,0,0|1,1,0]=3 589 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [1,0,0,0,0,0|1,1,0]=3 590 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [1,0,0,0,0,0|1,1,0]=3 591 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [1,0,0,0,0,0|1,1,0]=3 592 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [1,0,0,0,0,0|0,1,0]=2 593 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [1,0,0,0,0,0|0,1,0]=2 594 B9R1.1 CSc1ccc(cn1)Br 62a_100000686858_200000210301 [1,0,0,0,0,0|2,1,0]=4 595 B9R1.1 CSc1ccc(cn1)Br 62a_200000210301_100000686858 [1,0,0,0,0,0|2,1,0]=4 596 B9R1.1 CSc1ccc(cn1)C 62a_100011192072_200000210301 [1,0,0,0,0,0|2,1,0]=4 597 B9R1.1 CSc1ccc(cn1)C 62a_200000210301_100000754016 [1,0,0,0,0,0|2,1,0]=4 598 B9R1.1 CSc1ccc(cn1)Cl 62a_100011356976_200000210301 [1,0,0,0,0,0|2,1,0]=4 599 B9R1.1 CSc1ccc(cn1)Cl 62a_200000210301_100011356976 [1,0,0,0,0,0|2,1,0]=4 600 B9R1.1 CSc1ccc(cn1)F 62a_100000744514_200000210301 [1,0,0,0,0,0|2,1,0]=4 601 B9R1.1 CSc1ccc(cn1)F 62a_200000210301_100000744514 [1,0,0,0,0,0|2,1,0]=4 602 B9R1.1 CSc1ccc(cn1)N 62a_100000737798_200000210301 [1,0,0,0,0,0|2,1,0]=4 603 B9R1.1 CSc1ccc(cn1)N 62a_200000210301_100000737798 [1,0,0,0,0,0|2,1,0]=4 604 B9R1.1 CSc1ccc(cn1)O 271570a_203496583355_100011408404 [1,0,0,0,0,0|1,1,0]=3 605 B9R1.1 CSc1ccc(cn1)O 62a_100000685995_200000210301 [1,0,0,0,0,0|1,1,0]=3 606 B9R1.1 CSc1ccc(cn1)O 62a_200000210301_100000744096 [1,0,0,0,0,0|1,1,0]=3 607 B9R1.1 CSc1ccc(nc1)Br 62a_100009814638_200000210301 [1,0,0,0,0,0|2,1,0]=4 608 B9R1.1 CSc1ccc(nc1)Br 62a_200000210301_100009814638 [1,0,0,0,0,0|2,1,0]=4 609 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,0,0,0,0,0|2,1,0]=4 610 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,0,0,0,0,0|2,1,0]=4 611 B9R1.1 CSc1ccc(nc1)Cl 62a_100000034144_200000210301 [1,0,0,0,0,0|2,1,0]=4 612 B9R1.1 CSc1ccc(nc1)Cl 62a_200000210301_100000034144 [1,0,0,0,0,0|2,1,0]=4 613 B9R1.1 CSc1ccc(nc1)F 62a_100000042367_200000210301 [1,0,0,0,0,0|2,1,0]=4 614 B9R1.1 CSc1ccc(nc1)F 62a_200000210301_100000042367 [1,0,0,0,0,0|2,1,0]=4 615 B9R1.1 CSc1ccc(nc1)N 62a_100000187370_200000210301 [1,0,0,0,0,0|2,1,0]=4 616 B9R1.1 CSc1ccc(nc1)N 62a_200000210301_100000187370 [1,0,0,0,0,0|2,1,0]=4 617 B9R1.1 CSc1ccc(nc1)O 271570a_203496583355_100009820866 [1,0,0,0,0,0|1,1,0]=3 618 B9R1.1 CSc1cnc(cn1)O 271570a_203496583355_200012356277 [1,0,0,0,0,0|2,1,0]=4 619 B9R1.1 CSc1cnc(cn1)O 62a_100011934580_200000210301 [1,0,0,0,0,0|2,1,0]=4 620 B9R1.1 CSc1cnc(cn1)O 62a_200000210301_100015839800 [1,0,0,0,0,0|2,1,0]=4 621 B9R1.1 CSc1cnc(nc1)O 271570a_203496583355_100000718988 [1,0,0,0,0,0|2,1,0]=4 622 B9R1.1 CSc1ncc(cn1)O 271570a_203496583355_100000722549 [1,0,0,0,0,0|2,1,0]=4 623 B9R1.1 CSc1ncc(cn1)O 62a_100000730009_200000210301 [1,0,0,0,0,0|2,1,0]=4 624 B9R1.1 CSc1ncc(cn1)O 62a_200000210301_100000092845 [1,0,0,0,0,0|2,1,0]=4 625 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [1,0,0,0,0,0|2,0,0]=3 626 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [1,0,0,0,0,0|1,0,0]=2 627 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [1,0,0,0,0,0|1,0,0]=2 628 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [1,0,0,0,0,0|1,1,0]=3 629 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [1,0,0,0,0,0|1,1,0]=3 630 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,0,0,0,0,0|2,0,0]=3 631 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,0,0,0,0,0|2,0,0]=3 632 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,0,0,0,0,0|2,1,0]=4 633 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,0,0,0,0,0|2,1,0]=4 634 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [1,0,0,0,0,0|2,0,0]=3 635 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_100011192072_200025704644 [1,0,0,0,0,0|2,1,0]=4 636 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000754016 [1,0,0,0,0,0|2,1,0]=4 637 B9R1.1 Cc1ncc(cn1)O[13CH3] 34a_100000062939_200025704644 [1,0,0,0,0,0|3,0,0]=4 638 B9R1.1 Cc1ncc(cn1)O[13CH3] 7a_100000062939_200025704644 [1,0,0,0,0,0|3,0,0]=4 639 B9R1.1 N#Cc1ccc(cc1)O 271570a_203496583355_100000179745 [1,0,0,0,0,0|1,0,1]=3 640 B9R1.1 N#Cc1ccc(cn1)O 271570a_203496583355_100000760455 [1,0,0,0,0,0|2,0,1]=4 641 B9R1.1 N#Cc1ccc(nc1)O 271570a_203496583355_100000241038 [1,0,0,0,0,0|2,0,1]=4 642 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [1,0,0,0,0,0|1,0,0]=2 643 B9R1.1 NCc1ccc(cn1)O 271570a_203496583355_100015188789 [1,0,0,0,0,0|2,0,0]=3 644 B9R1.1 NCc1ccc(nc1)O 271570a_203496583355_100009817727 [1,0,0,0,0,0|2,0,0]=3 645 B9R1.1 NCc1ncc(cn1)O 271570a_203496583355_200016993442 [1,0,0,0,0,0|3,0,0]=4 646 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [1,0,0,0,0,0|2,0,0]=3 647 B9R1.1 NNc1ccc(cn1)O 271570a_203496583355_100000750576 [1,0,0,0,0,0|3,0,0]=4 648 B9R1.1 NNc1ccc(nc1)O 271570a_203496583355_100000119030 [1,0,0,0,0,0|3,0,0]=4 649 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [1,0,0,0,0,0|1,0,1]=3 650 B9R1.1 O=Cc1ccc(cn1)O 271570a_203496583355_100000754260 [1,0,0,0,0,0|2,0,1]=4 651 B9R1.1 O=Cc1ccc(nc1)O 271570a_203496583355_100000766901 [1,0,0,0,0,0|2,0,1]=4 652 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [1,0,0,0,0,0|1,0,0]=2 653 B9R1.1 OCc1ccc(cn1)O 271570a_203496583355_100000754261 [1,0,0,0,0,0|2,0,0]=3 654 B9R1.1 OCc1ccc(nc1)O 271570a_203496583355_100009816760 [1,0,0,0,0,0|2,0,0]=3 655 B9R1.1 OCc1cnc(cn1)O 271570a_203496583355_100012002382 [1,0,0,0,0,0|3,0,0]=4 656 B9R1.1 OCc1cnc(nc1)O 271570a_203496583355_100009855073 [1,0,0,0,0,0|3,0,0]=4 657 B9R1.1 OCc1ncc(cn1)O 271570a_203496583355_100009867226 [1,0,0,0,0,0|3,0,0]=4 658 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [1,0,0,0,0,0|1,0,0]=2 659 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [1,0,0,0,0,0|2,0,0]=3 660 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [1,0,0,0,0,0|2,0,0]=3 661 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [1,0,0,0,0,0|2,0,0]=3 662 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [1,0,0,0,0,0|2,0,0]=3 663 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [1,0,0,0,0,0|2,0,0]=3 664 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [1,0,0,0,0,0|2,0,0]=3 665 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [1,0,0,0,0,0|1,0,0]=2 666 B9R1.1 [13CH3]Oc1ccc(=O)[nH]c1 34a_100000075641_200025704644 [1,0,0,0,0,0|1,0,1]=3 667 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [1,0,0,0,0,0|1,0,0]=2 668 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [1,0,0,0,0,0|1,0,0]=2 669 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [1,0,0,0,0,0|1,0,0]=2 670 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [1,0,0,0,0,0|1,0,0]=2 671 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [1,0,0,0,0,0|1,0,0]=2 672 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [1,0,0,0,0,0|1,0,0]=2 673 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [1,0,0,0,0,0|1,0,0]=2 674 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [1,0,0,0,0,0|1,0,0]=2 675 B9R1.1 [13CH3]Oc1ccc(cn1)Cl 34a_100011215309_200025704644 [1,0,0,0,0,0|2,0,0]=3 676 B9R1.1 [13CH3]Oc1ccc(cn1)F 34a_100000742473_200025704644 [1,0,0,0,0,0|2,0,0]=3 677 B9R1.1 [13CH3]Oc1ccc(cn1)N 34a_100000729260_200025704644 [1,0,0,0,0,0|2,0,0]=3 678 B9R1.1 [13CH3]Oc1ccc(nc1)Br 34a_100000685995_200025704644 [1,0,0,0,0,0|2,0,0]=3 679 B9R1.1 [13CH3]Oc1ccc(nc1)Br 7a_100000685995_200025704644 [1,0,0,0,0,0|2,0,0]=3 680 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 34a_100000744096_200025704644 [1,0,0,0,0,0|2,0,0]=3 681 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 7a_100000744096_200025704644 [1,0,0,0,0,0|2,0,0]=3 682 B9R1.1 [13CH3]Oc1ccc(nc1)F 34a_100000688820_200025704644 [1,0,0,0,0,0|2,0,0]=3 683 B9R1.1 [13CH3]Oc1ccc(nc1)F 7a_100000688820_200025704644 [1,0,0,0,0,0|2,0,0]=3 684 B9R1.1 [13CH3]Oc1ccc(nc1)I 34a_100000687607_200025704644 [1,0,0,0,0,0|2,0,0]=3 685 B9R1.1 [13CH3]Oc1ccc(nc1)I 7a_100000687607_200025704644 [1,0,0,0,0,0|2,0,0]=3 686 B9R1.1 [13CH3]Oc1ccc(nc1)N 34a_100015188713_200025704644 [1,0,0,0,0,0|2,0,0]=3 687 B9R1.1 [13CH3]Oc1ccc(nc1)N 7a_100015188713_200025704644 [1,0,0,0,0,0|2,0,0]=3 688 B9R1.1 [13CH3]Oc1cnc(cn1)Br 34a_100011934580_200025704644 [1,0,0,0,0,0|3,0,0]=4 689 B9R1.1 [13CH3]Oc1cnc(cn1)Cl 34a_100015839800_200025704644 [1,0,0,0,0,0|3,0,0]=4 690 B9R1.1 [13CH3]Oc1cnc(nc1)Br 34a_100000730009_200025704644 [1,0,0,0,0,0|3,0,0]=4 691 B9R1.1 [13CH3]Oc1cnc(nc1)Br 7a_100000730009_200025704644 [1,0,0,0,0,0|3,0,0]=4 692 B9R1.1 [13CH3]Oc1cnc(nc1)Cl 34a_100000092845_200025704644 [1,0,0,0,0,0|3,0,0]=4 693 B9R1.1 [13CH3]Oc1cnc(nc1)Cl 7a_100000092845_200025704644 [1,0,0,0,0,0|3,0,0]=4 694 B9R1.1 [13CH3]Oc1cnc(nc1)F 34a_200009874573_200025704644 [1,0,0,0,0,0|3,0,0]=4 695 B9R1.1 [13CH3]Oc1cnc(nc1)F 7a_200009874573_200025704644 [1,0,0,0,0,0|3,0,0]=4 696 B9R1.1 [13CH3]Oc1cnc(nc1)N 34a_100000087137_200025704644 [1,0,0,0,0,0|3,0,0]=4 697 B9R1.1 [13CH3]Oc1cnc(nc1)N 7a_100000087137_200025704644 [1,0,0,0,0,0|3,0,0]=4 698 B9R1.1 [13CH3]Oc1ncc(cn1)F 34a_100011934040_200025704644 [1,0,0,0,0,0|3,0,0]=4 699 B9R1.1 [13CH3]Sc1cc[n+](cc1)[O-] 62a_200025704644_100000039755 [1,0,0,0,0,0|1,1,1]=4 700 B9R1.1 [13CH3]Sc1ccc(=O)[nH]c1 62a_100000212171_200025704644 [1,0,0,0,0,0|1,1,1]=4 701 B9R1.1 [13CH3]Sc1ccc(=O)[nH]c1 62a_200025704644_100000212171 [1,0,0,0,0,0|1,1,1]=4 702 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [1,0,0,0,0,0|1,1,0]=3 703 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [1,0,0,0,0,0|1,1,0]=3 704 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [1,0,0,0,0,0|1,1,0]=3 705 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [1,0,0,0,0,0|1,1,0]=3 706 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [1,0,0,0,0,0|1,1,0]=3 707 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [1,0,0,0,0,0|1,1,0]=3 708 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [1,0,0,0,0,0|1,1,0]=3 709 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [1,0,0,0,0,0|1,1,0]=3 710 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [1,0,0,0,0,0|0,1,0]=2 711 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_100000686858_200025704644 [1,0,0,0,0,0|2,1,0]=4 712 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_200025704644_100000686858 [1,0,0,0,0,0|2,1,0]=4 713 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_100011356976_200025704644 [1,0,0,0,0,0|2,1,0]=4 714 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_200025704644_100011356976 [1,0,0,0,0,0|2,1,0]=4 715 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_100000744514_200025704644 [1,0,0,0,0,0|2,1,0]=4 716 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_200025704644_100000744514 [1,0,0,0,0,0|2,1,0]=4 717 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_100000737798_200025704644 [1,0,0,0,0,0|2,1,0]=4 718 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_200025704644_100000737798 [1,0,0,0,0,0|2,1,0]=4 719 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_100000685995_200025704644 [1,0,0,0,0,0|1,1,0]=3 720 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_200025704644_100000744096 [1,0,0,0,0,0|1,1,0]=3 721 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_100009814638_200025704644 [1,0,0,0,0,0|2,1,0]=4 722 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_200025704644_100009814638 [1,0,0,0,0,0|2,1,0]=4 723 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_100000034144_200025704644 [1,0,0,0,0,0|2,1,0]=4 724 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_200025704644_100000034144 [1,0,0,0,0,0|2,1,0]=4 725 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_100000042367_200025704644 [1,0,0,0,0,0|2,1,0]=4 726 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_200025704644_100000042367 [1,0,0,0,0,0|2,1,0]=4 727 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_100000187370_200025704644 [1,0,0,0,0,0|2,1,0]=4 728 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_200025704644_100000187370 [1,0,0,0,0,0|2,1,0]=4 729 B9R1.1 [13CH3]Sc1cnc(cn1)O 62a_100011934580_200025704644 [1,0,0,0,0,0|2,1,0]=4 730 B9R1.1 [13CH3]Sc1cnc(cn1)O 62a_200025704644_100015839800 [1,0,0,0,0,0|2,1,0]=4 731 B9R1.1 [13CH3]Sc1ncc(cn1)O 62a_100000730009_200025704644 [1,0,0,0,0,0|2,1,0]=4 732 B9R1.1 [13CH3]Sc1ncc(cn1)O 62a_200025704644_100000092845 [1,0,0,0,0,0|2,1,0]=4 733 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,0,0,0,0|1,0,2]=4 734 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,0,0,0,0|1,0,1]=3 735 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,0,0,0,0|2,0,1]=4 736 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,0,0,0,0|2,0,1]=4 737 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,0,0,0,0|2,0,1]=4 738 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,0,0,0,0|1,0,0]=2 739 B9R1.8 CCNc1cccnn1 27a_100015525214_100016991348 [1,0,0,0,0,0|3,0,0]=4 740 B9R1.8 CCNc1ccncn1 27a_100015525214_100000703185 [1,0,0,0,0,0|3,0,0]=4 741 B9R1.8 CCNc1cnccn1 27a_100015525214_100000211759 [1,0,0,0,0,0|3,0,0]=4 742 B9R1.8 CCNc1ncccn1 27a_100015525214_100000211032 [1,0,0,0,0,0|3,0,0]=4 743 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,0,0,0,0|0,0,0]=1 744 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,0,0,0,0|0,0,0]=1 745 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [1,0,0,0,0,0|1,0,0]=2 746 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [1,0,0,0,0,0|1,0,0]=2 747 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [1,0,0,0,0,0|1,0,0]=2 748 B9R1.8 CCOc1ccnnc1 34a_100015204005_100000210202 [1,0,0,0,0,0|2,0,0]=3 749 B9R1.8 CCOc1cncnc1 7a_100000754086_100000210202 [1,0,0,0,0,0|2,0,0]=3 750 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,0,0,0,0|0,1,0]=2 751 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,0,0,0,0|0,1,0]=2 752 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [1,0,0,0,0,0|1,1,0]=3 753 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [1,0,0,0,0,0|1,1,0]=3 754 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [1,0,0,0,0,0|1,1,0]=3 755 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [1,0,0,0,0,0|1,1,0]=3 756 B9R1.8 CCSc1cccnn1 62a_100000210202_100016991348 [1,0,0,0,0,0|2,1,0]=4 757 B9R1.8 CCSc1cccnn1 62a_100016991348_100000210202 [1,0,0,0,0,0|2,1,0]=4 758 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [1,0,0,0,0,0|1,1,0]=3 759 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [1,0,0,0,0,0|1,1,0]=3 760 B9R1.8 CCSc1ccncn1 62a_100000210202_100000703185 [1,0,0,0,0,0|2,1,0]=4 761 B9R1.8 CCSc1ccncn1 62a_100000703185_100000210202 [1,0,0,0,0,0|2,1,0]=4 762 B9R1.8 CCSc1ccnnc1 62a_100000210202_100000732662 [1,0,0,0,0,0|2,1,0]=4 763 B9R1.8 CCSc1ccnnc1 62a_100000732662_100000210202 [1,0,0,0,0,0|2,1,0]=4 764 B9R1.8 CCSc1cnccn1 62a_100000210202_100000211759 [1,0,0,0,0,0|2,1,0]=4 765 B9R1.8 CCSc1cnccn1 62a_100000211759_100000210202 [1,0,0,0,0,0|2,1,0]=4 766 B9R1.8 CCSc1cncnc1 62a_100000210202_100011206942 [1,0,0,0,0,0|2,1,0]=4 767 B9R1.8 CCSc1cncnc1 62a_100011206942_100000210202 [1,0,0,0,0,0|2,1,0]=4 768 B9R1.8 CCSc1ncccn1 62a_100000210202_100000211032 [1,0,0,0,0,0|2,1,0]=4 769 B9R1.8 CCSc1ncccn1 62a_100000211032_100000210202 [1,0,0,0,0,0|2,1,0]=4 770 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,0,0,0,0|2,0,0]=3 771 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,0,0,0,0|2,0,0]=3 772 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,0,0,0,0|2,0,0]=3 773 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,0,0,0,0|2,0,0]=3 774 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,0,0,0,0|2,0,0]=3 775 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,0,0,0,0|2,0,0]=3 776 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,0,0,0,0|2,0,0]=3 777 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [1,0,0,0,0,0|3,0,0]=4 778 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [1,0,0,0,0,0|3,0,0]=4 779 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [1,0,0,0,0,0|3,0,0]=4 780 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [1,0,0,0,0,0|3,0,0]=4 781 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [1,0,0,0,0,0|3,0,0]=4 782 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [1,0,0,0,0,0|3,0,0]=4 783 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [1,0,0,0,0,0|3,0,0]=4 784 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [1,0,0,0,0,0|3,0,0]=4 785 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [1,0,0,0,0,0|3,0,0]=4 786 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [1,0,0,0,0,0|3,0,0]=4 787 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [1,0,0,0,0,0|3,0,0]=4 788 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [1,0,0,0,0,0|3,0,0]=4 789 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [1,0,0,0,0,0|3,0,0]=4 790 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,0,0,0,0|2,0,0]=3 791 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,0,0,0,0|2,0,0]=3 792 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,0,0,0,0|2,0,0]=3 793 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [1,0,0,0,0,0|3,0,0]=4 794 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [1,0,0,0,0,0|3,0,0]=4 795 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,0,0,0,0|2,0,0]=3 796 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,0,0,0,0|2,0,0]=3 797 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [1,0,0,0,0,0|3,0,0]=4 798 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [1,0,0,0,0,0|3,0,0]=4 799 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [1,0,0,0,0,0|3,0,0]=4 800 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [1,0,0,0,0,0|3,0,0]=4 801 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [1,0,0,0,0,0|3,0,0]=4 802 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [1,0,0,0,0,0|3,0,0]=4 803 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [1,0,0,0,0,0|2,0,0]=3 804 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,0,0,0,0|1,0,0]=2 805 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,0,0,0,0|1,0,0]=2 806 B9R1.8 FCOc1cccnc1 34a_100000210849_100015361967 [1,0,0,0,0,0|2,0,0]=3 807 B9R1.8 FCOc1cccnc1 7a_100000210849_100015361967 [1,0,0,0,0,0|2,0,0]=3 808 B9R1.8 FCOc1ccncc1 34a_100000212176_100015361967 [1,0,0,0,0,0|2,0,0]=3 809 B9R1.8 FCOc1ccnnc1 34a_100015204005_100015361967 [1,0,0,0,0,0|3,0,0]=4 810 B9R1.8 FCOc1cncnc1 7a_100000754086_100015361967 [1,0,0,0,0,0|3,0,0]=4 811 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [1,0,0,0,0,0|1,1,0]=3 812 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [1,0,0,0,0,0|1,1,0]=3 813 B9R1.8 FCSc1ccccn1 62a_100011216584_100015361967 [1,0,0,0,0,0|2,1,0]=4 814 B9R1.8 FCSc1ccccn1 62a_100015361967_100011216584 [1,0,0,0,0,0|2,1,0]=4 815 B9R1.8 FCSc1cccnc1 62a_100000210063_100015361967 [1,0,0,0,0,0|2,1,0]=4 816 B9R1.8 FCSc1cccnc1 62a_100015361967_100000210063 [1,0,0,0,0,0|2,1,0]=4 817 B9R1.8 FCSc1ccncc1 62a_100000728582_100015361967 [1,0,0,0,0,0|2,1,0]=4 818 B9R1.8 FCSc1ccncc1 62a_100015361967_100000728582 [1,0,0,0,0,0|2,1,0]=4 819 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,0,0,0,0|2,0,0]=3 820 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,0,0,0,0|2,0,0]=3 821 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,0,0,0,0|2,0,0]=3 822 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,0,0,0,0|2,0,0]=3 823 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,0,0,0,0|2,0,0]=3 824 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,0,0,0,0|2,0,0]=3 825 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [1,0,0,0,0,0|3,0,0]=4 826 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [1,0,0,0,0,0|3,0,0]=4 827 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [1,0,0,0,0,0|3,0,0]=4 828 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [1,0,0,0,0,0|3,0,0]=4 829 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [1,0,0,0,0,0|3,0,0]=4 830 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [1,0,0,0,0,0|3,0,0]=4 831 B11R1.1 C#CCNc1ccc(cc1)Br 2230a_100000210018_100000038162 [0,1,0,0,0,0|2,0,1]=4 832 B11R1.1 C#CCNc1ccc(cc1)Br 34a_100000210018_100000184674 [0,1,0,0,0,0|2,0,1]=4 833 B11R1.1 C#CCNc1ccc(cc1)C 34a_100000124888_100000184674 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.1 C#CCNc1ccc(cc1)Cl 2230a_100000210052_100000038162 [0,1,0,0,0,0|2,0,1]=4 835 B11R1.1 C#CCNc1ccc(cc1)Cl 34a_100000210052_100000184674 [0,1,0,0,0,0|2,0,1]=4 836 B11R1.1 C#CCNc1ccc(cc1)F 34a_100000185862_100000184674 [0,1,0,0,0,0|2,0,1]=4 837 B11R1.1 C#CCNc1ccc(cc1)I 34a_100000185761_100000184674 [0,1,0,0,0,0|2,0,1]=4 838 B11R1.1 C#CCNc1ccc(cc1)O 34a_100000185829_100000184674 [0,1,0,0,0,0|1,0,1]=3 839 B11R1.1 C#CCOc1ccc(=O)[nH]c1 34a_100000075641_100000184674 [0,1,0,0,0,0|1,0,2]=4 840 B11R1.1 C#CCOc1ccc(cc1)Br 34a_100000185759_100000184674 [0,1,0,0,0,0|1,0,1]=3 841 B11R1.1 C#CCOc1ccc(cc1)Br 7a_100000185759_100000038162 [0,1,0,0,0,0|1,0,1]=3 842 B11R1.1 C#CCOc1ccc(cc1)C 34a_100000210336_100000184674 [0,1,0,0,0,0|1,0,1]=3 843 B11R1.1 C#CCOc1ccc(cc1)C 7a_100000210336_100000038162 [0,1,0,0,0,0|1,0,1]=3 844 B11R1.1 C#CCOc1ccc(cc1)Cl 34a_100000210216_100000184674 [0,1,0,0,0,0|1,0,1]=3 845 B11R1.1 C#CCOc1ccc(cc1)Cl 7a_100000210216_100000038162 [0,1,0,0,0,0|1,0,1]=3 846 B11R1.1 C#CCOc1ccc(cc1)F 34a_100000210339_100000184674 [0,1,0,0,0,0|1,0,1]=3 847 B11R1.1 C#CCOc1ccc(cc1)I 34a_100000212066_100000184674 [0,1,0,0,0,0|1,0,1]=3 848 B11R1.1 C#CCOc1ccc(cc1)I 7a_100000212066_100000038162 [0,1,0,0,0,0|1,0,1]=3 849 B11R1.1 C#CCOc1ccc(cc1)N 34a_100000185829_100000184674 [0,1,0,0,0,0|1,0,1]=3 850 B11R1.1 C#CCOc1ccc(cn1)C 34a_100000759353_100000184674 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.1 C#CCOc1ccc(cn1)Cl 34a_100011215309_100000184674 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.1 C#CCOc1ccc(cn1)F 34a_100000742473_100000184674 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.1 C#CCOc1ccc(cn1)N 34a_100000729260_100000184674 [0,1,0,0,0,0|2,0,1]=4 854 B11R1.1 C#CCOc1ccc(nc1)Br 34a_100000685995_100000184674 [0,1,0,0,0,0|2,0,1]=4 855 B11R1.1 C#CCOc1ccc(nc1)Br 7a_100000685995_100000038162 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.1 C#CCOc1ccc(nc1)C 34a_100000745506_100000184674 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.1 C#CCOc1ccc(nc1)C 7a_100000745506_100000038162 [0,1,0,0,0,0|2,0,1]=4 858 B11R1.1 C#CCOc1ccc(nc1)Cl 34a_100000744096_100000184674 [0,1,0,0,0,0|2,0,1]=4 859 B11R1.1 C#CCOc1ccc(nc1)Cl 7a_100000744096_100000038162 [0,1,0,0,0,0|2,0,1]=4 860 B11R1.1 C#CCOc1ccc(nc1)F 34a_100000688820_100000184674 [0,1,0,0,0,0|2,0,1]=4 861 B11R1.1 C#CCOc1ccc(nc1)F 7a_100000688820_100000038162 [0,1,0,0,0,0|2,0,1]=4 862 B11R1.1 C#CCOc1ccc(nc1)I 34a_100000687607_100000184674 [0,1,0,0,0,0|2,0,1]=4 863 B11R1.1 C#CCOc1ccc(nc1)I 7a_100000687607_100000038162 [0,1,0,0,0,0|2,0,1]=4 864 B11R1.1 C#CCOc1ccc(nc1)N 34a_100015188713_100000184674 [0,1,0,0,0,0|2,0,1]=4 865 B11R1.1 C#CCOc1ccc(nc1)N 7a_100015188713_100000038162 [0,1,0,0,0,0|2,0,1]=4 866 B11R1.1 C#CCSc1ccc(cc1)Br 62a_100000038162_100000752885 [0,1,0,0,0,0|1,1,1]=4 867 B11R1.1 C#CCSc1ccc(cc1)C 62a_100000038162_100000186775 [0,1,0,0,0,0|1,1,1]=4 868 B11R1.1 C#CCSc1ccc(cc1)Cl 62a_100000038162_100000755918 [0,1,0,0,0,0|1,1,1]=4 869 B11R1.1 C#CCSc1ccc(cc1)F 62a_100000038162_100000211213 [0,1,0,0,0,0|1,1,1]=4 870 B11R1.1 C#CCSc1ccc(cc1)N 62a_100000038162_100000185761 [0,1,0,0,0,0|1,1,1]=4 871 B11R1.1 C#CCSc1ccc(cc1)O 62a_100000038162_100000185759 [0,1,0,0,0,0|0,1,1]=3 872 B11R1.1 C#CCSc1ccc(cn1)O 62a_100000038162_100000744096 [0,1,0,0,0,0|1,1,1]=4 873 B11R1.1 C=CCNc1ccc(cc1)Br 2230a_100000210018_100000210623 [0,1,0,0,0,0|2,0,1]=4 874 B11R1.1 C=CCNc1ccc(cc1)Br 34a_100000210018_100015514636 [0,1,0,0,0,0|2,0,1]=4 875 B11R1.1 C=CCNc1ccc(cc1)C 34a_100000124888_100015514636 [0,1,0,0,0,0|2,0,1]=4 876 B11R1.1 C=CCNc1ccc(cc1)Cl 2230a_100000210052_100000210623 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.1 C=CCNc1ccc(cc1)Cl 34a_100000210052_100015514636 [0,1,0,0,0,0|2,0,1]=4 878 B11R1.1 C=CCNc1ccc(cc1)F 34a_100000185862_100015514636 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.1 C=CCNc1ccc(cc1)I 34a_100000185761_100015514636 [0,1,0,0,0,0|2,0,1]=4 880 B11R1.1 C=CCNc1ccc(cc1)O 34a_100000185829_100015514636 [0,1,0,0,0,0|1,0,1]=3 881 B11R1.1 C=CCOc1ccc(=O)[nH]c1 34a_100000075641_100015514636 [0,1,0,0,0,0|1,0,2]=4 882 B11R1.1 C=CCOc1ccc(cc1)Br 34a_100000185759_100015514636 [0,1,0,0,0,0|1,0,1]=3 883 B11R1.1 C=CCOc1ccc(cc1)Br 7a_100000185759_100015514636 [0,1,0,0,0,0|1,0,1]=3 884 B11R1.1 C=CCOc1ccc(cc1)C 34a_100000210336_100015514636 [0,1,0,0,0,0|1,0,1]=3 885 B11R1.1 C=CCOc1ccc(cc1)C 7a_100000210336_100015514636 [0,1,0,0,0,0|1,0,1]=3 886 B11R1.1 C=CCOc1ccc(cc1)Cl 34a_100000210216_100015514636 [0,1,0,0,0,0|1,0,1]=3 887 B11R1.1 C=CCOc1ccc(cc1)Cl 7a_100000210216_100015514636 [0,1,0,0,0,0|1,0,1]=3 888 B11R1.1 C=CCOc1ccc(cc1)F 34a_100000210339_100015514636 [0,1,0,0,0,0|1,0,1]=3 889 B11R1.1 C=CCOc1ccc(cc1)I 34a_100000212066_100015514636 [0,1,0,0,0,0|1,0,1]=3 890 B11R1.1 C=CCOc1ccc(cc1)I 7a_100000212066_100015514636 [0,1,0,0,0,0|1,0,1]=3 891 B11R1.1 C=CCOc1ccc(cc1)N 34a_100000185829_100015514636 [0,1,0,0,0,0|1,0,1]=3 892 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [0,1,0,0,0,0|0,0,1]=2 893 B11R1.1 C=CCOc1ccc(cn1)C 34a_100000759353_100015514636 [0,1,0,0,0,0|2,0,1]=4 894 B11R1.1 C=CCOc1ccc(cn1)Cl 34a_100011215309_100015514636 [0,1,0,0,0,0|2,0,1]=4 895 B11R1.1 C=CCOc1ccc(cn1)F 34a_100000742473_100015514636 [0,1,0,0,0,0|2,0,1]=4 896 B11R1.1 C=CCOc1ccc(cn1)N 34a_100000729260_100015514636 [0,1,0,0,0,0|2,0,1]=4 897 B11R1.1 C=CCOc1ccc(nc1)Br 34a_100000685995_100015514636 [0,1,0,0,0,0|2,0,1]=4 898 B11R1.1 C=CCOc1ccc(nc1)Br 7a_100000685995_100015514636 [0,1,0,0,0,0|2,0,1]=4 899 B11R1.1 C=CCOc1ccc(nc1)C 34a_100000745506_100015514636 [0,1,0,0,0,0|2,0,1]=4 900 B11R1.1 C=CCOc1ccc(nc1)C 7a_100000745506_100015514636 [0,1,0,0,0,0|2,0,1]=4 901 B11R1.1 C=CCOc1ccc(nc1)Cl 34a_100000744096_100015514636 [0,1,0,0,0,0|2,0,1]=4 902 B11R1.1 C=CCOc1ccc(nc1)Cl 7a_100000744096_100015514636 [0,1,0,0,0,0|2,0,1]=4 903 B11R1.1 C=CCOc1ccc(nc1)F 34a_100000688820_100015514636 [0,1,0,0,0,0|2,0,1]=4 904 B11R1.1 C=CCOc1ccc(nc1)F 7a_100000688820_100015514636 [0,1,0,0,0,0|2,0,1]=4 905 B11R1.1 C=CCOc1ccc(nc1)I 34a_100000687607_100015514636 [0,1,0,0,0,0|2,0,1]=4 906 B11R1.1 C=CCOc1ccc(nc1)I 7a_100000687607_100015514636 [0,1,0,0,0,0|2,0,1]=4 907 B11R1.1 C=CCOc1ccc(nc1)N 34a_100015188713_100015514636 [0,1,0,0,0,0|2,0,1]=4 908 B11R1.1 C=CCOc1ccc(nc1)N 7a_100015188713_100015514636 [0,1,0,0,0,0|2,0,1]=4 909 B11R1.1 C=CCSc1ccc(cc1)Br 62a_100000210623_100000752885 [0,1,0,0,0,0|1,1,1]=4 910 B11R1.1 C=CCSc1ccc(cc1)Br 62a_100000752885_100000210623 [0,1,0,0,0,0|1,1,1]=4 911 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000186775_100000210623 [0,1,0,0,0,0|1,1,1]=4 912 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000210623_100000186775 [0,1,0,0,0,0|1,1,1]=4 913 B11R1.1 C=CCSc1ccc(cc1)Cl 62a_100000210623_100000755918 [0,1,0,0,0,0|1,1,1]=4 914 B11R1.1 C=CCSc1ccc(cc1)Cl 62a_100000755918_100000210623 [0,1,0,0,0,0|1,1,1]=4 915 B11R1.1 C=CCSc1ccc(cc1)F 62a_100000210623_100000211213 [0,1,0,0,0,0|1,1,1]=4 916 B11R1.1 C=CCSc1ccc(cc1)F 62a_100000211213_100000210623 [0,1,0,0,0,0|1,1,1]=4 917 B11R1.1 C=CCSc1ccc(cc1)N 62a_100000185761_100000210623 [0,1,0,0,0,0|1,1,1]=4 918 B11R1.1 C=CCSc1ccc(cc1)N 62a_100000210623_100000185761 [0,1,0,0,0,0|1,1,1]=4 919 B11R1.1 C=CCSc1ccc(cc1)O 62a_100000210623_100000185759 [0,1,0,0,0,0|0,1,1]=3 920 B11R1.1 C=CCSc1ccc(cn1)O 62a_100000210623_100000744096 [0,1,0,0,0,0|1,1,1]=4 921 B11R1.1 C=CCSc1ccc(cn1)O 62a_100000685995_100000210623 [0,1,0,0,0,0|1,1,1]=4 922 B11R1.1 CC=NNc1ccc(cc1)Br 4a_100000735608_200000210099 [0,1,0,0,0,0|2,0,1]=4 923 B11R1.1 CC=NNc1ccc(cc1)C 4a_100000683527_200000210099 [0,1,0,0,0,0|2,0,1]=4 924 B11R1.1 CC=NNc1ccc(cc1)Cl 4a_100000683521_200000210099 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.1 CC=NNc1ccc(cc1)F 4a_100000728448_200000210099 [0,1,0,0,0,0|2,0,1]=4 926 B11R1.1 CC=NNc1ccc(cc1)I 4a_100016988836_200000210099 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.1 CCCCc1cc[n+](cc1)[O-] 271570a_100020621405_100000039755 [0,1,0,0,0,0|2,0,1]=4 928 B11R1.1 CCCCc1ccc(=O)[nH]c1 271570a_100020621405_100000212171 [0,1,0,0,0,0|2,0,1]=4 929 B11R1.1 CCCCc1ccc(cc1)Br 271570a_100020621405_100000752885 [0,1,0,0,0,0|2,0,0]=3 930 B11R1.1 CCCCc1ccc(cc1)C 271570a_100020621405_100000186775 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.1 CCCCc1ccc(cc1)Cl 271570a_100020621405_100000755918 [0,1,0,0,0,0|2,0,0]=3 932 B11R1.1 CCCCc1ccc(cc1)F 271570a_100020621405_100000211213 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.1 CCCCc1ccc(cc1)N 271570a_100020621405_100000185761 [0,1,0,0,0,0|2,0,0]=3 934 B11R1.1 CCCCc1ccc(cc1)O 271570a_100020621405_100000185759 [0,1,0,0,0,0|1,0,0]=2 935 B11R1.1 CCCCc1ccc(cc1)O 271570a_203496583355_100011215597 [0,1,0,0,0,0|1,0,0]=2 936 B11R1.1 CCCCc1ccc(cn1)Br 271570a_100020621405_100000686858 [0,1,0,0,0,0|3,0,0]=4 937 B11R1.1 CCCCc1ccc(cn1)C 271570a_100020621405_100000754016 [0,1,0,0,0,0|3,0,0]=4 938 B11R1.1 CCCCc1ccc(cn1)Cl 271570a_100020621405_100011356976 [0,1,0,0,0,0|3,0,0]=4 939 B11R1.1 CCCCc1ccc(cn1)F 271570a_100020621405_100000744514 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.1 CCCCc1ccc(cn1)N 271570a_100020621405_100000744251 [0,1,0,0,0,0|3,0,0]=4 941 B11R1.1 CCCCc1ccc(cn1)O 271570a_100020621405_100000685995 [0,1,0,0,0,0|2,0,0]=3 942 B11R1.1 CCCCc1ccc(nc1)Br 271570a_100020621405_100009814638 [0,1,0,0,0,0|3,0,0]=4 943 B11R1.1 CCCCc1ccc(nc1)C 271570a_100020621405_100000751577 [0,1,0,0,0,0|3,0,0]=4 944 B11R1.1 CCCCc1ccc(nc1)Cl 271570a_100020621405_100000034144 [0,1,0,0,0,0|3,0,0]=4 945 B11R1.1 CCCCc1ccc(nc1)F 271570a_100020621405_100000748661 [0,1,0,0,0,0|3,0,0]=4 946 B11R1.1 CCCCc1ccc(nc1)N 271570a_100020621405_100000187370 [0,1,0,0,0,0|3,0,0]=4 947 B11R1.1 CCCCc1ncc(cn1)O 271570a_100020621405_100000730009 [0,1,0,0,0,0|3,0,0]=4 948 B11R1.1 CCCNc1ccc(cc1)Br 2230a_100000210018_100000210303 [0,1,0,0,0,0|2,0,0]=3 949 B11R1.1 CCCNc1ccc(cc1)Br 34a_100000210018_100000210303 [0,1,0,0,0,0|2,0,0]=3 950 B11R1.1 CCCNc1ccc(cc1)C 34a_100000124888_100000210303 [0,1,0,0,0,0|2,0,0]=3 951 B11R1.1 CCCNc1ccc(cc1)Cl 2230a_100000210052_100000210303 [0,1,0,0,0,0|2,0,0]=3 952 B11R1.1 CCCNc1ccc(cc1)Cl 34a_100000210052_100000210303 [0,1,0,0,0,0|2,0,0]=3 953 B11R1.1 CCCNc1ccc(cc1)F 34a_100000185862_100000210303 [0,1,0,0,0,0|2,0,0]=3 954 B11R1.1 CCCNc1ccc(cc1)I 34a_100000185761_100000210303 [0,1,0,0,0,0|2,0,0]=3 955 B11R1.1 CCCNc1ccc(cc1)O 34a_100000185829_100000210303 [0,1,0,0,0,0|1,0,0]=2 956 B11R1.1 CCCNc1ccc(nn1)O 271570a_203496583355_100000215239 [0,1,0,0,0,0|3,0,0]=4 957 B11R1.1 CCCNc1ncc(cn1)O 271570a_203496583355_200011938755 [0,1,0,0,0,0|3,0,0]=4 958 B11R1.1 CCCOc1ccc(=O)[nH]c1 34a_100000075641_100000210303 [0,1,0,0,0,0|1,0,1]=3 959 B11R1.1 CCCOc1ccc(cc1)Br 34a_100000185759_100000210303 [0,1,0,0,0,0|1,0,0]=2 960 B11R1.1 CCCOc1ccc(cc1)Br 7a_100000185759_100000210303 [0,1,0,0,0,0|1,0,0]=2 961 B11R1.1 CCCOc1ccc(cc1)C 34a_100000210336_100000210303 [0,1,0,0,0,0|1,0,0]=2 962 B11R1.1 CCCOc1ccc(cc1)C 7a_100000210336_100000210303 [0,1,0,0,0,0|1,0,0]=2 963 B11R1.1 CCCOc1ccc(cc1)Cl 34a_100000210216_100000210303 [0,1,0,0,0,0|1,0,0]=2 964 B11R1.1 CCCOc1ccc(cc1)Cl 7a_100000210216_100000210303 [0,1,0,0,0,0|1,0,0]=2 965 B11R1.1 CCCOc1ccc(cc1)F 34a_100000210339_100000210303 [0,1,0,0,0,0|1,0,0]=2 966 B11R1.1 CCCOc1ccc(cc1)I 34a_100000212066_100000210303 [0,1,0,0,0,0|1,0,0]=2 967 B11R1.1 CCCOc1ccc(cc1)I 7a_100000212066_100000210303 [0,1,0,0,0,0|1,0,0]=2 968 B11R1.1 CCCOc1ccc(cc1)N 34a_100000185829_100000210303 [0,1,0,0,0,0|1,0,0]=2 969 B11R1.1 CCCOc1ccc(cc1)O 271570a_203496583355_100000169948 [0,1,0,0,0,0|0,0,0]=1 970 B11R1.1 CCCOc1ccc(cn1)C 34a_100000759353_100000210303 [0,1,0,0,0,0|2,0,0]=3 971 B11R1.1 CCCOc1ccc(cn1)Cl 34a_100011215309_100000210303 [0,1,0,0,0,0|2,0,0]=3 972 B11R1.1 CCCOc1ccc(cn1)F 34a_100000742473_100000210303 [0,1,0,0,0,0|2,0,0]=3 973 B11R1.1 CCCOc1ccc(cn1)N 34a_100000729260_100000210303 [0,1,0,0,0,0|2,0,0]=3 974 B11R1.1 CCCOc1ccc(cn1)O 271570a_203496583355_100011465619 [0,1,0,0,0,0|1,0,0]=2 975 B11R1.1 CCCOc1ccc(nc1)Br 34a_100000685995_100000210303 [0,1,0,0,0,0|2,0,0]=3 976 B11R1.1 CCCOc1ccc(nc1)Br 7a_100000685995_100000210303 [0,1,0,0,0,0|2,0,0]=3 977 B11R1.1 CCCOc1ccc(nc1)C 34a_100000745506_100000210303 [0,1,0,0,0,0|2,0,0]=3 978 B11R1.1 CCCOc1ccc(nc1)C 7a_100000745506_100000210303 [0,1,0,0,0,0|2,0,0]=3 979 B11R1.1 CCCOc1ccc(nc1)Cl 34a_100000744096_100000210303 [0,1,0,0,0,0|2,0,0]=3 980 B11R1.1 CCCOc1ccc(nc1)Cl 7a_100000744096_100000210303 [0,1,0,0,0,0|2,0,0]=3 981 B11R1.1 CCCOc1ccc(nc1)F 34a_100000688820_100000210303 [0,1,0,0,0,0|2,0,0]=3 982 B11R1.1 CCCOc1ccc(nc1)F 7a_100000688820_100000210303 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.1 CCCOc1ccc(nc1)I 34a_100000687607_100000210303 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.1 CCCOc1ccc(nc1)I 7a_100000687607_100000210303 [0,1,0,0,0,0|2,0,0]=3 985 B11R1.1 CCCOc1ccc(nc1)N 34a_100015188713_100000210303 [0,1,0,0,0,0|2,0,0]=3 986 B11R1.1 CCCOc1ccc(nc1)N 7a_100015188713_100000210303 [0,1,0,0,0,0|2,0,0]=3 987 B11R1.1 CCCOc1ccc(nc1)O 271570a_203496583355_100000719977 [0,1,0,0,0,0|1,0,0]=2 988 B11R1.1 CCCOc1ccc(nn1)O 271570a_203496583355_200011279913 [0,1,0,0,0,0|2,0,0]=3 989 B11R1.1 CCCOc1cnc(cn1)Br 34a_100011934580_100000210303 [0,1,0,0,0,0|3,0,0]=4 990 B11R1.1 CCCOc1cnc(cn1)Cl 34a_100015839800_100000210303 [0,1,0,0,0,0|3,0,0]=4 991 B11R1.1 CCCOc1cnc(nc1)Br 34a_100000730009_100000210303 [0,1,0,0,0,0|3,0,0]=4 992 B11R1.1 CCCOc1cnc(nc1)Br 7a_100000730009_100000210303 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.1 CCCOc1cnc(nc1)C 34a_100000062939_100000210303 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.1 CCCOc1cnc(nc1)C 7a_100000062939_100000210303 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.1 CCCOc1cnc(nc1)Cl 34a_100000092845_100000210303 [0,1,0,0,0,0|3,0,0]=4 996 B11R1.1 CCCOc1cnc(nc1)Cl 7a_100000092845_100000210303 [0,1,0,0,0,0|3,0,0]=4 997 B11R1.1 CCCOc1cnc(nc1)F 34a_200009874573_100000210303 [0,1,0,0,0,0|3,0,0]=4 998 B11R1.1 CCCOc1cnc(nc1)F 7a_200009874573_100000210303 [0,1,0,0,0,0|3,0,0]=4 999 B11R1.1 CCCOc1cnc(nc1)N 34a_100000087137_100000210303 [0,1,0,0,0,0|3,0,0]=4 1000 B11R1.1 CCCOc1cnc(nc1)N 7a_100000087137_100000210303 [0,1,0,0,0,0|3,0,0]=4 1001 B11R1.1 CCCOc1ncc(cn1)F 34a_100011934040_100000210303 [0,1,0,0,0,0|3,0,0]=4 1002 B11R1.1 CCCSc1cc[n+](cc1)[O-] 62a_100000210303_100000039755 [0,1,0,0,0,0|1,1,1]=4 1003 B11R1.1 CCCSc1ccc(=O)[nH]c1 62a_100000210303_100000212171 [0,1,0,0,0,0|1,1,1]=4 1004 B11R1.1 CCCSc1ccc(=O)[nH]c1 62a_100000212171_100000210303 [0,1,0,0,0,0|1,1,1]=4 1005 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000210303_100000752885 [0,1,0,0,0,0|1,1,0]=3 1006 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000752885_100000210303 [0,1,0,0,0,0|1,1,0]=3 1007 B11R1.1 CCCSc1ccc(cc1)C 62a_100000186775_100000210303 [0,1,0,0,0,0|1,1,0]=3 1008 B11R1.1 CCCSc1ccc(cc1)C 62a_100000210303_100000186775 [0,1,0,0,0,0|1,1,0]=3 1009 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000210303_100000755918 [0,1,0,0,0,0|1,1,0]=3 1010 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000755918_100000210303 [0,1,0,0,0,0|1,1,0]=3 1011 B11R1.1 CCCSc1ccc(cc1)F 62a_100000210303_100000211213 [0,1,0,0,0,0|1,1,0]=3 1012 B11R1.1 CCCSc1ccc(cc1)F 62a_100000211213_100000210303 [0,1,0,0,0,0|1,1,0]=3 1013 B11R1.1 CCCSc1ccc(cc1)N 62a_100000185761_100000210303 [0,1,0,0,0,0|1,1,0]=3 1014 B11R1.1 CCCSc1ccc(cc1)N 62a_100000210303_100000185761 [0,1,0,0,0,0|1,1,0]=3 1015 B11R1.1 CCCSc1ccc(cc1)O 271570a_203496583355_200009811899 [0,1,0,0,0,0|0,1,0]=2 1016 B11R1.1 CCCSc1ccc(cc1)O 62a_100000210303_100000185759 [0,1,0,0,0,0|0,1,0]=2 1017 B11R1.1 CCCSc1ccc(cn1)Br 62a_100000210303_100000686858 [0,1,0,0,0,0|2,1,0]=4 1018 B11R1.1 CCCSc1ccc(cn1)Br 62a_100000686858_100000210303 [0,1,0,0,0,0|2,1,0]=4 1019 B11R1.1 CCCSc1ccc(cn1)C 62a_100000210303_100000754016 [0,1,0,0,0,0|2,1,0]=4 1020 B11R1.1 CCCSc1ccc(cn1)C 62a_100011192072_100000210303 [0,1,0,0,0,0|2,1,0]=4 1021 B11R1.1 CCCSc1ccc(cn1)Cl 62a_100000210303_100011356976 [0,1,0,0,0,0|2,1,0]=4 1022 B11R1.1 CCCSc1ccc(cn1)Cl 62a_100011356976_100000210303 [0,1,0,0,0,0|2,1,0]=4 1023 B11R1.1 CCCSc1ccc(cn1)F 62a_100000210303_100000744514 [0,1,0,0,0,0|2,1,0]=4 1024 B11R1.1 CCCSc1ccc(cn1)F 62a_100000744514_100000210303 [0,1,0,0,0,0|2,1,0]=4 1025 B11R1.1 CCCSc1ccc(cn1)N 62a_100000210303_100000737798 [0,1,0,0,0,0|2,1,0]=4 1026 B11R1.1 CCCSc1ccc(cn1)N 62a_100000737798_100000210303 [0,1,0,0,0,0|2,1,0]=4 1027 B11R1.1 CCCSc1ccc(cn1)O 62a_100000210303_100000744096 [0,1,0,0,0,0|1,1,0]=3 1028 B11R1.1 CCCSc1ccc(cn1)O 62a_100000685995_100000210303 [0,1,0,0,0,0|1,1,0]=3 1029 B11R1.1 CCCSc1ccc(nc1)Br 62a_100000210303_100009814638 [0,1,0,0,0,0|2,1,0]=4 1030 B11R1.1 CCCSc1ccc(nc1)Br 62a_100009814638_100000210303 [0,1,0,0,0,0|2,1,0]=4 1031 B11R1.1 CCCSc1ccc(nc1)C 62a_100000210303_100000751577 [0,1,0,0,0,0|2,1,0]=4 1032 B11R1.1 CCCSc1ccc(nc1)C 62a_100000751577_100000210303 [0,1,0,0,0,0|2,1,0]=4 1033 B11R1.1 CCCSc1ccc(nc1)Cl 62a_100000034144_100000210303 [0,1,0,0,0,0|2,1,0]=4 1034 B11R1.1 CCCSc1ccc(nc1)Cl 62a_100000210303_100000034144 [0,1,0,0,0,0|2,1,0]=4 1035 B11R1.1 CCCSc1ccc(nc1)F 62a_100000042367_100000210303 [0,1,0,0,0,0|2,1,0]=4 1036 B11R1.1 CCCSc1ccc(nc1)F 62a_100000210303_100000042367 [0,1,0,0,0,0|2,1,0]=4 1037 B11R1.1 CCCSc1ccc(nc1)N 62a_100000187370_100000210303 [0,1,0,0,0,0|2,1,0]=4 1038 B11R1.1 CCCSc1ccc(nc1)N 62a_100000210303_100000187370 [0,1,0,0,0,0|2,1,0]=4 1039 B11R1.1 CCCSc1cnc(cn1)O 62a_100000210303_100015839800 [0,1,0,0,0,0|2,1,0]=4 1040 B11R1.1 CCCSc1cnc(cn1)O 62a_100011934580_100000210303 [0,1,0,0,0,0|2,1,0]=4 1041 B11R1.1 CCCSc1ncc(cn1)O 271570a_203496583355_200011939516 [0,1,0,0,0,0|2,1,0]=4 1042 B11R1.1 CCCSc1ncc(cn1)O 62a_100000210303_100000092845 [0,1,0,0,0,0|2,1,0]=4 1043 B11R1.1 CCCSc1ncc(cn1)O 62a_100000730009_100000210303 [0,1,0,0,0,0|2,1,0]=4 1044 B11R1.1 CCNCc1ccc(cc1)Br 207a_100015525214_100000186029 [0,1,0,0,0,0|2,0,0]=3 1045 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100000174875_100000210202 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100015525214_100011217064 [0,1,0,0,0,0|2,0,0]=3 1047 B11R1.1 CCNCc1ccc(cc1)Br 270004a_100015525214_100000186029 [0,1,0,0,0,0|2,0,0]=3 1048 B11R1.1 CCNCc1ccc(cc1)Br 34a_100000174875_100000210202 [0,1,0,0,0,0|2,0,0]=3 1049 B11R1.1 CCNCc1ccc(cc1)C 207a_100015525214_100000211033 [0,1,0,0,0,0|2,0,0]=3 1050 B11R1.1 CCNCc1ccc(cc1)C 2230a_100000174908_100000210202 [0,1,0,0,0,0|2,0,0]=3 1051 B11R1.1 CCNCc1ccc(cc1)C 2230a_100015525214_100000210814 [0,1,0,0,0,0|2,0,0]=3 1052 B11R1.1 CCNCc1ccc(cc1)C 270004a_100015525214_100000211033 [0,1,0,0,0,0|2,0,0]=3 1053 B11R1.1 CCNCc1ccc(cc1)C 34a_100000174908_100000210202 [0,1,0,0,0,0|2,0,0]=3 1054 B11R1.1 CCNCc1ccc(cc1)Cl 207a_100015525214_100000189385 [0,1,0,0,0,0|2,0,0]=3 1055 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210202 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100015525214_100000694040 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.1 CCNCc1ccc(cc1)Cl 270004a_100015525214_100000189385 [0,1,0,0,0,0|2,0,0]=3 1058 B11R1.1 CCNCc1ccc(cc1)Cl 34a_100000174871_100000210202 [0,1,0,0,0,0|2,0,0]=3 1059 B11R1.1 CCNCc1ccc(cc1)F 207a_100015525214_100000210084 [0,1,0,0,0,0|2,0,0]=3 1060 B11R1.1 CCNCc1ccc(cc1)F 2230a_100000174882_100000210202 [0,1,0,0,0,0|2,0,0]=3 1061 B11R1.1 CCNCc1ccc(cc1)F 2230a_100015525214_100000198546 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.1 CCNCc1ccc(cc1)F 270004a_100015525214_100000210084 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.1 CCNCc1ccc(cc1)F 34a_100000174882_100000210202 [0,1,0,0,0,0|2,0,0]=3 1064 B11R1.1 CCNCc1ccc(cc1)I 207a_100015525214_100000188517 [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.1 CCNCc1ccc(cc1)I 2230a_100015525214_100000189116 [0,1,0,0,0,0|2,0,0]=3 1066 B11R1.1 CCNCc1ccc(cc1)I 2230a_100016989417_100000210202 [0,1,0,0,0,0|2,0,0]=3 1067 B11R1.1 CCNCc1ccc(cc1)I 34a_100016989417_100000210202 [0,1,0,0,0,0|2,0,0]=3 1068 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [0,1,0,0,0,0|1,0,0]=2 1069 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [0,1,0,0,0,0|1,0,0]=2 1070 B11R1.1 CCNCc1ccc(cn1)Br 207a_100015525214_100000754260 [0,1,0,0,0,0|3,0,0]=4 1071 B11R1.1 CCNCc1ccc(cn1)Br 2230a_100015525214_100000702658 [0,1,0,0,0,0|3,0,0]=4 1072 B11R1.1 CCNCc1ccc(cn1)Br 270004a_100015525214_100000754260 [0,1,0,0,0,0|3,0,0]=4 1073 B11R1.1 CCNCc1ccc(cn1)Br 34a_100015188789_100000210202 [0,1,0,0,0,0|3,0,0]=4 1074 B11R1.1 CCNCc1ccc(cn1)C 207a_100015525214_100000050478 [0,1,0,0,0,0|3,0,0]=4 1075 B11R1.1 CCNCc1ccc(cn1)C 2230a_100015525214_100000691093 [0,1,0,0,0,0|3,0,0]=4 1076 B11R1.1 CCNCc1ccc(cn1)C 270004a_100015525214_100000050478 [0,1,0,0,0,0|3,0,0]=4 1077 B11R1.1 CCNCc1ccc(cn1)C 34a_100015187455_100000210202 [0,1,0,0,0,0|3,0,0]=4 1078 B11R1.1 CCNCc1ccc(cn1)Cl 207a_100015525214_100011361569 [0,1,0,0,0,0|3,0,0]=4 1079 B11R1.1 CCNCc1ccc(cn1)Cl 2230a_100015525214_100012066911 [0,1,0,0,0,0|3,0,0]=4 1080 B11R1.1 CCNCc1ccc(cn1)Cl 270004a_100015525214_100011361569 [0,1,0,0,0,0|3,0,0]=4 1081 B11R1.1 CCNCc1ccc(cn1)Cl 34a_100000697193_100000210202 [0,1,0,0,0,0|3,0,0]=4 1082 B11R1.1 CCNCc1ccc(cn1)F 207a_100015525214_100011934744 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.1 CCNCc1ccc(cn1)F 2230a_100015525214_100000703193 [0,1,0,0,0,0|3,0,0]=4 1084 B11R1.1 CCNCc1ccc(cn1)F 270004a_100015525214_100011934744 [0,1,0,0,0,0|3,0,0]=4 1085 B11R1.1 CCNCc1ccc(cn1)F 34a_100020620131_100000210202 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.1 CCNCc1ccc(nc1)Br 2230a_100009817727_100000210202 [0,1,0,0,0,0|3,0,0]=4 1087 B11R1.1 CCNCc1ccc(nc1)Br 2230a_100015525214_100009831999 [0,1,0,0,0,0|3,0,0]=4 1088 B11R1.1 CCNCc1ccc(nc1)Br 34a_100009817727_100000210202 [0,1,0,0,0,0|3,0,0]=4 1089 B11R1.1 CCNCc1ccc(nc1)C 2230a_100015525214_100016987292 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.1 CCNCc1ccc(nc1)C 270004a_100015525214_100000743784 [0,1,0,0,0,0|3,0,0]=4 1091 B11R1.1 CCNCc1ccc(nc1)C 34a_100000740942_100000210202 [0,1,0,0,0,0|3,0,0]=4 1092 B11R1.1 CCNCc1ccc(nc1)Cl 2230a_100000735879_100000210202 [0,1,0,0,0,0|3,0,0]=4 1093 B11R1.1 CCNCc1ccc(nc1)Cl 2230a_100015525214_100000735431 [0,1,0,0,0,0|3,0,0]=4 1094 B11R1.1 CCNCc1ccc(nc1)Cl 34a_100000735879_100000210202 [0,1,0,0,0,0|3,0,0]=4 1095 B11R1.1 CCNCc1ccc(nc1)F 2230a_100000101913_100000210202 [0,1,0,0,0,0|3,0,0]=4 1096 B11R1.1 CCNCc1ccc(nc1)F 2230a_100015525214_100009820150 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.1 CCNCc1ccc(nc1)F 34a_100000101913_100000210202 [0,1,0,0,0,0|3,0,0]=4 1098 B11R1.1 CCNCc1ccc(nc1)O 207a_100015525214_100011361521 [0,1,0,0,0,0|2,0,0]=3 1099 B11R1.1 CCNCc1ccc(nc1)O 2230a_100000757128_100000210202 [0,1,0,0,0,0|2,0,0]=3 1100 B11R1.1 CCOCc1cc[n+](cc1)C 34a_100009831711_100000210202 [0,1,0,0,0,0|2,0,0]=3 1101 B11R1.1 CCOCc1cc[n+](cc1)[O-] 34a_100000031831_100000210202 [0,1,0,0,0,0|1,0,1]=3 1102 B11R1.1 CCOCc1cc[n+](cc1)[O-] 7a_100000031831_100000210202 [0,1,0,0,0,0|1,0,1]=3 1103 B11R1.1 CCOCc1ccc(=O)[nH]c1 34a_100011999846_100000210202 [0,1,0,0,0,0|1,0,1]=3 1104 B11R1.1 CCOCc1ccc(cc1)Br 34a_100000695286_100000210202 [0,1,0,0,0,0|1,0,0]=2 1105 B11R1.1 CCOCc1ccc(cc1)Br 34a_100121572206_100000189115 [0,1,0,0,0,0|1,0,0]=2 1106 B11R1.1 CCOCc1ccc(cc1)C 34a_100011215236_100000210202 [0,1,0,0,0,0|1,0,0]=2 1107 B11R1.1 CCOCc1ccc(cc1)C 34a_100121572206_100000210814 [0,1,0,0,0,0|1,0,0]=2 1108 B11R1.1 CCOCc1ccc(cc1)C 7a_100011215236_100000210202 [0,1,0,0,0,0|1,0,0]=2 1109 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [0,1,0,0,0,0|1,0,0]=2 1110 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [0,1,0,0,0,0|1,0,0]=2 1111 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [0,1,0,0,0,0|1,0,0]=2 1112 B11R1.1 CCOCc1ccc(cc1)F 34a_100000210977_100000210202 [0,1,0,0,0,0|1,0,0]=2 1113 B11R1.1 CCOCc1ccc(cc1)F 34a_100121572206_100000198546 [0,1,0,0,0,0|1,0,0]=2 1114 B11R1.1 CCOCc1ccc(cc1)F 7a_100000210977_100000210202 [0,1,0,0,0,0|1,0,0]=2 1115 B11R1.1 CCOCc1ccc(cc1)I 34a_100000690907_100000210202 [0,1,0,0,0,0|1,0,0]=2 1116 B11R1.1 CCOCc1ccc(cc1)I 34a_100121572206_100000189116 [0,1,0,0,0,0|1,0,0]=2 1117 B11R1.1 CCOCc1ccc(cc1)I 7a_100000690907_100000210202 [0,1,0,0,0,0|1,0,0]=2 1118 B11R1.1 CCOCc1ccc(cc1)N 34a_100011215238_100000210202 [0,1,0,0,0,0|1,0,0]=2 1119 B11R1.1 CCOCc1ccc(cc1)O 271570a_203496583355_100000758564 [0,1,0,0,0,0|0,0,0]=1 1120 B11R1.1 CCOCc1ccc(cn1)Br 34a_100000754261_100000210202 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.1 CCOCc1ccc(cn1)Br 34a_100121572206_100000702658 [0,1,0,0,0,0|2,0,0]=3 1122 B11R1.1 CCOCc1ccc(cn1)C 34a_100012001401_100000210202 [0,1,0,0,0,0|2,0,0]=3 1123 B11R1.1 CCOCc1ccc(cn1)C 34a_100121572206_100000691093 [0,1,0,0,0,0|2,0,0]=3 1124 B11R1.1 CCOCc1ccc(cn1)Cl 34a_100000703999_100000210202 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.1 CCOCc1ccc(cn1)Cl 34a_100121572206_100012066911 [0,1,0,0,0,0|2,0,0]=3 1126 B11R1.1 CCOCc1ccc(cn1)F 34a_100011999454_100000210202 [0,1,0,0,0,0|2,0,0]=3 1127 B11R1.1 CCOCc1ccc(cn1)F 34a_100121572206_100000703193 [0,1,0,0,0,0|2,0,0]=3 1128 B11R1.1 CCOCc1ccc(cn1)N 34a_100011998161_100000210202 [0,1,0,0,0,0|2,0,0]=3 1129 B11R1.1 CCOCc1ccc(nc1)Br 34a_100009816760_100000210202 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.1 CCOCc1ccc(nc1)Br 34a_100121572206_100009831999 [0,1,0,0,0,0|2,0,0]=3 1131 B11R1.1 CCOCc1ccc(nc1)Br 7a_100009816760_100000210202 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.1 CCOCc1ccc(nc1)C 34a_100011248133_100000210202 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.1 CCOCc1ccc(nc1)C 34a_100121572206_100016987292 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.1 CCOCc1ccc(nc1)Cl 34a_100000755211_100000210202 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.1 CCOCc1ccc(nc1)Cl 34a_100121572206_100000735431 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.1 CCOCc1ccc(nc1)Cl 7a_100000755211_100000210202 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.1 CCOCc1ccc(nc1)F 34a_100000079959_100000210202 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.1 CCOCc1ccc(nc1)F 34a_100121572206_100000099788 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.1 CCOCc1ccc(nc1)N 34a_100000704267_100000210202 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.1 CCOCc1ccc(nc1)O 271570a_203496583355_100011206209 [0,1,0,0,0,0|1,0,0]=2 1141 B11R1.1 CCOCc1ccc(nn1)Cl 34a_100121572206_100016992710 [0,1,0,0,0,0|3,0,0]=4 1142 B11R1.1 CCOCc1cnc(cn1)C 34a_100011273949_100000210202 [0,1,0,0,0,0|3,0,0]=4 1143 B11R1.1 CCOCc1cnc(cn1)Cl 34a_100012002382_100000210202 [0,1,0,0,0,0|3,0,0]=4 1144 B11R1.1 CCOCc1cnc(nc1)C 34a_100011746891_100000210202 [0,1,0,0,0,0|3,0,0]=4 1145 B11R1.1 CCOCc1cnc(nc1)Cl 34a_100009855073_100000210202 [0,1,0,0,0,0|3,0,0]=4 1146 B11R1.1 CCOCc1cnc(nc1)Cl 7a_100009855073_100000210202 [0,1,0,0,0,0|3,0,0]=4 1147 B11R1.1 CCOCc1ncc(cn1)Br 34a_100121572206_100010064664 [0,1,0,0,0,0|3,0,0]=4 1148 B11R1.1 CCOCc1ncc(cn1)C 34a_100121572206_100000685645 [0,1,0,0,0,0|3,0,0]=4 1149 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000189115_100000210202 [0,1,0,0,0,0|1,1,0]=3 1150 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000210202_100000189115 [0,1,0,0,0,0|1,1,0]=3 1151 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210202_100000210814 [0,1,0,0,0,0|1,1,0]=3 1152 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210814_100000210202 [0,1,0,0,0,0|1,1,0]=3 1153 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000187161_100000210202 [0,1,0,0,0,0|1,1,0]=3 1154 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000210202_100000187161 [0,1,0,0,0,0|1,1,0]=3 1155 B11R1.1 CCSCc1ccc(cc1)F 62a_100000198546_100000210202 [0,1,0,0,0,0|1,1,0]=3 1156 B11R1.1 CCSCc1ccc(cc1)F 62a_100000210202_100000187164 [0,1,0,0,0,0|1,1,0]=3 1157 B11R1.1 CCSCc1ccc(cc1)I 62a_100000189116_100000210202 [0,1,0,0,0,0|1,1,0]=3 1158 B11R1.1 CCSCc1ccc(cc1)I 62a_100000210202_100000189116 [0,1,0,0,0,0|1,1,0]=3 1159 B11R1.1 CCSCc1ccc(cn1)Br 62a_100000210202_100000702658 [0,1,0,0,0,0|2,1,0]=4 1160 B11R1.1 CCSCc1ccc(cn1)Br 62a_100000702658_100000210202 [0,1,0,0,0,0|2,1,0]=4 1161 B11R1.1 CCSCc1ccc(cn1)C 62a_100000210202_100000691093 [0,1,0,0,0,0|2,1,0]=4 1162 B11R1.1 CCSCc1ccc(cn1)C 62a_100000691093_100000210202 [0,1,0,0,0,0|2,1,0]=4 1163 B11R1.1 CCSCc1ccc(cn1)Cl 62a_100000210202_100000697101 [0,1,0,0,0,0|2,1,0]=4 1164 B11R1.1 CCSCc1ccc(cn1)Cl 62a_100012066911_100000210202 [0,1,0,0,0,0|2,1,0]=4 1165 B11R1.1 CCSCc1ccc(cn1)F 62a_100000210202_100000703193 [0,1,0,0,0,0|2,1,0]=4 1166 B11R1.1 CCSCc1ccc(cn1)F 62a_100000703193_100000210202 [0,1,0,0,0,0|2,1,0]=4 1167 B11R1.1 CCSCc1ccc(nc1)Br 62a_100000210202_100009831999 [0,1,0,0,0,0|2,1,0]=4 1168 B11R1.1 CCSCc1ccc(nc1)Br 62a_100009831999_100000210202 [0,1,0,0,0,0|2,1,0]=4 1169 B11R1.1 CCSCc1ccc(nc1)C 62a_100000210202_100016987292 [0,1,0,0,0,0|2,1,0]=4 1170 B11R1.1 CCSCc1ccc(nc1)C 62a_100016987292_100000210202 [0,1,0,0,0,0|2,1,0]=4 1171 B11R1.1 CCSCc1ccc(nc1)Cl 62a_100000210202_100000735431 [0,1,0,0,0,0|2,1,0]=4 1172 B11R1.1 CCSCc1ccc(nc1)Cl 62a_100000735431_100000210202 [0,1,0,0,0,0|2,1,0]=4 1173 B11R1.1 CCSCc1ccc(nc1)F 62a_100000210202_100000099788 [0,1,0,0,0,0|2,1,0]=4 1174 B11R1.1 CCSCc1ccc(nc1)F 62a_100009820150_100000210202 [0,1,0,0,0,0|2,1,0]=4 1175 B11R1.1 CNCCc1ccc(cc1)Br 2230a_100000755846_200000210301 [0,1,0,0,0,0|2,0,0]=3 1176 B11R1.1 CNCCc1ccc(cc1)Br 2230a_106832991635_100011740612 [0,1,0,0,0,0|2,0,0]=3 1177 B11R1.1 CNCCc1ccc(cc1)Br 34a_100000755846_200000210301 [0,1,0,0,0,0|2,0,0]=3 1178 B11R1.1 CNCCc1ccc(cc1)Br 34a_100102657272_100011740612 [0,1,0,0,0,0|2,0,0]=3 1179 B11R1.1 CNCCc1ccc(cc1)Br 7a_106832991635_100011740612 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.1 CNCCc1ccc(cc1)C 2230a_100000705350_200000210301 [0,1,0,0,0,0|2,0,0]=3 1181 B11R1.1 CNCCc1ccc(cc1)C 2230a_106832991635_100011713686 [0,1,0,0,0,0|2,0,0]=3 1182 B11R1.1 CNCCc1ccc(cc1)C 34a_100000705350_200000210301 [0,1,0,0,0,0|2,0,0]=3 1183 B11R1.1 CNCCc1ccc(cc1)C 34a_100102657272_100011713686 [0,1,0,0,0,0|2,0,0]=3 1184 B11R1.1 CNCCc1ccc(cc1)C 7a_106832991635_100011713686 [0,1,0,0,0,0|2,0,0]=3 1185 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_100000185265_200000210301 [0,1,0,0,0,0|2,0,0]=3 1186 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_106832991635_100011713675 [0,1,0,0,0,0|2,0,0]=3 1187 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100000185265_200000210301 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100102657272_100011713675 [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.1 CNCCc1ccc(cc1)Cl 7a_106832991635_100011713675 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.1 CNCCc1ccc(cc1)F 2230a_100000199005_200000210301 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.1 CNCCc1ccc(cc1)F 2230a_106832991635_100011217392 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.1 CNCCc1ccc(cc1)F 34a_100000199005_200000210301 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.1 CNCCc1ccc(cc1)F 34a_100102657272_100011217392 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.1 CNCCc1ccc(cc1)F 7a_106832991635_100011217392 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.1 CNCCc1ccc(cc1)O 2230a_106832991635_100009816426 [0,1,0,0,0,0|1,0,0]=2 1196 B11R1.1 CNCCc1ccc(cc1)O 271570a_203496583355_100000752880 [0,1,0,0,0,0|1,0,0]=2 1197 B11R1.1 CNCCc1ccc(cc1)O 34a_100000743037_200000210301 [0,1,0,0,0,0|1,0,0]=2 1198 B11R1.1 CNCCc1ccc(cc1)O 7a_106832991635_100009816426 [0,1,0,0,0,0|1,0,0]=2 1199 B11R1.1 COC=Cc1ccc(cc1)O 271570a_203496583355_100020630460 [0,1,0,0,0,0|1,0,1]=3 1200 B11R1.1 COCCc1ccc(cc1)Br 34a_100000766406_200000210301 [0,1,0,0,0,0|2,0,0]=3 1201 B11R1.1 COCCc1ccc(cc1)Br 34a_100138415774_100011740612 [0,1,0,0,0,0|2,0,0]=3 1202 B11R1.1 COCCc1ccc(cc1)Br 7a_100000766406_200000210301 [0,1,0,0,0,0|2,0,0]=3 1203 B11R1.1 COCCc1ccc(cc1)C 34a_100000756670_200000210301 [0,1,0,0,0,0|2,0,0]=3 1204 B11R1.1 COCCc1ccc(cc1)C 34a_100138415774_100011713686 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.1 COCCc1ccc(cc1)C 7a_100000756670_200000210301 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.1 COCCc1ccc(cc1)Cl 34a_100011219627_200000210301 [0,1,0,0,0,0|2,0,0]=3 1207 B11R1.1 COCCc1ccc(cc1)Cl 34a_100138415774_100011713675 [0,1,0,0,0,0|2,0,0]=3 1208 B11R1.1 COCCc1ccc(cc1)Cl 7a_100011219627_200000210301 [0,1,0,0,0,0|2,0,0]=3 1209 B11R1.1 COCCc1ccc(cc1)F 34a_100000754732_200000210301 [0,1,0,0,0,0|2,0,0]=3 1210 B11R1.1 COCCc1ccc(cc1)F 34a_100138415774_100011217392 [0,1,0,0,0,0|2,0,0]=3 1211 B11R1.1 COCCc1ccc(cc1)F 7a_100000754732_200000210301 [0,1,0,0,0,0|2,0,0]=3 1212 B11R1.1 COCCc1ccc(cc1)I 34a_100012291149_200000210301 [0,1,0,0,0,0|2,0,0]=3 1213 B11R1.1 COCCc1ccc(cc1)I 7a_100012291149_200000210301 [0,1,0,0,0,0|2,0,0]=3 1214 B11R1.1 COCCc1ccc(cc1)N 34a_100011204434_200000210301 [0,1,0,0,0,0|2,0,0]=3 1215 B11R1.1 COCCc1ccc(cc1)O 271570a_203496583355_100000739703 [0,1,0,0,0,0|1,0,0]=2 1216 B11R1.1 COCCc1ccc(cn1)Br 34a_100012357577_200000210301 [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.1 COCCc1ccc(nc1)C 34a_100011815783_200000210301 [0,1,0,0,0,0|3,0,0]=4 1218 B11R1.1 COCCc1ccc(nc1)Cl 34a_100009880866_200000210301 [0,1,0,0,0,0|3,0,0]=4 1219 B11R1.1 COCCc1ccc(nc1)Cl 7a_100009880866_200000210301 [0,1,0,0,0,0|3,0,0]=4 1220 B11R1.1 COCNc1ccc(cc1)Br 2230a_100000210018_100000766300 [0,1,0,0,0,0|2,0,0]=3 1221 B11R1.1 COCNc1ccc(cc1)Cl 2230a_100000210052_100000766300 [0,1,0,0,0,0|2,0,0]=3 1222 B11R1.1 COCOc1ccc(cc1)O 271570a_203496583355_100012265687 [0,1,0,0,0,0|0,0,0]=1 1223 B11R1.1 COCOc1ccc(nc1)O 271570a_203496583355_100012568617 [0,1,0,0,0,0|1,0,0]=2 1224 B11R1.1 COCSc1cc[n+](cc1)[O-] 62a_100000766300_100000039755 [0,1,0,0,0,0|1,1,1]=4 1225 B11R1.1 COCSc1ccc(=O)[nH]c1 62a_100000212171_100000766300 [0,1,0,0,0,0|1,1,1]=4 1226 B11R1.1 COCSc1ccc(=O)[nH]c1 62a_100000766300_100000212171 [0,1,0,0,0,0|1,1,1]=4 1227 B11R1.1 COCSc1ccc(cc1)Br 62a_100000752885_100000766300 [0,1,0,0,0,0|1,1,0]=3 1228 B11R1.1 COCSc1ccc(cc1)Br 62a_100000766300_100000752885 [0,1,0,0,0,0|1,1,0]=3 1229 B11R1.1 COCSc1ccc(cc1)C 62a_100000186775_100000766300 [0,1,0,0,0,0|1,1,0]=3 1230 B11R1.1 COCSc1ccc(cc1)C 62a_100000766300_100000186775 [0,1,0,0,0,0|1,1,0]=3 1231 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000755918_100000766300 [0,1,0,0,0,0|1,1,0]=3 1232 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000766300_100000755918 [0,1,0,0,0,0|1,1,0]=3 1233 B11R1.1 COCSc1ccc(cc1)F 62a_100000211213_100000766300 [0,1,0,0,0,0|1,1,0]=3 1234 B11R1.1 COCSc1ccc(cc1)F 62a_100000766300_100000211213 [0,1,0,0,0,0|1,1,0]=3 1235 B11R1.1 COCSc1ccc(cc1)N 62a_100000185761_100000766300 [0,1,0,0,0,0|1,1,0]=3 1236 B11R1.1 COCSc1ccc(cc1)N 62a_100000766300_100000185761 [0,1,0,0,0,0|1,1,0]=3 1237 B11R1.1 COCSc1ccc(cc1)O 62a_100000766300_100000185759 [0,1,0,0,0,0|0,1,0]=2 1238 B11R1.1 COCSc1ccc(cn1)Br 62a_100000686858_100000766300 [0,1,0,0,0,0|2,1,0]=4 1239 B11R1.1 COCSc1ccc(cn1)Br 62a_100000766300_100000686858 [0,1,0,0,0,0|2,1,0]=4 1240 B11R1.1 COCSc1ccc(cn1)C 62a_100000766300_100000754016 [0,1,0,0,0,0|2,1,0]=4 1241 B11R1.1 COCSc1ccc(cn1)C 62a_100011192072_100000766300 [0,1,0,0,0,0|2,1,0]=4 1242 B11R1.1 COCSc1ccc(cn1)Cl 62a_100000766300_100011356976 [0,1,0,0,0,0|2,1,0]=4 1243 B11R1.1 COCSc1ccc(cn1)Cl 62a_100011356976_100000766300 [0,1,0,0,0,0|2,1,0]=4 1244 B11R1.1 COCSc1ccc(cn1)F 62a_100000744514_100000766300 [0,1,0,0,0,0|2,1,0]=4 1245 B11R1.1 COCSc1ccc(cn1)F 62a_100000766300_100000744514 [0,1,0,0,0,0|2,1,0]=4 1246 B11R1.1 COCSc1ccc(cn1)N 62a_100000737798_100000766300 [0,1,0,0,0,0|2,1,0]=4 1247 B11R1.1 COCSc1ccc(cn1)N 62a_100000766300_100000737798 [0,1,0,0,0,0|2,1,0]=4 1248 B11R1.1 COCSc1ccc(cn1)O 62a_100000685995_100000766300 [0,1,0,0,0,0|1,1,0]=3 1249 B11R1.1 COCSc1ccc(cn1)O 62a_100000766300_100000744096 [0,1,0,0,0,0|1,1,0]=3 1250 B11R1.1 COCSc1ccc(nc1)Br 62a_100000766300_100009814638 [0,1,0,0,0,0|2,1,0]=4 1251 B11R1.1 COCSc1ccc(nc1)Br 62a_100009814638_100000766300 [0,1,0,0,0,0|2,1,0]=4 1252 B11R1.1 COCSc1ccc(nc1)C 62a_100000751577_100000766300 [0,1,0,0,0,0|2,1,0]=4 1253 B11R1.1 COCSc1ccc(nc1)C 62a_100000766300_100000751577 [0,1,0,0,0,0|2,1,0]=4 1254 B11R1.1 COCSc1ccc(nc1)Cl 62a_100000034144_100000766300 [0,1,0,0,0,0|2,1,0]=4 1255 B11R1.1 COCSc1ccc(nc1)Cl 62a_100000766300_100000034144 [0,1,0,0,0,0|2,1,0]=4 1256 B11R1.1 COCSc1ccc(nc1)F 62a_100000042367_100000766300 [0,1,0,0,0,0|2,1,0]=4 1257 B11R1.1 COCSc1ccc(nc1)F 62a_100000766300_100000042367 [0,1,0,0,0,0|2,1,0]=4 1258 B11R1.1 COCSc1ccc(nc1)N 62a_100000187370_100000766300 [0,1,0,0,0,0|2,1,0]=4 1259 B11R1.1 COCSc1ccc(nc1)N 62a_100000766300_100000187370 [0,1,0,0,0,0|2,1,0]=4 1260 B11R1.1 COCSc1cnc(cn1)O 62a_100000766300_100015839800 [0,1,0,0,0,0|2,1,0]=4 1261 B11R1.1 COCSc1cnc(cn1)O 62a_100011934580_100000766300 [0,1,0,0,0,0|2,1,0]=4 1262 B11R1.1 COCSc1ncc(cn1)O 62a_100000730009_100000766300 [0,1,0,0,0,0|2,1,0]=4 1263 B11R1.1 COCSc1ncc(cn1)O 62a_100000766300_100000092845 [0,1,0,0,0,0|2,1,0]=4 1264 B11R1.1 CSCCc1ccc(cc1)Br 62a_100011740612_200000210301 [0,1,0,0,0,0|2,0,0]=3 1265 B11R1.1 CSCCc1ccc(cc1)Br 62a_200000210301_100011740612 [0,1,0,0,0,0|2,0,0]=3 1266 B11R1.1 CSCCc1ccc(cc1)C 62a_100011713686_200000210301 [0,1,0,0,0,0|2,0,0]=3 1267 B11R1.1 CSCCc1ccc(cc1)C 62a_200000210301_100011713686 [0,1,0,0,0,0|2,0,0]=3 1268 B11R1.1 CSCCc1ccc(cc1)Cl 62a_100011713675_200000210301 [0,1,0,0,0,0|2,0,0]=3 1269 B11R1.1 CSCCc1ccc(cc1)Cl 62a_200000210301_100011713675 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.1 CSCCc1ccc(cc1)F 62a_100011217392_200000210301 [0,1,0,0,0,0|2,0,0]=3 1271 B11R1.1 CSCCc1ccc(cc1)F 62a_200000210301_100011217392 [0,1,0,0,0,0|2,0,0]=3 1272 B11R1.1 CSCCc1ccc(cc1)O 62a_100009816426_200000210301 [0,1,0,0,0,0|1,0,0]=2 1273 B11R1.1 CSCCc1ccc(cc1)O 62a_200000210301_100009816426 [0,1,0,0,0,0|1,0,0]=2 1274 B11R1.1 CSCNc1ccc(cc1)Br 2230a_100000210018_100011218213 [0,1,0,0,0,0|2,0,0]=3 1275 B11R1.1 CSCNc1ccc(cc1)Br 34a_100000210018_100011218213 [0,1,0,0,0,0|2,0,0]=3 1276 B11R1.1 CSCNc1ccc(cc1)C 34a_100000124888_100011218213 [0,1,0,0,0,0|2,0,0]=3 1277 B11R1.1 CSCNc1ccc(cc1)Cl 2230a_100000210052_100011218213 [0,1,0,0,0,0|2,0,0]=3 1278 B11R1.1 CSCNc1ccc(cc1)Cl 34a_100000210052_100011218213 [0,1,0,0,0,0|2,0,0]=3 1279 B11R1.1 CSCNc1ccc(cc1)F 34a_100000185862_100011218213 [0,1,0,0,0,0|2,0,0]=3 1280 B11R1.1 CSCNc1ccc(cc1)I 34a_100000185761_100011218213 [0,1,0,0,0,0|2,0,0]=3 1281 B11R1.1 CSCNc1ccc(cc1)O 34a_100000185829_100011218213 [0,1,0,0,0,0|1,0,0]=2 1282 B11R1.1 CSCOc1ccc(=O)[nH]c1 34a_100000075641_100011218213 [0,1,0,0,0,0|1,0,1]=3 1283 B11R1.1 CSCOc1ccc(cc1)Br 34a_100000185759_100011218213 [0,1,0,0,0,0|1,0,0]=2 1284 B11R1.1 CSCOc1ccc(cc1)C 34a_100000210336_100011218213 [0,1,0,0,0,0|1,0,0]=2 1285 B11R1.1 CSCOc1ccc(cc1)Cl 34a_100000210216_100011218213 [0,1,0,0,0,0|1,0,0]=2 1286 B11R1.1 CSCOc1ccc(cc1)F 34a_100000210339_100011218213 [0,1,0,0,0,0|1,0,0]=2 1287 B11R1.1 CSCOc1ccc(cc1)I 34a_100000212066_100011218213 [0,1,0,0,0,0|1,0,0]=2 1288 B11R1.1 CSCOc1ccc(cc1)N 34a_100000185829_100011218213 [0,1,0,0,0,0|1,0,0]=2 1289 B11R1.1 CSCOc1ccc(cn1)C 34a_100000759353_100011218213 [0,1,0,0,0,0|2,0,0]=3 1290 B11R1.1 CSCOc1ccc(cn1)Cl 34a_100011215309_100011218213 [0,1,0,0,0,0|2,0,0]=3 1291 B11R1.1 CSCOc1ccc(cn1)F 34a_100000742473_100011218213 [0,1,0,0,0,0|2,0,0]=3 1292 B11R1.1 CSCOc1ccc(cn1)N 34a_100000729260_100011218213 [0,1,0,0,0,0|2,0,0]=3 1293 B11R1.1 CSCOc1ccc(nc1)Br 34a_100000685995_100011218213 [0,1,0,0,0,0|2,0,0]=3 1294 B11R1.1 CSCOc1ccc(nc1)C 34a_100000745506_100011218213 [0,1,0,0,0,0|2,0,0]=3 1295 B11R1.1 CSCOc1ccc(nc1)Cl 34a_100000744096_100011218213 [0,1,0,0,0,0|2,0,0]=3 1296 B11R1.1 CSCOc1ccc(nc1)F 34a_100000688820_100011218213 [0,1,0,0,0,0|2,0,0]=3 1297 B11R1.1 CSCOc1ccc(nc1)I 34a_100000687607_100011218213 [0,1,0,0,0,0|2,0,0]=3 1298 B11R1.1 CSCOc1ccc(nc1)N 34a_100015188713_100011218213 [0,1,0,0,0,0|2,0,0]=3 1299 B11R1.1 CSCOc1cnc(cn1)Br 34a_100011934580_100011218213 [0,1,0,0,0,0|3,0,0]=4 1300 B11R1.1 CSCOc1cnc(cn1)Cl 34a_100015839800_100011218213 [0,1,0,0,0,0|3,0,0]=4 1301 B11R1.1 CSCOc1cnc(nc1)Br 34a_100000730009_100011218213 [0,1,0,0,0,0|3,0,0]=4 1302 B11R1.1 CSCOc1cnc(nc1)C 34a_100000062939_100011218213 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.1 CSCOc1cnc(nc1)Cl 34a_100000092845_100011218213 [0,1,0,0,0,0|3,0,0]=4 1304 B11R1.1 CSCOc1cnc(nc1)F 34a_200009874573_100011218213 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.1 CSCOc1cnc(nc1)N 34a_100000087137_100011218213 [0,1,0,0,0,0|3,0,0]=4 1306 B11R1.1 CSCOc1ncc(cn1)F 34a_100011934040_100011218213 [0,1,0,0,0,0|3,0,0]=4 1307 B11R1.1 CSCSc1cc[n+](cc1)[O-] 62a_100011218213_100000039755 [0,1,0,0,0,0|1,1,1]=4 1308 B11R1.1 CSCSc1ccc(=O)[nH]c1 62a_100000212171_100011218213 [0,1,0,0,0,0|1,1,1]=4 1309 B11R1.1 CSCSc1ccc(=O)[nH]c1 62a_100011218213_100000212171 [0,1,0,0,0,0|1,1,1]=4 1310 B11R1.1 CSCSc1ccc(cc1)Br 62a_100000752885_100011218213 [0,1,0,0,0,0|1,1,0]=3 1311 B11R1.1 CSCSc1ccc(cc1)Br 62a_100011218213_100000752885 [0,1,0,0,0,0|1,1,0]=3 1312 B11R1.1 CSCSc1ccc(cc1)C 62a_100000186775_100011218213 [0,1,0,0,0,0|1,1,0]=3 1313 B11R1.1 CSCSc1ccc(cc1)C 62a_100011218213_100000186775 [0,1,0,0,0,0|1,1,0]=3 1314 B11R1.1 CSCSc1ccc(cc1)Cl 62a_100000755918_100011218213 [0,1,0,0,0,0|1,1,0]=3 1315 B11R1.1 CSCSc1ccc(cc1)Cl 62a_100011218213_100000755918 [0,1,0,0,0,0|1,1,0]=3 1316 B11R1.1 CSCSc1ccc(cc1)F 62a_100000211213_100011218213 [0,1,0,0,0,0|1,1,0]=3 1317 B11R1.1 CSCSc1ccc(cc1)F 62a_100011218213_100000211213 [0,1,0,0,0,0|1,1,0]=3 1318 B11R1.1 CSCSc1ccc(cc1)N 62a_100000185761_100011218213 [0,1,0,0,0,0|1,1,0]=3 1319 B11R1.1 CSCSc1ccc(cc1)N 62a_100011218213_100000185761 [0,1,0,0,0,0|1,1,0]=3 1320 B11R1.1 CSCSc1ccc(cc1)O 62a_100011218213_100000185759 [0,1,0,0,0,0|0,1,0]=2 1321 B11R1.1 CSCSc1ccc(cn1)Br 62a_100000686858_100011218213 [0,1,0,0,0,0|2,1,0]=4 1322 B11R1.1 CSCSc1ccc(cn1)Br 62a_100011218213_100000686858 [0,1,0,0,0,0|2,1,0]=4 1323 B11R1.1 CSCSc1ccc(cn1)C 62a_100011192072_100011218213 [0,1,0,0,0,0|2,1,0]=4 1324 B11R1.1 CSCSc1ccc(cn1)C 62a_100011218213_100000754016 [0,1,0,0,0,0|2,1,0]=4 1325 B11R1.1 CSCSc1ccc(cn1)Cl 62a_100011218213_100011356976 [0,1,0,0,0,0|2,1,0]=4 1326 B11R1.1 CSCSc1ccc(cn1)Cl 62a_100011356976_100011218213 [0,1,0,0,0,0|2,1,0]=4 1327 B11R1.1 CSCSc1ccc(cn1)F 62a_100000744514_100011218213 [0,1,0,0,0,0|2,1,0]=4 1328 B11R1.1 CSCSc1ccc(cn1)F 62a_100011218213_100000744514 [0,1,0,0,0,0|2,1,0]=4 1329 B11R1.1 CSCSc1ccc(cn1)N 62a_100000737798_100011218213 [0,1,0,0,0,0|2,1,0]=4 1330 B11R1.1 CSCSc1ccc(cn1)N 62a_100011218213_100000737798 [0,1,0,0,0,0|2,1,0]=4 1331 B11R1.1 CSCSc1ccc(cn1)O 62a_100000685995_100011218213 [0,1,0,0,0,0|1,1,0]=3 1332 B11R1.1 CSCSc1ccc(cn1)O 62a_100011218213_100000744096 [0,1,0,0,0,0|1,1,0]=3 1333 B11R1.1 CSCSc1ccc(nc1)Br 62a_100009814638_100011218213 [0,1,0,0,0,0|2,1,0]=4 1334 B11R1.1 CSCSc1ccc(nc1)Br 62a_100011218213_100009814638 [0,1,0,0,0,0|2,1,0]=4 1335 B11R1.1 CSCSc1ccc(nc1)C 62a_100000751577_100011218213 [0,1,0,0,0,0|2,1,0]=4 1336 B11R1.1 CSCSc1ccc(nc1)C 62a_100011218213_100000751577 [0,1,0,0,0,0|2,1,0]=4 1337 B11R1.1 CSCSc1ccc(nc1)Cl 62a_100000034144_100011218213 [0,1,0,0,0,0|2,1,0]=4 1338 B11R1.1 CSCSc1ccc(nc1)Cl 62a_100011218213_100000034144 [0,1,0,0,0,0|2,1,0]=4 1339 B11R1.1 CSCSc1ccc(nc1)F 62a_100000042367_100011218213 [0,1,0,0,0,0|2,1,0]=4 1340 B11R1.1 CSCSc1ccc(nc1)F 62a_100011218213_100000042367 [0,1,0,0,0,0|2,1,0]=4 1341 B11R1.1 CSCSc1ccc(nc1)N 62a_100000187370_100011218213 [0,1,0,0,0,0|2,1,0]=4 1342 B11R1.1 CSCSc1ccc(nc1)N 62a_100011218213_100000187370 [0,1,0,0,0,0|2,1,0]=4 1343 B11R1.1 CSCSc1cnc(cn1)O 62a_100011218213_100015839800 [0,1,0,0,0,0|2,1,0]=4 1344 B11R1.1 CSCSc1cnc(cn1)O 62a_100011934580_100011218213 [0,1,0,0,0,0|2,1,0]=4 1345 B11R1.1 CSCSc1ncc(cn1)O 62a_100000730009_100011218213 [0,1,0,0,0,0|2,1,0]=4 1346 B11R1.1 CSCSc1ncc(cn1)O 62a_100011218213_100000092845 [0,1,0,0,0,0|2,1,0]=4 1347 B11R1.1 C[n+]1ccc(cc1)COCF 34a_100009831711_100015361967 [0,1,0,0,0,0|3,0,0]=4 1348 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 2230a_100000705350_200025704644 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 34a_100000705350_200025704644 [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 34a_100000756670_200025704644 [0,1,0,0,0,0|2,0,0]=3 1351 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 7a_100000756670_200025704644 [0,1,0,0,0,0|2,0,0]=3 1352 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_100011713686_200025704644 [0,1,0,0,0,0|2,0,0]=3 1353 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713686 [0,1,0,0,0,0|2,0,0]=3 1354 B11R1.1 Cc1ccc(cc1)CNCF 34a_100000174908_100015361967 [0,1,0,0,0,0|3,0,0]=4 1355 B11R1.1 Cc1ccc(cc1)COCF 34a_100011215236_100015361967 [0,1,0,0,0,0|2,0,0]=3 1356 B11R1.1 Cc1ccc(cc1)COCF 7a_100011215236_100015361967 [0,1,0,0,0,0|2,0,0]=3 1357 B11R1.1 Cc1ccc(cc1)CSCF 62a_100000210814_100015361967 [0,1,0,0,0,0|2,1,0]=4 1358 B11R1.1 Cc1ccc(cc1)CSCF 62a_100015361967_100000210814 [0,1,0,0,0,0|2,1,0]=4 1359 B11R1.1 Cc1ccc(cc1)NCC=O 34a_100000124888_200009817547 [0,1,0,0,0,0|2,0,1]=4 1360 B11R1.1 Cc1ccc(cc1)NCCF 34a_100000124888_100011217306 [0,1,0,0,0,0|2,0,0]=3 1361 B11R1.1 Cc1ccc(cc1)NCCO 34a_100000124888_100000211926 [0,1,0,0,0,0|2,0,0]=3 1362 B11R1.1 Cc1ccc(cc1)OCC#N 7a_100000210336_100011215382 [0,1,0,0,0,0|1,0,1]=3 1363 B11R1.1 Cc1ccc(cc1)OCC=O 34a_100000210336_200009817547 [0,1,0,0,0,0|1,0,1]=3 1364 B11R1.1 Cc1ccc(cc1)OCC=O 7a_100000210336_200015260668 [0,1,0,0,0,0|1,0,1]=3 1365 B11R1.1 Cc1ccc(cc1)OCCF 34a_100000210336_100011217306 [0,1,0,0,0,0|1,0,0]=2 1366 B11R1.1 Cc1ccc(cc1)OCCF 7a_100000210336_100011217306 [0,1,0,0,0,0|1,0,0]=2 1367 B11R1.1 Cc1ccc(cc1)OCCO 34a_100000210336_100000211926 [0,1,0,0,0,0|1,0,0]=2 1368 B11R1.1 Cc1ccc(cc1)OCCO 7a_100000210336_100000211926 [0,1,0,0,0,0|1,0,0]=2 1369 B11R1.1 Cc1ccc(cc1)SCC#N 62a_100000186775_100011215382 [0,1,0,0,0,0|1,1,1]=4 1370 B11R1.1 Cc1ccc(cc1)SCC#N 62a_100011215382_100000186775 [0,1,0,0,0,0|1,1,1]=4 1371 B11R1.1 Cc1ccc(cc1)SCC=O 62a_100000186775_200015260668 [0,1,0,0,0,0|1,1,1]=4 1372 B11R1.1 Cc1ccc(cc1)SCC=O 62a_200015260668_100000186775 [0,1,0,0,0,0|1,1,1]=4 1373 B11R1.1 Cc1ccc(cc1)SCCF 62a_100000186775_100011217306 [0,1,0,0,0,0|1,1,0]=3 1374 B11R1.1 Cc1ccc(cc1)SCCF 62a_100011217306_100000186775 [0,1,0,0,0,0|1,1,0]=3 1375 B11R1.1 Cc1ccc(cc1)SCCO 62a_100000186775_100000211926 [0,1,0,0,0,0|1,1,0]=3 1376 B11R1.1 Cc1ccc(cc1)SCCO 62a_100000211926_100000186775 [0,1,0,0,0,0|1,1,0]=3 1377 B11R1.1 Cc1ccc(cn1)CCO[13CH3] 34a_100011815783_200025704644 [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.1 Cc1ccc(cn1)COCF 34a_100011248133_100015361967 [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.1 Cc1ccc(cn1)OCC#N 7a_100000745506_100011215382 [0,1,0,0,0,0|2,0,1]=4 1380 B11R1.1 Cc1ccc(cn1)OCC=O 34a_100000745506_200009817547 [0,1,0,0,0,0|2,0,1]=4 1381 B11R1.1 Cc1ccc(cn1)OCC=O 7a_100000745506_200015260668 [0,1,0,0,0,0|2,0,1]=4 1382 B11R1.1 Cc1ccc(cn1)OCCF 34a_100000745506_100011217306 [0,1,0,0,0,0|2,0,0]=3 1383 B11R1.1 Cc1ccc(cn1)OCCF 7a_100000745506_100011217306 [0,1,0,0,0,0|2,0,0]=3 1384 B11R1.1 Cc1ccc(cn1)OCCO 34a_100000745506_100000211926 [0,1,0,0,0,0|2,0,0]=3 1385 B11R1.1 Cc1ccc(cn1)OCCO 7a_100000745506_100000211926 [0,1,0,0,0,0|2,0,0]=3 1386 B11R1.1 Cc1ccc(cn1)SCCF 62a_100000751577_100011217306 [0,1,0,0,0,0|2,1,0]=4 1387 B11R1.1 Cc1ccc(cn1)SCCF 62a_100011217306_100000751577 [0,1,0,0,0,0|2,1,0]=4 1388 B11R1.1 Cc1ccc(cn1)SCCO 62a_100000211926_100000751577 [0,1,0,0,0,0|2,1,0]=4 1389 B11R1.1 Cc1ccc(cn1)SCCO 62a_100000751577_100000211926 [0,1,0,0,0,0|2,1,0]=4 1390 B11R1.1 Cc1ccc(nc1)COCF 34a_100012001401_100015361967 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.1 Cc1ccc(nc1)OCC=O 34a_100000759353_200009817547 [0,1,0,0,0,0|2,0,1]=4 1392 B11R1.1 Cc1ccc(nc1)OCCF 34a_100000759353_100011217306 [0,1,0,0,0,0|2,0,0]=3 1393 B11R1.1 Cc1ccc(nc1)OCCO 34a_100000759353_100000211926 [0,1,0,0,0,0|2,0,0]=3 1394 B11R1.1 Cc1ccc(nc1)SCCF 62a_100011192072_100011217306 [0,1,0,0,0,0|2,1,0]=4 1395 B11R1.1 Cc1ccc(nc1)SCCF 62a_100011217306_100000754016 [0,1,0,0,0,0|2,1,0]=4 1396 B11R1.1 Cc1ccc(nc1)SCCO 62a_100000211926_100000754016 [0,1,0,0,0,0|2,1,0]=4 1397 B11R1.1 Cc1ccc(nc1)SCCO 62a_100011192072_100000211926 [0,1,0,0,0,0|2,1,0]=4 1398 B11R1.1 Cc1ncc(cn1)OCCF 34a_100000062939_100011217306 [0,1,0,0,0,0|3,0,0]=4 1399 B11R1.1 Cc1ncc(cn1)OCCF 7a_100000062939_100011217306 [0,1,0,0,0,0|3,0,0]=4 1400 B11R1.1 Cc1ncc(cn1)OCCO 34a_100000062939_100000211926 [0,1,0,0,0,0|3,0,0]=4 1401 B11R1.1 Cc1ncc(cn1)OCCO 7a_100000062939_100000211926 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.1 FCCNc1ccc(cc1)Br 2230a_100000210018_100011217306 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.1 FCCNc1ccc(cc1)Br 34a_100000210018_100011217306 [0,1,0,0,0,0|2,0,0]=3 1404 B11R1.1 FCCNc1ccc(cc1)Cl 2230a_100000210052_100011217306 [0,1,0,0,0,0|2,0,0]=3 1405 B11R1.1 FCCNc1ccc(cc1)Cl 34a_100000210052_100011217306 [0,1,0,0,0,0|2,0,0]=3 1406 B11R1.1 FCCNc1ccc(cc1)F 34a_100000185862_100011217306 [0,1,0,0,0,0|2,0,0]=3 1407 B11R1.1 FCCNc1ccc(cc1)I 34a_100000185761_100011217306 [0,1,0,0,0,0|2,0,0]=3 1408 B11R1.1 FCCOc1ccc(cc1)Br 34a_100000185759_100011217306 [0,1,0,0,0,0|1,0,0]=2 1409 B11R1.1 FCCOc1ccc(cc1)Br 7a_100000185759_100011217306 [0,1,0,0,0,0|1,0,0]=2 1410 B11R1.1 FCCOc1ccc(cc1)Cl 34a_100000210216_100011217306 [0,1,0,0,0,0|1,0,0]=2 1411 B11R1.1 FCCOc1ccc(cc1)Cl 7a_100000210216_100011217306 [0,1,0,0,0,0|1,0,0]=2 1412 B11R1.1 FCCOc1ccc(cc1)F 34a_100000210339_100011217306 [0,1,0,0,0,0|1,0,0]=2 1413 B11R1.1 FCCOc1ccc(cc1)I 34a_100000212066_100011217306 [0,1,0,0,0,0|1,0,0]=2 1414 B11R1.1 FCCOc1ccc(cc1)I 7a_100000212066_100011217306 [0,1,0,0,0,0|1,0,0]=2 1415 B11R1.1 FCCOc1ccc(cn1)Cl 34a_100011215309_100011217306 [0,1,0,0,0,0|2,0,0]=3 1416 B11R1.1 FCCOc1ccc(cn1)F 34a_100000742473_100011217306 [0,1,0,0,0,0|2,0,0]=3 1417 B11R1.1 FCCOc1ccc(nc1)Br 34a_100000685995_100011217306 [0,1,0,0,0,0|2,0,0]=3 1418 B11R1.1 FCCOc1ccc(nc1)Br 7a_100000685995_100011217306 [0,1,0,0,0,0|2,0,0]=3 1419 B11R1.1 FCCOc1ccc(nc1)Cl 34a_100000744096_100011217306 [0,1,0,0,0,0|2,0,0]=3 1420 B11R1.1 FCCOc1ccc(nc1)Cl 7a_100000744096_100011217306 [0,1,0,0,0,0|2,0,0]=3 1421 B11R1.1 FCCOc1ccc(nc1)F 34a_100000688820_100011217306 [0,1,0,0,0,0|2,0,0]=3 1422 B11R1.1 FCCOc1ccc(nc1)F 7a_100000688820_100011217306 [0,1,0,0,0,0|2,0,0]=3 1423 B11R1.1 FCCOc1ccc(nc1)I 34a_100000687607_100011217306 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.1 FCCOc1ccc(nc1)I 7a_100000687607_100011217306 [0,1,0,0,0,0|2,0,0]=3 1425 B11R1.1 FCCOc1cnc(cn1)Br 34a_100011934580_100011217306 [0,1,0,0,0,0|3,0,0]=4 1426 B11R1.1 FCCOc1cnc(cn1)Cl 34a_100015839800_100011217306 [0,1,0,0,0,0|3,0,0]=4 1427 B11R1.1 FCCOc1cnc(nc1)Br 34a_100000730009_100011217306 [0,1,0,0,0,0|3,0,0]=4 1428 B11R1.1 FCCOc1cnc(nc1)Br 7a_100000730009_100011217306 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.1 FCCOc1cnc(nc1)Cl 34a_100000092845_100011217306 [0,1,0,0,0,0|3,0,0]=4 1430 B11R1.1 FCCOc1cnc(nc1)Cl 7a_100000092845_100011217306 [0,1,0,0,0,0|3,0,0]=4 1431 B11R1.1 FCCOc1cnc(nc1)F 34a_200009874573_100011217306 [0,1,0,0,0,0|3,0,0]=4 1432 B11R1.1 FCCOc1cnc(nc1)F 7a_200009874573_100011217306 [0,1,0,0,0,0|3,0,0]=4 1433 B11R1.1 FCCOc1ncc(cn1)F 34a_100011934040_100011217306 [0,1,0,0,0,0|3,0,0]=4 1434 B11R1.1 FCCSc1ccc(cc1)Br 62a_100000752885_100011217306 [0,1,0,0,0,0|1,1,0]=3 1435 B11R1.1 FCCSc1ccc(cc1)Br 62a_100011217306_100000752885 [0,1,0,0,0,0|1,1,0]=3 1436 B11R1.1 FCCSc1ccc(cc1)Cl 62a_100000755918_100011217306 [0,1,0,0,0,0|1,1,0]=3 1437 B11R1.1 FCCSc1ccc(cc1)Cl 62a_100011217306_100000755918 [0,1,0,0,0,0|1,1,0]=3 1438 B11R1.1 FCCSc1ccc(cc1)F 62a_100000211213_100011217306 [0,1,0,0,0,0|1,1,0]=3 1439 B11R1.1 FCCSc1ccc(cc1)F 62a_100011217306_100000211213 [0,1,0,0,0,0|1,1,0]=3 1440 B11R1.1 FCCSc1ccc(cn1)Br 62a_100000686858_100011217306 [0,1,0,0,0,0|2,1,0]=4 1441 B11R1.1 FCCSc1ccc(cn1)Br 62a_100011217306_100000686858 [0,1,0,0,0,0|2,1,0]=4 1442 B11R1.1 FCCSc1ccc(cn1)Cl 62a_100011217306_100011356976 [0,1,0,0,0,0|2,1,0]=4 1443 B11R1.1 FCCSc1ccc(cn1)Cl 62a_100011356976_100011217306 [0,1,0,0,0,0|2,1,0]=4 1444 B11R1.1 FCCSc1ccc(cn1)F 62a_100000744514_100011217306 [0,1,0,0,0,0|2,1,0]=4 1445 B11R1.1 FCCSc1ccc(cn1)F 62a_100011217306_100000744514 [0,1,0,0,0,0|2,1,0]=4 1446 B11R1.1 FCCSc1ccc(nc1)Br 62a_100009814638_100011217306 [0,1,0,0,0,0|2,1,0]=4 1447 B11R1.1 FCCSc1ccc(nc1)Br 62a_100011217306_100009814638 [0,1,0,0,0,0|2,1,0]=4 1448 B11R1.1 FCCSc1ccc(nc1)Cl 62a_100000034144_100011217306 [0,1,0,0,0,0|2,1,0]=4 1449 B11R1.1 FCCSc1ccc(nc1)Cl 62a_100011217306_100000034144 [0,1,0,0,0,0|2,1,0]=4 1450 B11R1.1 FCCSc1ccc(nc1)F 62a_100000042367_100011217306 [0,1,0,0,0,0|2,1,0]=4 1451 B11R1.1 FCCSc1ccc(nc1)F 62a_100011217306_100000042367 [0,1,0,0,0,0|2,1,0]=4 1452 B11R1.1 FCNCc1ccc(cc1)Br 34a_100000174875_100015361967 [0,1,0,0,0,0|3,0,0]=4 1453 B11R1.1 FCNCc1ccc(cc1)Cl 34a_100000174871_100015361967 [0,1,0,0,0,0|3,0,0]=4 1454 B11R1.1 FCNCc1ccc(cc1)F 34a_100000174882_100015361967 [0,1,0,0,0,0|3,0,0]=4 1455 B11R1.1 FCNCc1ccc(cc1)I 34a_100016989417_100015361967 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.1 FCOCc1ccc(cc1)Br 34a_100000695286_100015361967 [0,1,0,0,0,0|2,0,0]=3 1457 B11R1.1 FCOCc1ccc(cc1)Cl 34a_100000211118_100015361967 [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.1 FCOCc1ccc(cc1)Cl 7a_100000211118_100015361967 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.1 FCOCc1ccc(cc1)F 34a_100000210977_100015361967 [0,1,0,0,0,0|2,0,0]=3 1460 B11R1.1 FCOCc1ccc(cc1)F 7a_100000210977_100015361967 [0,1,0,0,0,0|2,0,0]=3 1461 B11R1.1 FCOCc1ccc(cc1)I 34a_100000690907_100015361967 [0,1,0,0,0,0|2,0,0]=3 1462 B11R1.1 FCOCc1ccc(cc1)I 7a_100000690907_100015361967 [0,1,0,0,0,0|2,0,0]=3 1463 B11R1.1 FCOCc1ccc(cn1)Br 34a_100000754261_100015361967 [0,1,0,0,0,0|3,0,0]=4 1464 B11R1.1 FCOCc1ccc(cn1)Cl 34a_100000703999_100015361967 [0,1,0,0,0,0|3,0,0]=4 1465 B11R1.1 FCOCc1ccc(cn1)F 34a_100011999454_100015361967 [0,1,0,0,0,0|3,0,0]=4 1466 B11R1.1 FCOCc1ccc(nc1)Br 34a_100009816760_100015361967 [0,1,0,0,0,0|3,0,0]=4 1467 B11R1.1 FCOCc1ccc(nc1)Br 7a_100009816760_100015361967 [0,1,0,0,0,0|3,0,0]=4 1468 B11R1.1 FCOCc1ccc(nc1)Cl 34a_100000755211_100015361967 [0,1,0,0,0,0|3,0,0]=4 1469 B11R1.1 FCOCc1ccc(nc1)Cl 7a_100000755211_100015361967 [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.1 FCOCc1ccc(nc1)F 34a_100000079959_100015361967 [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.1 FCSCc1ccc(cc1)Br 62a_100000189115_100015361967 [0,1,0,0,0,0|2,1,0]=4 1472 B11R1.1 FCSCc1ccc(cc1)Br 62a_100015361967_100000189115 [0,1,0,0,0,0|2,1,0]=4 1473 B11R1.1 FCSCc1ccc(cc1)Cl 62a_100000187161_100015361967 [0,1,0,0,0,0|2,1,0]=4 1474 B11R1.1 FCSCc1ccc(cc1)Cl 62a_100015361967_100000187161 [0,1,0,0,0,0|2,1,0]=4 1475 B11R1.1 FCSCc1ccc(cc1)F 62a_100000198546_100015361967 [0,1,0,0,0,0|2,1,0]=4 1476 B11R1.1 FCSCc1ccc(cc1)F 62a_100015361967_100000187164 [0,1,0,0,0,0|2,1,0]=4 1477 B11R1.1 FCSCc1ccc(cc1)I 62a_100000189116_100015361967 [0,1,0,0,0,0|2,1,0]=4 1478 B11R1.1 FCSCc1ccc(cc1)I 62a_100015361967_100000189116 [0,1,0,0,0,0|2,1,0]=4 1479 B11R1.1 N#CCCc1ccc(cc1)O 271570a_203496583355_100011216407 [0,1,0,0,0,0|1,0,1]=3 1480 B11R1.1 N#CCNc1ccc(cc1)Br 2230a_100000210018_100011215382 [0,1,0,0,0,0|2,0,1]=4 1481 B11R1.1 N#CCNc1ccc(cc1)Cl 2230a_100000210052_100011215382 [0,1,0,0,0,0|2,0,1]=4 1482 B11R1.1 N#CCOc1ccc(cc1)Br 7a_100000185759_100011215382 [0,1,0,0,0,0|1,0,1]=3 1483 B11R1.1 N#CCOc1ccc(cc1)Cl 7a_100000210216_100011215382 [0,1,0,0,0,0|1,0,1]=3 1484 B11R1.1 N#CCOc1ccc(cc1)I 7a_100000212066_100011215382 [0,1,0,0,0,0|1,0,1]=3 1485 B11R1.1 N#CCOc1ccc(cc1)O 271570a_203496583355_200000169425 [0,1,0,0,0,0|0,0,1]=2 1486 B11R1.1 N#CCOc1ccc(nc1)Br 7a_100000685995_100011215382 [0,1,0,0,0,0|2,0,1]=4 1487 B11R1.1 N#CCOc1ccc(nc1)Cl 7a_100000744096_100011215382 [0,1,0,0,0,0|2,0,1]=4 1488 B11R1.1 N#CCOc1ccc(nc1)F 7a_100000688820_100011215382 [0,1,0,0,0,0|2,0,1]=4 1489 B11R1.1 N#CCOc1ccc(nc1)I 7a_100000687607_100011215382 [0,1,0,0,0,0|2,0,1]=4 1490 B11R1.1 N#CCOc1ccc(nc1)N 7a_100015188713_100011215382 [0,1,0,0,0,0|2,0,1]=4 1491 B11R1.1 N#CCSc1ccc(cc1)Br 62a_100000752885_100011215382 [0,1,0,0,0,0|1,1,1]=4 1492 B11R1.1 N#CCSc1ccc(cc1)Br 62a_100011215382_100000752885 [0,1,0,0,0,0|1,1,1]=4 1493 B11R1.1 N#CCSc1ccc(cc1)Cl 62a_100000755918_100011215382 [0,1,0,0,0,0|1,1,1]=4 1494 B11R1.1 N#CCSc1ccc(cc1)Cl 62a_100011215382_100000755918 [0,1,0,0,0,0|1,1,1]=4 1495 B11R1.1 N#CCSc1ccc(cc1)F 62a_100000211213_100011215382 [0,1,0,0,0,0|1,1,1]=4 1496 B11R1.1 N#CCSc1ccc(cc1)F 62a_100011215382_100000211213 [0,1,0,0,0,0|1,1,1]=4 1497 B11R1.1 N#CCSc1ccc(cc1)N 62a_100000185761_100011215382 [0,1,0,0,0,0|1,1,1]=4 1498 B11R1.1 N#CCSc1ccc(cc1)N 62a_100011215382_100000185761 [0,1,0,0,0,0|1,1,1]=4 1499 B11R1.1 N#CCSc1ccc(cc1)O 62a_100011215382_100000185759 [0,1,0,0,0,0|0,1,1]=3 1500 B11R1.1 N#CCSc1ccc(cn1)O 62a_100000685995_100011215382 [0,1,0,0,0,0|1,1,1]=4 1501 B11R1.1 N#CCSc1ccc(cn1)O 62a_100011215382_100000744096 [0,1,0,0,0,0|1,1,1]=4 1502 B11R1.1 N#CSCc1ccc(cc1)O 271570a_203496583355_200010141448 [0,1,0,0,0,0|1,1,1]=4 1503 B11R1.1 NCCCc1ccc(cc1)O 271570a_203496583355_100011297623 [0,1,0,0,0,0|1,0,0]=2 1504 B11R1.1 NCCNc1ccc(cn1)O 271570a_203496583355_200011214600 [0,1,0,0,0,0|2,0,0]=3 1505 B11R1.1 NCCOc1ccc(cc1)O 271570a_203496583355_100000746992 [0,1,0,0,0,0|0,0,0]=1 1506 B11R1.1 NCCSc1ccc(cc1)O 271570a_203496583355_100000184645 [0,1,0,0,0,0|0,1,0]=2 1507 B11R1.1 Nc1ccc(cc1)COCF 34a_100011215238_100015361967 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.1 Nc1ccc(cc1)OCC=O 34a_100000185829_200009817547 [0,1,0,0,0,0|1,0,1]=3 1509 B11R1.1 Nc1ccc(cc1)OCCF 34a_100000185829_100011217306 [0,1,0,0,0,0|1,0,0]=2 1510 B11R1.1 Nc1ccc(cc1)OCCO 34a_100000185829_100000211926 [0,1,0,0,0,0|1,0,0]=2 1511 B11R1.1 Nc1ccc(cc1)SCC=O 62a_100000185761_200015260668 [0,1,0,0,0,0|1,1,1]=4 1512 B11R1.1 Nc1ccc(cc1)SCC=O 62a_200015260668_100000185761 [0,1,0,0,0,0|1,1,1]=4 1513 B11R1.1 Nc1ccc(cc1)SCCF 62a_100000185761_100011217306 [0,1,0,0,0,0|1,1,0]=3 1514 B11R1.1 Nc1ccc(cc1)SCCF 62a_100011217306_100000185761 [0,1,0,0,0,0|1,1,0]=3 1515 B11R1.1 Nc1ccc(cc1)SCCO 62a_100000185761_100000211926 [0,1,0,0,0,0|1,1,0]=3 1516 B11R1.1 Nc1ccc(cc1)SCCO 62a_100000211926_100000185761 [0,1,0,0,0,0|1,1,0]=3 1517 B11R1.1 Nc1ccc(cn1)COCF 34a_100000704267_100015361967 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.1 Nc1ccc(cn1)OCC=O 34a_100015188713_200009817547 [0,1,0,0,0,0|2,0,1]=4 1519 B11R1.1 Nc1ccc(cn1)OCC=O 7a_100015188713_200015260668 [0,1,0,0,0,0|2,0,1]=4 1520 B11R1.1 Nc1ccc(cn1)OCCF 34a_100015188713_100011217306 [0,1,0,0,0,0|2,0,0]=3 1521 B11R1.1 Nc1ccc(cn1)OCCF 7a_100015188713_100011217306 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.1 Nc1ccc(cn1)OCCO 34a_100015188713_100000211926 [0,1,0,0,0,0|2,0,0]=3 1523 B11R1.1 Nc1ccc(cn1)OCCO 7a_100015188713_100000211926 [0,1,0,0,0,0|2,0,0]=3 1524 B11R1.1 Nc1ccc(cn1)SCCF 62a_100000187370_100011217306 [0,1,0,0,0,0|2,1,0]=4 1525 B11R1.1 Nc1ccc(cn1)SCCF 62a_100011217306_100000187370 [0,1,0,0,0,0|2,1,0]=4 1526 B11R1.1 Nc1ccc(cn1)SCCO 62a_100000187370_100000211926 [0,1,0,0,0,0|2,1,0]=4 1527 B11R1.1 Nc1ccc(cn1)SCCO 62a_100000211926_100000187370 [0,1,0,0,0,0|2,1,0]=4 1528 B11R1.1 Nc1ccc(nc1)COCF 34a_100011998161_100015361967 [0,1,0,0,0,0|3,0,0]=4 1529 B11R1.1 Nc1ccc(nc1)OCC=O 34a_100000729260_200009817547 [0,1,0,0,0,0|2,0,1]=4 1530 B11R1.1 Nc1ccc(nc1)OCCF 34a_100000729260_100011217306 [0,1,0,0,0,0|2,0,0]=3 1531 B11R1.1 Nc1ccc(nc1)OCCO 34a_100000729260_100000211926 [0,1,0,0,0,0|2,0,0]=3 1532 B11R1.1 Nc1ccc(nc1)SCCF 62a_100000737798_100011217306 [0,1,0,0,0,0|2,1,0]=4 1533 B11R1.1 Nc1ccc(nc1)SCCF 62a_100011217306_100000737798 [0,1,0,0,0,0|2,1,0]=4 1534 B11R1.1 Nc1ccc(nc1)SCCO 62a_100000211926_100000737798 [0,1,0,0,0,0|2,1,0]=4 1535 B11R1.1 Nc1ccc(nc1)SCCO 62a_100000737798_100000211926 [0,1,0,0,0,0|2,1,0]=4 1536 B11R1.1 Nc1ncc(cn1)OCCF 34a_100000087137_100011217306 [0,1,0,0,0,0|3,0,0]=4 1537 B11R1.1 Nc1ncc(cn1)OCCF 7a_100000087137_100011217306 [0,1,0,0,0,0|3,0,0]=4 1538 B11R1.1 Nc1ncc(cn1)OCCO 34a_100000087137_100000211926 [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.1 Nc1ncc(cn1)OCCO 7a_100000087137_100000211926 [0,1,0,0,0,0|3,0,0]=4 1540 B11R1.1 O=CCCc1ccc(cc1)O 271570a_203496583355_100011361538 [0,1,0,0,0,0|1,0,1]=3 1541 B11R1.1 O=CCNc1ccc(cc1)Br 2230a_100000210018_200015260668 [0,1,0,0,0,0|2,0,1]=4 1542 B11R1.1 O=CCNc1ccc(cc1)Br 34a_100000210018_200009817547 [0,1,0,0,0,0|2,0,1]=4 1543 B11R1.1 O=CCNc1ccc(cc1)Cl 2230a_100000210052_200015260668 [0,1,0,0,0,0|2,0,1]=4 1544 B11R1.1 O=CCNc1ccc(cc1)Cl 34a_100000210052_200009817547 [0,1,0,0,0,0|2,0,1]=4 1545 B11R1.1 O=CCNc1ccc(cc1)F 34a_100000185862_200009817547 [0,1,0,0,0,0|2,0,1]=4 1546 B11R1.1 O=CCNc1ccc(cc1)I 34a_100000185761_200009817547 [0,1,0,0,0,0|2,0,1]=4 1547 B11R1.1 O=CCNc1ccc(cc1)O 34a_100000185829_200009817547 [0,1,0,0,0,0|1,0,1]=3 1548 B11R1.1 O=CCOc1ccc(=O)[nH]c1 34a_100000075641_200009817547 [0,1,0,0,0,0|1,0,2]=4 1549 B11R1.1 O=CCOc1ccc(cc1)Br 34a_100000185759_200009817547 [0,1,0,0,0,0|1,0,1]=3 1550 B11R1.1 O=CCOc1ccc(cc1)Br 7a_100000185759_200015260668 [0,1,0,0,0,0|1,0,1]=3 1551 B11R1.1 O=CCOc1ccc(cc1)Cl 34a_100000210216_200009817547 [0,1,0,0,0,0|1,0,1]=3 1552 B11R1.1 O=CCOc1ccc(cc1)Cl 7a_100000210216_200015260668 [0,1,0,0,0,0|1,0,1]=3 1553 B11R1.1 O=CCOc1ccc(cc1)F 34a_100000210339_200009817547 [0,1,0,0,0,0|1,0,1]=3 1554 B11R1.1 O=CCOc1ccc(cc1)I 34a_100000212066_200009817547 [0,1,0,0,0,0|1,0,1]=3 1555 B11R1.1 O=CCOc1ccc(cc1)I 7a_100000212066_200015260668 [0,1,0,0,0,0|1,0,1]=3 1556 B11R1.1 O=CCOc1ccc(cn1)Cl 34a_100011215309_200009817547 [0,1,0,0,0,0|2,0,1]=4 1557 B11R1.1 O=CCOc1ccc(cn1)F 34a_100000742473_200009817547 [0,1,0,0,0,0|2,0,1]=4 1558 B11R1.1 O=CCOc1ccc(nc1)Br 34a_100000685995_200009817547 [0,1,0,0,0,0|2,0,1]=4 1559 B11R1.1 O=CCOc1ccc(nc1)Br 7a_100000685995_200015260668 [0,1,0,0,0,0|2,0,1]=4 1560 B11R1.1 O=CCOc1ccc(nc1)Cl 34a_100000744096_200009817547 [0,1,0,0,0,0|2,0,1]=4 1561 B11R1.1 O=CCOc1ccc(nc1)Cl 7a_100000744096_200015260668 [0,1,0,0,0,0|2,0,1]=4 1562 B11R1.1 O=CCOc1ccc(nc1)F 34a_100000688820_200009817547 [0,1,0,0,0,0|2,0,1]=4 1563 B11R1.1 O=CCOc1ccc(nc1)F 7a_100000688820_200015260668 [0,1,0,0,0,0|2,0,1]=4 1564 B11R1.1 O=CCOc1ccc(nc1)I 34a_100000687607_200009817547 [0,1,0,0,0,0|2,0,1]=4 1565 B11R1.1 O=CCOc1ccc(nc1)I 7a_100000687607_200015260668 [0,1,0,0,0,0|2,0,1]=4 1566 B11R1.1 O=CCSc1ccc(cc1)Br 62a_100000752885_200015260668 [0,1,0,0,0,0|1,1,1]=4 1567 B11R1.1 O=CCSc1ccc(cc1)Br 62a_200015260668_100000752885 [0,1,0,0,0,0|1,1,1]=4 1568 B11R1.1 O=CCSc1ccc(cc1)Cl 62a_100000755918_200015260668 [0,1,0,0,0,0|1,1,1]=4 1569 B11R1.1 O=CCSc1ccc(cc1)Cl 62a_200015260668_100000755918 [0,1,0,0,0,0|1,1,1]=4 1570 B11R1.1 O=CCSc1ccc(cc1)F 62a_100000211213_200015260668 [0,1,0,0,0,0|1,1,1]=4 1571 B11R1.1 O=CCSc1ccc(cc1)F 62a_200015260668_100000211213 [0,1,0,0,0,0|1,1,1]=4 1572 B11R1.1 O=CCSc1ccc(cc1)O 62a_200015260668_100000185759 [0,1,0,0,0,0|0,1,1]=3 1573 B11R1.1 O=CCSc1ccc(cn1)O 62a_100000685995_200015260668 [0,1,0,0,0,0|1,1,1]=4 1574 B11R1.1 O=CCSc1ccc(cn1)O 62a_200015260668_100000744096 [0,1,0,0,0,0|1,1,1]=4 1575 B11R1.1 O=c1ccc(c[nH]1)COCF 34a_100011999846_100015361967 [0,1,0,0,0,0|2,0,1]=4 1576 B11R1.1 O=c1ccc(c[nH]1)OCCF 34a_100000075641_100011217306 [0,1,0,0,0,0|1,0,1]=3 1577 B11R1.1 O=c1ccc(c[nH]1)OCCO 34a_100000075641_100000211926 [0,1,0,0,0,0|1,0,1]=3 1578 B11R1.1 O=c1ccc(c[nH]1)SCCF 62a_100000212171_100011217306 [0,1,0,0,0,0|1,1,1]=4 1579 B11R1.1 O=c1ccc(c[nH]1)SCCF 62a_100011217306_100000212171 [0,1,0,0,0,0|1,1,1]=4 1580 B11R1.1 O=c1ccc(c[nH]1)SCCO 62a_100000211926_100000212171 [0,1,0,0,0,0|1,1,1]=4 1581 B11R1.1 O=c1ccc(c[nH]1)SCCO 62a_100000212171_100000211926 [0,1,0,0,0,0|1,1,1]=4 1582 B11R1.1 OCC#Cc1ccc(cc1)O 271570a_203496583355_100009814260 [0,1,0,0,0,0|1,0,1]=3 1583 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [0,1,0,0,0,0|1,0,0]=2 1584 B11R1.1 OCCNc1ccc(cc1)Br 2230a_100000210018_100000211926 [0,1,0,0,0,0|2,0,0]=3 1585 B11R1.1 OCCNc1ccc(cc1)Br 34a_100000210018_100000211926 [0,1,0,0,0,0|2,0,0]=3 1586 B11R1.1 OCCNc1ccc(cc1)Cl 2230a_100000210052_100000211926 [0,1,0,0,0,0|2,0,0]=3 1587 B11R1.1 OCCNc1ccc(cc1)Cl 34a_100000210052_100000211926 [0,1,0,0,0,0|2,0,0]=3 1588 B11R1.1 OCCNc1ccc(cc1)F 34a_100000185862_100000211926 [0,1,0,0,0,0|2,0,0]=3 1589 B11R1.1 OCCNc1ccc(cc1)I 34a_100000185761_100000211926 [0,1,0,0,0,0|2,0,0]=3 1590 B11R1.1 OCCNc1ccc(cc1)O 34a_100000185829_100000211926 [0,1,0,0,0,0|1,0,0]=2 1591 B11R1.1 OCCNc1ccc(cn1)Br 27a_100000210304_100000686858 [0,1,0,0,0,0|3,0,0]=4 1592 B11R1.1 OCCNc1ccc(nn1)O 271570a_203496583355_100000767036 [0,1,0,0,0,0|3,0,0]=4 1593 B11R1.1 OCCOc1ccc(cc1)Br 34a_100000185759_100000211926 [0,1,0,0,0,0|1,0,0]=2 1594 B11R1.1 OCCOc1ccc(cc1)Br 7a_100000185759_100000211926 [0,1,0,0,0,0|1,0,0]=2 1595 B11R1.1 OCCOc1ccc(cc1)Cl 34a_100000210216_100000211926 [0,1,0,0,0,0|1,0,0]=2 1596 B11R1.1 OCCOc1ccc(cc1)Cl 7a_100000210216_100000211926 [0,1,0,0,0,0|1,0,0]=2 1597 B11R1.1 OCCOc1ccc(cc1)F 34a_100000210339_100000211926 [0,1,0,0,0,0|1,0,0]=2 1598 B11R1.1 OCCOc1ccc(cc1)I 34a_100000212066_100000211926 [0,1,0,0,0,0|1,0,0]=2 1599 B11R1.1 OCCOc1ccc(cc1)I 7a_100000212066_100000211926 [0,1,0,0,0,0|1,0,0]=2 1600 B11R1.1 OCCOc1ccc(cc1)O 271570a_203496583355_100000686261 [0,1,0,0,0,0|0,0,0]=1 1601 B11R1.1 OCCOc1ccc(cn1)Cl 34a_100011215309_100000211926 [0,1,0,0,0,0|2,0,0]=3 1602 B11R1.1 OCCOc1ccc(cn1)F 34a_100000742473_100000211926 [0,1,0,0,0,0|2,0,0]=3 1603 B11R1.1 OCCOc1ccc(nc1)Br 34a_100000685995_100000211926 [0,1,0,0,0,0|2,0,0]=3 1604 B11R1.1 OCCOc1ccc(nc1)Br 7a_100000685995_100000211926 [0,1,0,0,0,0|2,0,0]=3 1605 B11R1.1 OCCOc1ccc(nc1)Cl 34a_100000744096_100000211926 [0,1,0,0,0,0|2,0,0]=3 1606 B11R1.1 OCCOc1ccc(nc1)Cl 7a_100000744096_100000211926 [0,1,0,0,0,0|2,0,0]=3 1607 B11R1.1 OCCOc1ccc(nc1)F 34a_100000688820_100000211926 [0,1,0,0,0,0|2,0,0]=3 1608 B11R1.1 OCCOc1ccc(nc1)F 7a_100000688820_100000211926 [0,1,0,0,0,0|2,0,0]=3 1609 B11R1.1 OCCOc1ccc(nc1)I 34a_100000687607_100000211926 [0,1,0,0,0,0|2,0,0]=3 1610 B11R1.1 OCCOc1ccc(nc1)I 7a_100000687607_100000211926 [0,1,0,0,0,0|2,0,0]=3 1611 B11R1.1 OCCOc1ccc(nc1)O 271570a_203496583355_200013150534 [0,1,0,0,0,0|1,0,0]=2 1612 B11R1.1 OCCOc1cnc(cn1)Br 34a_100011934580_100000211926 [0,1,0,0,0,0|3,0,0]=4 1613 B11R1.1 OCCOc1cnc(cn1)Cl 34a_100015839800_100000211926 [0,1,0,0,0,0|3,0,0]=4 1614 B11R1.1 OCCOc1cnc(nc1)Br 34a_100000730009_100000211926 [0,1,0,0,0,0|3,0,0]=4 1615 B11R1.1 OCCOc1cnc(nc1)Br 7a_100000730009_100000211926 [0,1,0,0,0,0|3,0,0]=4 1616 B11R1.1 OCCOc1cnc(nc1)Cl 34a_100000092845_100000211926 [0,1,0,0,0,0|3,0,0]=4 1617 B11R1.1 OCCOc1cnc(nc1)Cl 7a_100000092845_100000211926 [0,1,0,0,0,0|3,0,0]=4 1618 B11R1.1 OCCOc1cnc(nc1)F 34a_200009874573_100000211926 [0,1,0,0,0,0|3,0,0]=4 1619 B11R1.1 OCCOc1cnc(nc1)F 7a_200009874573_100000211926 [0,1,0,0,0,0|3,0,0]=4 1620 B11R1.1 OCCOc1ncc(cn1)F 34a_100011934040_100000211926 [0,1,0,0,0,0|3,0,0]=4 1621 B11R1.1 OCCSc1ccc(cc1)Br 62a_100000211926_100000752885 [0,1,0,0,0,0|1,1,0]=3 1622 B11R1.1 OCCSc1ccc(cc1)Br 62a_100000752885_100000211926 [0,1,0,0,0,0|1,1,0]=3 1623 B11R1.1 OCCSc1ccc(cc1)Cl 62a_100000211926_100000755918 [0,1,0,0,0,0|1,1,0]=3 1624 B11R1.1 OCCSc1ccc(cc1)Cl 62a_100000755918_100000211926 [0,1,0,0,0,0|1,1,0]=3 1625 B11R1.1 OCCSc1ccc(cc1)F 62a_100000211213_100000211926 [0,1,0,0,0,0|1,1,0]=3 1626 B11R1.1 OCCSc1ccc(cc1)F 62a_100000211926_100000211213 [0,1,0,0,0,0|1,1,0]=3 1627 B11R1.1 OCCSc1ccc(cc1)O 62a_100000211926_100000185759 [0,1,0,0,0,0|0,1,0]=2 1628 B11R1.1 OCCSc1ccc(cn1)Br 62a_100000211926_100000686858 [0,1,0,0,0,0|2,1,0]=4 1629 B11R1.1 OCCSc1ccc(cn1)Br 62a_100000686858_100000211926 [0,1,0,0,0,0|2,1,0]=4 1630 B11R1.1 OCCSc1ccc(cn1)Cl 62a_100000211926_100011356976 [0,1,0,0,0,0|2,1,0]=4 1631 B11R1.1 OCCSc1ccc(cn1)Cl 62a_100011356976_100000211926 [0,1,0,0,0,0|2,1,0]=4 1632 B11R1.1 OCCSc1ccc(cn1)F 62a_100000211926_100000744514 [0,1,0,0,0,0|2,1,0]=4 1633 B11R1.1 OCCSc1ccc(cn1)F 62a_100000744514_100000211926 [0,1,0,0,0,0|2,1,0]=4 1634 B11R1.1 OCCSc1ccc(cn1)O 62a_100000211926_100000744096 [0,1,0,0,0,0|1,1,0]=3 1635 B11R1.1 OCCSc1ccc(cn1)O 62a_100000685995_100000211926 [0,1,0,0,0,0|1,1,0]=3 1636 B11R1.1 OCCSc1ccc(nc1)Br 62a_100000211926_100009814638 [0,1,0,0,0,0|2,1,0]=4 1637 B11R1.1 OCCSc1ccc(nc1)Br 62a_100009814638_100000211926 [0,1,0,0,0,0|2,1,0]=4 1638 B11R1.1 OCCSc1ccc(nc1)Cl 62a_100000034144_100000211926 [0,1,0,0,0,0|2,1,0]=4 1639 B11R1.1 OCCSc1ccc(nc1)Cl 62a_100000211926_100000034144 [0,1,0,0,0,0|2,1,0]=4 1640 B11R1.1 OCCSc1ccc(nc1)F 62a_100000042367_100000211926 [0,1,0,0,0,0|2,1,0]=4 1641 B11R1.1 OCCSc1ccc(nc1)F 62a_100000211926_100000042367 [0,1,0,0,0,0|2,1,0]=4 1642 B11R1.1 OCCSc1ccc(nn1)O 271570a_203496583355_100000215309 [0,1,0,0,0,0|2,1,0]=4 1643 B11R1.1 OCCSc1cnc(cn1)O 62a_100000211926_100015839800 [0,1,0,0,0,0|2,1,0]=4 1644 B11R1.1 OCCSc1cnc(cn1)O 62a_100011934580_100000211926 [0,1,0,0,0,0|2,1,0]=4 1645 B11R1.1 OCCSc1ncc(cn1)O 62a_100000211926_100000092845 [0,1,0,0,0,0|2,1,0]=4 1646 B11R1.1 OCCSc1ncc(cn1)O 62a_100000730009_100000211926 [0,1,0,0,0,0|2,1,0]=4 1647 B11R1.1 Oc1ccc(cc1)CNCF 34a_100000185549_100015361967 [0,1,0,0,0,0|2,0,0]=3 1648 B11R1.1 Oc1ccc(cc1)NCCF 34a_100000185829_100011217306 [0,1,0,0,0,0|1,0,0]=2 1649 B11R1.1 Oc1ccc(cc1)OCCF 271570a_203496583355_100012347556 [0,1,0,0,0,0|0,0,0]=1 1650 B11R1.1 Oc1ccc(cc1)SCCF 62a_100011217306_100000185759 [0,1,0,0,0,0|0,1,0]=2 1651 B11R1.1 Oc1ccc(nc1)SCCF 62a_100000685995_100011217306 [0,1,0,0,0,0|1,1,0]=3 1652 B11R1.1 Oc1ccc(nc1)SCCF 62a_100011217306_100000744096 [0,1,0,0,0,0|1,1,0]=3 1653 B11R1.1 Oc1cnc(cn1)SCCF 62a_100011217306_100015839800 [0,1,0,0,0,0|2,1,0]=4 1654 B11R1.1 Oc1cnc(cn1)SCCF 62a_100011934580_100011217306 [0,1,0,0,0,0|2,1,0]=4 1655 B11R1.1 Oc1cnc(nc1)SCCF 62a_100000730009_100011217306 [0,1,0,0,0,0|2,1,0]=4 1656 B11R1.1 Oc1cnc(nc1)SCCF 62a_100011217306_100000092845 [0,1,0,0,0,0|2,1,0]=4 1657 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 2230a_100000755846_200025704644 [0,1,0,0,0,0|2,0,0]=3 1658 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 34a_100000755846_200025704644 [0,1,0,0,0,0|2,0,0]=3 1659 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 2230a_100000185265_200025704644 [0,1,0,0,0,0|2,0,0]=3 1660 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 34a_100000185265_200025704644 [0,1,0,0,0,0|2,0,0]=3 1661 B11R1.1 [13CH3]NCCc1ccc(cc1)F 2230a_100000199005_200025704644 [0,1,0,0,0,0|2,0,0]=3 1662 B11R1.1 [13CH3]NCCc1ccc(cc1)F 34a_100000199005_200025704644 [0,1,0,0,0,0|2,0,0]=3 1663 B11R1.1 [13CH3]NCCc1ccc(cc1)O 34a_100000743037_200025704644 [0,1,0,0,0,0|1,0,0]=2 1664 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 34a_100000766406_200025704644 [0,1,0,0,0,0|2,0,0]=3 1665 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 7a_100000766406_200025704644 [0,1,0,0,0,0|2,0,0]=3 1666 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 34a_100011219627_200025704644 [0,1,0,0,0,0|2,0,0]=3 1667 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 7a_100011219627_200025704644 [0,1,0,0,0,0|2,0,0]=3 1668 B11R1.1 [13CH3]OCCc1ccc(cc1)F 34a_100000754732_200025704644 [0,1,0,0,0,0|2,0,0]=3 1669 B11R1.1 [13CH3]OCCc1ccc(cc1)F 7a_100000754732_200025704644 [0,1,0,0,0,0|2,0,0]=3 1670 B11R1.1 [13CH3]OCCc1ccc(cc1)I 34a_100012291149_200025704644 [0,1,0,0,0,0|2,0,0]=3 1671 B11R1.1 [13CH3]OCCc1ccc(cc1)I 7a_100012291149_200025704644 [0,1,0,0,0,0|2,0,0]=3 1672 B11R1.1 [13CH3]OCCc1ccc(cc1)N 34a_100011204434_200025704644 [0,1,0,0,0,0|2,0,0]=3 1673 B11R1.1 [13CH3]OCCc1ccc(cn1)Br 34a_100012357577_200025704644 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.1 [13CH3]OCCc1ccc(nc1)Cl 34a_100009880866_200025704644 [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.1 [13CH3]OCCc1ccc(nc1)Cl 7a_100009880866_200025704644 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_100011740612_200025704644 [0,1,0,0,0,0|2,0,0]=3 1677 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_200025704644_100011740612 [0,1,0,0,0,0|2,0,0]=3 1678 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_100011713675_200025704644 [0,1,0,0,0,0|2,0,0]=3 1679 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_200025704644_100011713675 [0,1,0,0,0,0|2,0,0]=3 1680 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_100011217392_200025704644 [0,1,0,0,0,0|2,0,0]=3 1681 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_200025704644_100011217392 [0,1,0,0,0,0|2,0,0]=3 1682 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_100009816426_200025704644 [0,1,0,0,0,0|1,0,0]=2 1683 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_200025704644_100009816426 [0,1,0,0,0,0|1,0,0]=2 1684 B11R1.1 [O-][n+]1ccc(cc1)COCF 34a_100000031831_100015361967 [0,1,0,0,0,0|2,0,1]=4 1685 B11R1.1 [O-][n+]1ccc(cc1)COCF 7a_100000031831_100015361967 [0,1,0,0,0,0|2,0,1]=4 1686 B11R1.1 [O-][n+]1ccc(cc1)SCCF 62a_100011217306_100000039755 [0,1,0,0,0,0|1,1,1]=4 1687 B11R1.1 [O-][n+]1ccc(cc1)SCCO 62a_100000211926_100000039755 [0,1,0,0,0,0|1,1,1]=4 1688 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [0,1,0,0,0,0|2,0,1]=4 1689 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,1,0,0,0,0|2,0,1]=4 1690 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [0,1,0,0,0,0|2,0,1]=4 1691 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [0,1,0,0,0,0|2,0,1]=4 1692 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [0,1,0,0,0,0|2,0,1]=4 1693 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [0,1,0,0,0,0|1,0,1]=3 1694 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [0,1,0,0,0,0|2,0,1]=4 1695 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [0,1,0,0,0,0|2,0,1]=4 1696 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [0,1,0,0,0,0|2,0,1]=4 1697 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,1,0,0,0,0|2,0,1]=4 1698 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,1,0,0,0,0|2,0,1]=4 1699 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [0,1,0,0,0,0|2,0,1]=4 1700 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [0,1,0,0,0,0|2,0,1]=4 1701 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [0,1,0,0,0,0|2,0,1]=4 1702 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [0,1,0,0,0,0|2,0,1]=4 1703 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [0,1,0,0,0,0|2,0,1]=4 1704 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [0,1,0,0,0,0|2,0,1]=4 1705 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [0,1,0,0,0,0|1,0,1]=3 1706 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [0,1,0,0,0,0|1,0,1]=3 1707 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,1,0,0,0,0|2,0,1]=4 1708 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,1,0,0,0,0|2,0,1]=4 1709 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,1,0,0,0,0|2,0,1]=4 1711 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,1,0,0,0,0|2,0,1]=4 1712 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,1,0,0,0,0|2,0,1]=4 1713 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,1,0,0,0,0|2,0,1]=4 1714 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,1,0,0,0,0|2,0,1]=4 1715 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,1,0,0,0,0|2,0,1]=4 1716 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,1,0,0,0,0|2,0,1]=4 1717 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,1,0,0,0,0|2,0,1]=4 1718 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,1,0,0,0,0|2,0,1]=4 1719 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,1,0,0,0,0|2,0,1]=4 1720 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,1,0,0,0,0|2,0,1]=4 1721 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,1,0,0,0,0|2,0,1]=4 1722 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,1,0,0,0,0|2,0,1]=4 1723 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,1,0,0,0,0|2,0,1]=4 1724 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,1,0,0,0,0|2,0,1]=4 1725 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,1,0,0,0,0|2,0,1]=4 1726 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,1,0,0,0,0|2,0,1]=4 1727 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,1,0,0,0,0|1,0,1]=3 1728 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,1,0,0,0,0|1,0,1]=3 1729 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [0,1,0,0,0,0|2,0,1]=4 1730 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [0,1,0,0,0,0|2,0,1]=4 1731 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [0,1,0,0,0,0|0,0,1]=2 1732 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,1,0,0,0,0|0,1,1]=3 1733 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [0,1,0,0,0,0|0,0,1]=2 1734 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [0,1,0,0,0,0|1,0,0]=2 1735 B11R1.20 CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000210206 [0,1,0,0,0,0|2,0,0]=3 1736 B11R1.20 CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000210206 [0,1,0,0,0,0|2,0,0]=3 1737 B11R1.20 CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000210206 [0,1,0,0,0,0|2,0,0]=3 1738 B11R1.20 CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210206 [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.20 CC(C)Nc1ccc(cc1)F 34a_100000185862_100000210206 [0,1,0,0,0,0|2,0,0]=3 1740 B11R1.20 CC(C)Nc1ccc(cc1)I 34a_100000185761_100000210206 [0,1,0,0,0,0|2,0,0]=3 1741 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [0,1,0,0,0,0|1,0,0]=2 1742 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [0,1,0,0,0,0|1,0,0]=2 1743 B11R1.20 CC(C)Nc1ccc(cn1)Br 27a_100138425928_100000686858 [0,1,0,0,0,0|3,0,0]=4 1744 B11R1.20 CC(C)Nc1ccc(nn1)O 271570a_203496583355_200011242954 [0,1,0,0,0,0|3,0,0]=4 1745 B11R1.20 CC(C)Nc1ncc(cn1)O 271570a_203496583355_100011934052 [0,1,0,0,0,0|3,0,0]=4 1746 B11R1.20 CC(C)Oc1ccc(=O)[nH]c1 34a_100000075641_100000210206 [0,1,0,0,0,0|1,0,1]=3 1747 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [0,1,0,0,0,0|1,0,0]=2 1748 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [0,1,0,0,0,0|1,0,0]=2 1749 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [0,1,0,0,0,0|1,0,0]=2 1750 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [0,1,0,0,0,0|1,0,0]=2 1751 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [0,1,0,0,0,0|1,0,0]=2 1752 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [0,1,0,0,0,0|1,0,0]=2 1753 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [0,1,0,0,0,0|1,0,0]=2 1754 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [0,1,0,0,0,0|1,0,0]=2 1755 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [0,1,0,0,0,0|0,0,0]=1 1756 B11R1.20 CC(C)Oc1ccc(cn1)Cl 34a_100011215309_100000210206 [0,1,0,0,0,0|2,0,0]=3 1757 B11R1.20 CC(C)Oc1ccc(cn1)F 34a_100000742473_100000210206 [0,1,0,0,0,0|2,0,0]=3 1758 B11R1.20 CC(C)Oc1ccc(cn1)N 34a_100000729260_100000210206 [0,1,0,0,0,0|2,0,0]=3 1759 B11R1.20 CC(C)Oc1ccc(cn1)O 271570a_203496583355_100000688564 [0,1,0,0,0,0|1,0,0]=2 1760 B11R1.20 CC(C)Oc1ccc(nc1)Br 34a_100000685995_100000210206 [0,1,0,0,0,0|2,0,0]=3 1761 B11R1.20 CC(C)Oc1ccc(nc1)Br 7a_100000685995_100000210206 [0,1,0,0,0,0|2,0,0]=3 1762 B11R1.20 CC(C)Oc1ccc(nc1)Cl 34a_100000744096_100000210206 [0,1,0,0,0,0|2,0,0]=3 1763 B11R1.20 CC(C)Oc1ccc(nc1)Cl 7a_100000744096_100000210206 [0,1,0,0,0,0|2,0,0]=3 1764 B11R1.20 CC(C)Oc1ccc(nc1)F 34a_100000688820_100000210206 [0,1,0,0,0,0|2,0,0]=3 1765 B11R1.20 CC(C)Oc1ccc(nc1)F 7a_100000688820_100000210206 [0,1,0,0,0,0|2,0,0]=3 1766 B11R1.20 CC(C)Oc1ccc(nc1)I 34a_100000687607_100000210206 [0,1,0,0,0,0|2,0,0]=3 1767 B11R1.20 CC(C)Oc1ccc(nc1)I 7a_100000687607_100000210206 [0,1,0,0,0,0|2,0,0]=3 1768 B11R1.20 CC(C)Oc1ccc(nc1)N 34a_100015188713_100000210206 [0,1,0,0,0,0|2,0,0]=3 1769 B11R1.20 CC(C)Oc1ccc(nc1)N 7a_100015188713_100000210206 [0,1,0,0,0,0|2,0,0]=3 1770 B11R1.20 CC(C)Oc1ccc(nc1)O 271570a_203496583355_100012354243 [0,1,0,0,0,0|1,0,0]=2 1771 B11R1.20 CC(C)Oc1ccc(nn1)O 271570a_203496583355_100011211678 [0,1,0,0,0,0|2,0,0]=3 1772 B11R1.20 CC(C)Oc1cnc(cn1)Br 34a_100011934580_100000210206 [0,1,0,0,0,0|3,0,0]=4 1773 B11R1.20 CC(C)Oc1cnc(cn1)Cl 34a_100015839800_100000210206 [0,1,0,0,0,0|3,0,0]=4 1774 B11R1.20 CC(C)Oc1cnc(cn1)O 271570a_203496583355_200010967586 [0,1,0,0,0,0|2,0,0]=3 1775 B11R1.20 CC(C)Oc1cnc(nc1)Br 34a_100000730009_100000210206 [0,1,0,0,0,0|3,0,0]=4 1776 B11R1.20 CC(C)Oc1cnc(nc1)Br 7a_100000730009_100000210206 [0,1,0,0,0,0|3,0,0]=4 1777 B11R1.20 CC(C)Oc1cnc(nc1)Cl 34a_100000092845_100000210206 [0,1,0,0,0,0|3,0,0]=4 1778 B11R1.20 CC(C)Oc1cnc(nc1)Cl 7a_100000092845_100000210206 [0,1,0,0,0,0|3,0,0]=4 1779 B11R1.20 CC(C)Oc1cnc(nc1)F 34a_200009874573_100000210206 [0,1,0,0,0,0|3,0,0]=4 1780 B11R1.20 CC(C)Oc1cnc(nc1)F 7a_200009874573_100000210206 [0,1,0,0,0,0|3,0,0]=4 1781 B11R1.20 CC(C)Oc1cnc(nc1)N 34a_100000087137_100000210206 [0,1,0,0,0,0|3,0,0]=4 1782 B11R1.20 CC(C)Oc1cnc(nc1)N 7a_100000087137_100000210206 [0,1,0,0,0,0|3,0,0]=4 1783 B11R1.20 CC(C)Oc1ncc(cn1)F 34a_100011934040_100000210206 [0,1,0,0,0,0|3,0,0]=4 1784 B11R1.20 CC(C)Oc1ncc(cn1)O 271570a_203496583355_200011939451 [0,1,0,0,0,0|2,0,0]=3 1785 B11R1.20 CC(C)Sc1cc[n+](cc1)[O-] 62a_100000210206_100000039755 [0,1,0,0,0,0|1,1,1]=4 1786 B11R1.20 CC(C)Sc1ccc(=O)[nH]c1 62a_100000210206_100000212171 [0,1,0,0,0,0|1,1,1]=4 1787 B11R1.20 CC(C)Sc1ccc(=O)[nH]c1 62a_100000212171_100000210206 [0,1,0,0,0,0|1,1,1]=4 1788 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000210206_100000752885 [0,1,0,0,0,0|1,1,0]=3 1789 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000752885_100000210206 [0,1,0,0,0,0|1,1,0]=3 1790 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000210206_100000755918 [0,1,0,0,0,0|1,1,0]=3 1791 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000210206 [0,1,0,0,0,0|1,1,0]=3 1792 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000210206_100000211213 [0,1,0,0,0,0|1,1,0]=3 1793 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000211213_100000210206 [0,1,0,0,0,0|1,1,0]=3 1794 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000185761_100000210206 [0,1,0,0,0,0|1,1,0]=3 1795 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000210206_100000185761 [0,1,0,0,0,0|1,1,0]=3 1796 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [0,1,0,0,0,0|0,1,0]=2 1797 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [0,1,0,0,0,0|0,1,0]=2 1798 B11R1.20 CC(C)Sc1ccc(cn1)Br 62a_100000210206_100000686858 [0,1,0,0,0,0|2,1,0]=4 1799 B11R1.20 CC(C)Sc1ccc(cn1)Br 62a_100000686858_100000210206 [0,1,0,0,0,0|2,1,0]=4 1800 B11R1.20 CC(C)Sc1ccc(cn1)Cl 62a_100000210206_100011356976 [0,1,0,0,0,0|2,1,0]=4 1801 B11R1.20 CC(C)Sc1ccc(cn1)Cl 62a_100011356976_100000210206 [0,1,0,0,0,0|2,1,0]=4 1802 B11R1.20 CC(C)Sc1ccc(cn1)F 62a_100000210206_100000744514 [0,1,0,0,0,0|2,1,0]=4 1803 B11R1.20 CC(C)Sc1ccc(cn1)F 62a_100000744514_100000210206 [0,1,0,0,0,0|2,1,0]=4 1804 B11R1.20 CC(C)Sc1ccc(cn1)N 62a_100000210206_100000737798 [0,1,0,0,0,0|2,1,0]=4 1805 B11R1.20 CC(C)Sc1ccc(cn1)N 62a_100000737798_100000210206 [0,1,0,0,0,0|2,1,0]=4 1806 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000210206_100000744096 [0,1,0,0,0,0|1,1,0]=3 1807 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000685995_100000210206 [0,1,0,0,0,0|1,1,0]=3 1808 B11R1.20 CC(C)Sc1ccc(nc1)Br 62a_100000210206_100009814638 [0,1,0,0,0,0|2,1,0]=4 1809 B11R1.20 CC(C)Sc1ccc(nc1)Br 62a_100009814638_100000210206 [0,1,0,0,0,0|2,1,0]=4 1810 B11R1.20 CC(C)Sc1ccc(nc1)Cl 62a_100000034144_100000210206 [0,1,0,0,0,0|2,1,0]=4 1811 B11R1.20 CC(C)Sc1ccc(nc1)Cl 62a_100000210206_100000034144 [0,1,0,0,0,0|2,1,0]=4 1812 B11R1.20 CC(C)Sc1ccc(nc1)F 62a_100000042367_100000210206 [0,1,0,0,0,0|2,1,0]=4 1813 B11R1.20 CC(C)Sc1ccc(nc1)F 62a_100000210206_100000042367 [0,1,0,0,0,0|2,1,0]=4 1814 B11R1.20 CC(C)Sc1ccc(nc1)N 62a_100000187370_100000210206 [0,1,0,0,0,0|2,1,0]=4 1815 B11R1.20 CC(C)Sc1ccc(nc1)N 62a_100000210206_100000187370 [0,1,0,0,0,0|2,1,0]=4 1816 B11R1.20 CC(C)Sc1cnc(cn1)O 62a_100000210206_100015839800 [0,1,0,0,0,0|2,1,0]=4 1817 B11R1.20 CC(C)Sc1cnc(cn1)O 62a_100011934580_100000210206 [0,1,0,0,0,0|2,1,0]=4 1818 B11R1.20 CC(C)Sc1ncc(cn1)O 271570a_203496583355_200011939557 [0,1,0,0,0,0|2,1,0]=4 1819 B11R1.20 CC(C)Sc1ncc(cn1)O 62a_100000210206_100000092845 [0,1,0,0,0,0|2,1,0]=4 1820 B11R1.20 CC(C)Sc1ncc(cn1)O 62a_100000730009_100000210206 [0,1,0,0,0,0|2,1,0]=4 1821 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [0,1,0,0,0,0|3,0,0]=4 1822 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [0,1,0,0,0,0|3,0,0]=4 1823 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [0,1,0,0,0,0|3,0,0]=4 1824 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [0,1,0,0,0,0|3,0,0]=4 1825 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [0,1,0,0,0,0|3,0,0]=4 1826 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [0,1,0,0,0,0|3,0,0]=4 1827 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [0,1,0,0,0,0|3,0,0]=4 1828 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [0,1,0,0,0,0|3,0,0]=4 1829 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [0,1,0,0,0,0|3,0,0]=4 1830 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [0,1,0,0,0,0|3,0,0]=4 1831 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [0,1,0,0,0,0|3,0,0]=4 1832 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [0,1,0,0,0,0|3,0,0]=4 1833 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [0,1,0,0,0,0|3,0,0]=4 1834 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [0,1,0,0,0,0|3,0,0]=4 1835 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [0,1,0,0,0,0|3,0,0]=4 1836 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [0,1,0,0,0,0|3,0,0]=4 1837 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [0,1,0,0,0,0|3,0,0]=4 1838 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [0,1,0,0,0,0|3,0,0]=4 1839 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [0,1,0,0,0,0|3,0,0]=4 1840 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [0,1,0,0,0,0|2,0,0]=3 1841 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [0,1,0,0,0,0|2,0,0]=3 1842 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [0,1,0,0,0,0|2,0,0]=3 1843 B11R1.20 CN(C)Cc1ccc(nc1)O 271570a_203496583355_106446545466 [0,1,0,0,0,0|3,0,0]=4 1844 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [0,1,0,0,0,0|3,0,0]=4 1845 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [0,1,0,0,0,0|3,0,0]=4 1846 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [0,1,0,0,0,0|3,0,0]=4 1847 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [0,1,0,0,0,0|3,0,0]=4 1848 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [0,1,0,0,0,0|3,0,0]=4 1849 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [0,1,0,0,0,0|3,0,0]=4 1850 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [0,1,0,0,0,0|3,0,0]=4 1851 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [0,1,0,0,0,0|3,0,0]=4 1852 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [0,1,0,0,0,0|2,0,0]=3 1853 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [0,1,0,0,0,0|2,0,0]=3 1854 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,1,0,0,0,0|2,0,1]=4 1855 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [0,1,0,0,0,0|3,0,0]=4 1856 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [0,1,0,0,0,0|3,0,0]=4 1857 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [0,1,0,0,0,0|3,0,0]=4 1858 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [0,1,0,0,0,0|3,0,0]=4 1859 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [0,1,0,0,0,0|3,0,0]=4 1860 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [0,1,0,0,0,0|3,0,0]=4 1861 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [0,1,0,0,0,0|3,0,0]=4 1862 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [0,1,0,0,0,0|3,0,0]=4 1863 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [0,1,0,0,0,0|3,0,0]=4 1864 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [0,1,0,0,0,0|2,0,0]=3 1865 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [0,1,0,0,0,0|1,0,0]=2 1866 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [0,1,0,0,0,0|1,0,0]=2 1867 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [0,1,0,0,0,0|1,1,0]=3 1868 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [0,1,0,0,0,0|1,1,0]=3 1869 B11R1.20 Cc1ccc(cn1)OC(C)C 34a_100000745506_100000210206 [0,1,0,0,0,0|2,0,0]=3 1870 B11R1.20 Cc1ccc(cn1)OC(C)C 7a_100000745506_100000210206 [0,1,0,0,0,0|2,0,0]=3 1871 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000210206_100000751577 [0,1,0,0,0,0|2,1,0]=4 1872 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000751577_100000210206 [0,1,0,0,0,0|2,1,0]=4 1873 B11R1.20 Cc1ccc(nc1)OC(C)C 34a_100000759353_100000210206 [0,1,0,0,0,0|2,0,0]=3 1874 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100000210206_100000754016 [0,1,0,0,0,0|2,1,0]=4 1875 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100011192072_100000210206 [0,1,0,0,0,0|2,1,0]=4 1876 B11R1.20 Cc1ncc(cn1)OC(C)C 34a_100000062939_100000210206 [0,1,0,0,0,0|3,0,0]=4 1877 B11R1.20 Cc1ncc(cn1)OC(C)C 7a_100000062939_100000210206 [0,1,0,0,0,0|3,0,0]=4 1878 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [0,1,0,0,0,0|2,0,1]=4 1879 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [0,1,0,0,0,0|2,0,1]=4 1880 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [0,1,0,0,0,0|2,0,1]=4 1881 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [0,1,0,0,0,0|2,0,1]=4 1882 B11R1.20 Oc1ccc(cc1)OC(F)F 271570a_203496583355_100000179047 [0,1,0,0,0,0|1,0,0]=2 1883 B11R1.20 Oc1ccc(cc1)SC(F)F 271570a_203496583355_100000178776 [0,1,0,0,0,0|1,1,0]=3 1884 B11R1.20 Oc1ccc(cn1)OC(F)F 271570a_203496583355_100000698515 [0,1,0,0,0,0|2,0,0]=3 1885 B11R1.20 Oc1ccc(nc1)OC(F)F 271570a_203496583355_100000695986 [0,1,0,0,0,0|2,0,0]=3 1886 B11R1.20 Oc1ncc(cn1)OC(F)F 271570a_203496583355_100009874815 [0,1,0,0,0,0|3,0,0]=4 1887 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [0,1,0,0,0,0|2,0,1]=4 1888 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [0,1,0,0,0,0|2,0,1]=4 1889 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [0,1,0,0,0,0|2,0,1]=4 1890 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [0,1,0,0,0,0|2,0,1]=4 1891 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [0,1,0,0,0,0|1,0,1]=3 1892 B11R1.22 CC(C#N)c1ccc(cc1)O 271570a_203496583355_100000695319 [0,1,0,0,0,0|2,0,1]=4 1893 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,1,0,0,0,0|3,0,0]=4 1894 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,1,0,0,0,0|3,0,0]=4 1895 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,1,0,0,0,0|3,0,0]=4 1896 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,1,0,0,0,0|3,0,0]=4 1897 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,1,0,0,0,0|3,0,0]=4 1898 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [0,1,0,0,0,0|3,0,0]=4 1899 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [0,1,0,0,0,0|3,0,0]=4 1900 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [0,1,0,0,0,0|3,0,0]=4 1901 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [0,1,0,0,0,0|3,0,0]=4 1902 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [0,1,0,0,0,0|3,0,0]=4 1903 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [0,1,0,0,0,0|3,0,0]=4 1904 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,1,0,0,0,0|2,0,0]=3 1905 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,1,0,0,0,0|2,0,0]=3 1906 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,1,0,0,0,0|2,0,0]=3 1907 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,1,0,0,0,0|2,0,0]=3 1908 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,1,0,0,0,0|2,0,0]=3 1909 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,1,0,0,0,0|1,0,0]=2 1910 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,1,0,0,0,0|1,0,0]=2 1911 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,1,0,0,0,0|2,0,0]=3 1912 B11R1.22 CCC(=O)c1ncc(cn1)O 271570a_203496583355_200010116844 [0,1,0,0,0,0|3,0,0]=4 1913 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [0,1,0,0,0,0|1,0,0]=2 1914 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [0,1,0,0,0,0|1,0,0]=2 1915 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [0,1,0,0,0,0|2,0,0]=3 1916 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [0,1,0,0,0,0|2,0,0]=3 1917 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [0,1,0,0,0,0|2,0,0]=3 1918 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [0,1,0,0,0,0|2,0,0]=3 1919 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [0,1,0,0,0,0|2,0,0]=3 1920 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [0,1,0,0,0,0|2,0,0]=3 1921 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [0,1,0,0,0,0|2,0,0]=3 1922 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [0,1,0,0,0,0|2,0,0]=3 1923 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [0,1,0,0,0,0|2,0,0]=3 1924 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [0,1,0,0,0,0|2,0,0]=3 1925 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [0,1,0,0,0,0|2,0,0]=3 1926 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [0,1,0,0,0,0|2,0,0]=3 1927 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [0,1,0,0,0,0|2,0,0]=3 1928 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [0,1,0,0,0,0|2,0,0]=3 1929 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [0,1,0,0,0,0|2,0,0]=3 1930 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [0,1,0,0,0,0|2,0,0]=3 1931 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [0,1,0,0,0,0|2,0,0]=3 1933 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [0,1,0,0,0,0|2,0,0]=3 1934 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [0,1,0,0,0,0|2,0,0]=3 1936 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [0,1,0,0,0,0|2,0,0]=3 1937 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [0,1,0,0,0,0|2,0,0]=3 1938 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [0,1,0,0,0,0|2,0,0]=3 1939 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [0,1,0,0,0,0|2,0,0]=3 1940 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [0,1,0,0,0,0|2,0,0]=3 1941 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [0,1,0,0,0,0|2,0,0]=3 1942 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [0,1,0,0,0,0|1,0,0]=2 1943 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [0,1,0,0,0,0|1,0,0]=2 1944 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [0,1,0,0,0,0|1,0,0]=2 1945 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [0,1,0,0,0,0|1,0,0]=2 1946 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [0,1,0,0,0,0|1,0,0]=2 1947 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [0,1,0,0,0,0|2,0,0]=3 1948 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [0,1,0,0,0,0|2,0,0]=3 1949 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [0,1,0,0,0,0|2,0,0]=3 1950 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [0,1,0,0,0,0|2,0,0]=3 1951 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [0,1,0,0,0,0|2,0,0]=3 1952 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [0,1,0,0,0,0|2,0,0]=3 1953 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [0,1,0,0,0,0|2,0,0]=3 1954 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [0,1,0,0,0,0|2,0,0]=3 1955 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [0,1,0,0,0,0|2,0,0]=3 1956 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [0,1,0,0,0,0|2,0,0]=3 1957 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [0,1,0,0,0,0|2,0,0]=3 1958 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [0,1,0,0,0,0|2,0,0]=3 1959 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [0,1,0,0,0,0|1,0,0]=2 1960 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [0,1,0,0,0,0|1,0,0]=2 1961 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [0,1,0,0,0,0|1,0,0]=2 1962 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [0,1,0,0,0,0|1,0,0]=2 1963 B11R1.22 CN(CF)c1ccc(cc1)Br 269982a_100000219623_100015361967 [0,1,0,0,0,0|3,0,0]=4 1964 B11R1.22 CN(CF)c1ccc(cc1)Br 34a_100000219623_100015361967 [0,1,0,0,0,0|3,0,0]=4 1965 B11R1.22 CN(CF)c1ccc(cc1)Cl 269982a_100020629279_100015361967 [0,1,0,0,0,0|3,0,0]=4 1966 B11R1.22 CN(CF)c1ccc(cc1)Cl 34a_100020629279_100015361967 [0,1,0,0,0,0|3,0,0]=4 1967 B11R1.22 CN(CF)c1ccc(cc1)F 269982a_100000219829_100015361967 [0,1,0,0,0,0|3,0,0]=4 1968 B11R1.22 CN(CF)c1ccc(cc1)F 34a_100000219829_100015361967 [0,1,0,0,0,0|3,0,0]=4 1969 B11R1.22 CN(CF)c1ccc(cc1)I 269982a_100000743151_100015361967 [0,1,0,0,0,0|3,0,0]=4 1970 B11R1.22 CN(CF)c1ccc(cc1)I 34a_100000743151_100015361967 [0,1,0,0,0,0|3,0,0]=4 1971 B11R1.22 CN(CF)c1ccc(cc1)O 269982a_100000182112_100015361967 [0,1,0,0,0,0|2,0,0]=3 1972 B11R1.22 CN(CF)c1ccc(cc1)O 34a_100000182112_100015361967 [0,1,0,0,0,0|2,0,0]=3 1973 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,1,0,0,0,0|3,0,0]=4 1974 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,1,0,0,0,0|3,0,0]=4 1975 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,1,0,0,0,0|3,0,0]=4 1976 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,1,0,0,0,0|3,0,0]=4 1977 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,1,0,0,0,0|3,0,0]=4 1978 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,1,0,0,0,0|3,0,0]=4 1979 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,1,0,0,0,0|3,0,0]=4 1980 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,1,0,0,0,0|3,0,0]=4 1981 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,1,0,0,0,0|3,0,0]=4 1982 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,1,0,0,0,0|3,0,0]=4 1983 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,1,0,0,0,0|3,0,0]=4 1984 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,1,0,0,0,0|3,0,0]=4 1985 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,1,0,0,0,0|3,0,0]=4 1986 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,1,0,0,0,0|3,0,0]=4 1987 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,1,0,0,0,0|3,0,0]=4 1988 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,1,0,0,0,0|3,0,0]=4 1989 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,1,0,0,0,0|3,0,0]=4 1990 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,1,0,0,0,0|3,0,0]=4 1991 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,1,0,0,0,0|3,0,0]=4 1992 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,1,0,0,0,0|3,0,0]=4 1993 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,1,0,0,0,0|2,0,0]=3 1994 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,1,0,0,0,0|2,0,0]=3 1995 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,1,0,0,0,0|2,0,0]=3 1996 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,1,0,0,0,0|3,0,0]=4 1997 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,1,0,0,0,0|3,0,0]=4 1998 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [0,1,0,0,0,0|3,0,0]=4 1999 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [0,1,0,0,0,0|3,0,0]=4 2000 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [0,1,0,0,0,0|3,0,0]=4 2001 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [0,1,0,0,0,0|3,0,0]=4 2002 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [0,1,0,0,0,0|3,0,0]=4 2003 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [0,1,0,0,0,0|3,0,0]=4 2004 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [0,1,0,0,0,0|3,0,0]=4 2005 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [0,1,0,0,0,0|3,0,0]=4 2006 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [0,1,0,0,0,0|3,0,0]=4 2007 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [0,1,0,0,0,0|3,0,0]=4 2008 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [0,1,0,0,0,0|3,0,0]=4 2009 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [0,1,0,0,0,0|3,0,0]=4 2010 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [0,1,0,0,0,0|3,0,0]=4 2011 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [0,1,0,0,0,0|3,0,0]=4 2012 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [0,1,0,0,0,0|3,0,0]=4 2013 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [0,1,0,0,0,0|2,0,0]=3 2014 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [0,1,0,0,0,0|3,0,0]=4 2015 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [0,1,0,0,0,0|3,0,0]=4 2016 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [0,1,0,0,0,0|3,0,0]=4 2017 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [0,1,0,0,0,0|2,0,0]=3 2018 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [0,1,0,0,0,0|3,0,0]=4 2019 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [0,1,0,0,0,0|3,0,0]=4 2020 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [0,1,0,0,0,0|3,0,0]=4 2021 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [0,1,0,0,0,0|3,0,0]=4 2022 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [0,1,0,0,0,0|3,0,0]=4 2023 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,1,0,0,0,0|2,0,0]=3 2024 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,1,0,0,0,0|3,0,0]=4 2025 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,1,0,0,0,0|3,0,0]=4 2026 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,1,0,0,0,0|3,0,0]=4 2027 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,1,0,0,0,0|3,0,0]=4 2028 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,1,0,0,0,0|3,0,0]=4 2029 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,1,0,0,0,0|3,0,0]=4 2030 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,1,0,0,0,0|3,0,0]=4 2031 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,1,0,0,0,0|3,0,0]=4 2032 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,1,0,0,0,0|3,0,0]=4 2033 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,1,0,0,0,0|3,0,0]=4 2034 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,1,0,0,0,0|2,0,0]=3 2035 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,1,0,0,0,0|3,0,0]=4 2036 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,1,0,0,0,0|3,0,0]=4 2037 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,1,0,0,0,0|3,0,0]=4 2038 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,1,0,0,0,0|3,0,0]=4 2039 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [0,1,0,0,0,0|3,0,0]=4 2040 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [0,1,0,0,0,0|3,0,0]=4 2041 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [0,1,0,0,0,0|3,0,0]=4 2042 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [0,1,0,0,0,0|3,0,0]=4 2043 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [0,1,0,0,0,0|3,0,0]=4 2044 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [0,1,0,0,0,0|3,0,0]=4 2045 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [0,1,0,0,0,0|3,0,0]=4 2046 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [0,1,0,0,0,0|3,0,0]=4 2047 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [0,1,0,0,0,0|3,0,0]=4 2048 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [0,1,0,0,0,0|3,0,0]=4 2049 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [0,1,0,0,0,0|3,0,0]=4 2050 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [0,1,0,0,0,0|3,0,0]=4 2051 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [0,1,0,0,0,0|3,0,0]=4 2052 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [0,1,0,0,0,0|3,0,0]=4 2053 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [0,1,0,0,0,0|2,0,0]=3 2054 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,1,0,0,0,0|3,0,0]=4 2055 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,1,0,0,0,0|3,0,0]=4 2056 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,1,0,0,0,0|3,0,0]=4 2057 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [0,1,0,0,0,0|3,0,0]=4 2058 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [0,1,0,0,0,0|3,0,0]=4 2059 B11R1.22 Cc1ccc(cc1)N(C)CF 269982a_100000219977_100015361967 [0,1,0,0,0,0|3,0,0]=4 2060 B11R1.22 Cc1ccc(cc1)N(C)CF 34a_100000219977_100015361967 [0,1,0,0,0,0|3,0,0]=4 2061 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [0,1,0,0,0,0|3,0,0]=4 2062 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [0,1,0,0,0,0|3,0,0]=4 2063 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,1,0,0,0,0|3,0,0]=4 2064 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,1,0,0,0,0|3,0,0]=4 2065 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,1,0,0,0,0|2,0,1]=4 2066 B11R1.22 N#CC(N)c1ccc(cc1)O 271570a_203496583355_106722365845 [0,1,0,0,0,0|2,0,1]=4 2067 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [0,1,0,0,0,0|2,0,0]=3 2068 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,1,0,0,0,0|2,0,0]=3 2069 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [0,1,0,0,0,0|2,0,0]=3 2070 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,1,0,0,0,0|3,0,0]=4 2071 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,1,0,0,0,0|3,0,0]=4 2072 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,1,0,0,0,0|3,0,0]=4 2073 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,1,0,0,0,0|3,0,0]=4 2074 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,1,0,0,0,0|3,0,0]=4 2075 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,1,0,0,0,0|2,0,0]=3 2076 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,0,0,0,0|2,0,0]=3 2077 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,1,0,0,0,0|2,0,1]=4 2078 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [0,1,0,0,0,0|2,0,0]=3 2079 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,1,0,0,0,0|3,0,0]=4 2080 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,1,0,0,0,0|3,0,0]=4 2081 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,1,0,0,0,0|3,0,0]=4 2082 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,1,0,0,0,0|3,0,0]=4 2083 B11R1.81 C=C=Cc1ccc(cc1Br)O 271570a_100015277604_100000701344 [0,1,0,0,0,0|1,0,2]=4 2084 B11R1.81 C=C=Cc1ccc(cc1C)O 271570a_100015277604_100000729255 [0,1,0,0,0,0|1,0,2]=4 2085 B11R1.81 C=C=Cc1ccc(cc1Cl)O 271570a_100015277604_100000047559 [0,1,0,0,0,0|1,0,2]=4 2086 B11R1.81 C=C=Cc1ccc(cc1F)O 271570a_100015277604_100000755031 [0,1,0,0,0,0|1,0,2]=4 2087 B11R1.81 C=C=Cc1ccc(cc1N)O 271570a_100015277604_100011999798 [0,1,0,0,0,0|1,0,2]=4 2088 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [0,1,0,0,0,0|1,0,2]=4 2089 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [0,1,0,0,0,0|2,0,1]=4 2090 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [0,1,0,0,0,0|2,0,1]=4 2091 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [0,1,0,0,0,0|2,0,1]=4 2092 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [0,1,0,0,0,0|2,0,1]=4 2093 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [0,1,0,0,0,0|2,0,1]=4 2094 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [0,1,0,0,0,0|1,0,1]=3 2095 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [0,1,0,0,0,0|2,0,1]=4 2096 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,1,0,0,0,0|2,0,1]=4 2097 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [0,1,0,0,0,0|2,0,1]=4 2098 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [0,1,0,0,0,0|2,0,1]=4 2099 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [0,1,0,0,0,0|2,0,1]=4 2100 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [0,1,0,0,0,0|1,0,1]=3 2101 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [0,1,0,0,0,0|2,0,1]=4 2102 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [0,1,0,0,0,0|2,0,1]=4 2103 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [0,1,0,0,0,0|2,0,1]=4 2104 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [0,1,0,0,0,0|2,0,1]=4 2105 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [0,1,0,0,0,0|2,0,1]=4 2106 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [0,1,0,0,0,0|1,0,1]=3 2107 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [0,1,0,0,0,0|2,0,1]=4 2108 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [0,1,0,0,0,0|2,0,1]=4 2109 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [0,1,0,0,0,0|2,0,1]=4 2110 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [0,1,0,0,0,0|2,0,1]=4 2111 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [0,1,0,0,0,0|2,0,1]=4 2112 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [0,1,0,0,0,0|1,0,1]=3 2113 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [0,1,0,0,0,0|2,0,1]=4 2114 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,1,0,0,0,0|2,0,1]=4 2115 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [0,1,0,0,0,0|2,0,1]=4 2116 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [0,1,0,0,0,0|2,0,1]=4 2117 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [0,1,0,0,0,0|2,0,1]=4 2118 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [0,1,0,0,0,0|1,0,1]=3 2119 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [0,1,0,0,0,0|2,0,1]=4 2120 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [0,1,0,0,0,0|2,0,1]=4 2121 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [0,1,0,0,0,0|2,0,1]=4 2122 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [0,1,0,0,0,0|2,0,1]=4 2123 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [0,1,0,0,0,0|1,0,1]=3 2124 B11R1.81 CC=Cc1ccc(nc1C)O 271570a_100016259895_100000691680 [0,1,0,0,0,0|2,0,1]=4 2125 B11R1.81 CC=Cc1ccc(nc1F)O 271570a_100016259895_100009879308 [0,1,0,0,0,0|2,0,1]=4 2126 B11R1.81 CC=Cc1cnc(cc1C)O 271570a_100016259895_100010114363 [0,1,0,0,0,0|2,0,1]=4 2127 B11R1.81 CC=Cc1ncc(cc1C)O 271570a_100016259895_100012000486 [0,1,0,0,0,0|2,0,1]=4 2128 B11R1.81 CC=Cc1ncc(cc1F)O 271570a_100016259895_100000063512 [0,1,0,0,0,0|2,0,1]=4 2129 B11R1.81 CCNc1ccc(cc1Br)Br 34a_100000211012_100000210202 [0,1,0,0,0,0|2,0,0]=3 2130 B11R1.81 CCNc1ccc(cc1Br)C 34a_100000210942_100000210202 [0,1,0,0,0,0|2,0,0]=3 2131 B11R1.81 CCNc1ccc(cc1Br)Cl 34a_100000752454_100000210202 [0,1,0,0,0,0|2,0,0]=3 2132 B11R1.81 CCNc1ccc(cc1Br)F 34a_100000738039_100000210202 [0,1,0,0,0,0|2,0,0]=3 2133 B11R1.81 CCNc1ccc(cc1Br)O 34a_100012001276_100000210202 [0,1,0,0,0,0|1,0,0]=2 2134 B11R1.81 CCNc1ccc(cc1C)Br 34a_100000211769_100000210202 [0,1,0,0,0,0|2,0,0]=3 2135 B11R1.81 CCNc1ccc(cc1C)Br 7a_100000211769_100000210202 [0,1,0,0,0,0|2,0,0]=3 2136 B11R1.81 CCNc1ccc(cc1C)C 34a_100000736561_100000210202 [0,1,0,0,0,0|2,0,0]=3 2137 B11R1.81 CCNc1ccc(cc1C)C 7a_100000736561_100000210202 [0,1,0,0,0,0|2,0,0]=3 2138 B11R1.81 CCNc1ccc(cc1C)Cl 34a_100000210418_100000210202 [0,1,0,0,0,0|2,0,0]=3 2139 B11R1.81 CCNc1ccc(cc1C)Cl 7a_100000210418_100000210202 [0,1,0,0,0,0|2,0,0]=3 2140 B11R1.81 CCNc1ccc(cc1C)F 34a_100000211637_100000210202 [0,1,0,0,0,0|2,0,0]=3 2141 B11R1.81 CCNc1ccc(cc1C)F 7a_100000211637_100000210202 [0,1,0,0,0,0|2,0,0]=3 2142 B11R1.81 CCNc1ccc(cc1C)I 34a_100000184554_100000210202 [0,1,0,0,0,0|2,0,0]=3 2143 B11R1.81 CCNc1ccc(cc1C)I 7a_100000184554_100000210202 [0,1,0,0,0,0|2,0,0]=3 2144 B11R1.81 CCNc1ccc(cc1C)O 34a_100000756630_100000210202 [0,1,0,0,0,0|1,0,0]=2 2145 B11R1.81 CCNc1ccc(cc1Cl)Br 34a_100000211467_100000210202 [0,1,0,0,0,0|2,0,0]=3 2146 B11R1.81 CCNc1ccc(cc1Cl)C 34a_100000210522_100000210202 [0,1,0,0,0,0|2,0,0]=3 2147 B11R1.81 CCNc1ccc(cc1Cl)Cl 34a_100000185861_100000210202 [0,1,0,0,0,0|2,0,0]=3 2148 B11R1.81 CCNc1ccc(cc1Cl)F 34a_100000212003_100000210202 [0,1,0,0,0,0|2,0,0]=3 2149 B11R1.81 CCNc1ccc(cc1Cl)I 34a_100011218065_100000210202 [0,1,0,0,0,0|2,0,0]=3 2150 B11R1.81 CCNc1ccc(cc1Cl)O 34a_100011215599_100000210202 [0,1,0,0,0,0|1,0,0]=2 2151 B11R1.81 CCNc1ccc(cc1F)Br 34a_100000210722_100000210202 [0,1,0,0,0,0|2,0,0]=3 2152 B11R1.81 CCNc1ccc(cc1F)C 34a_100000211023_100000210202 [0,1,0,0,0,0|2,0,0]=3 2153 B11R1.81 CCNc1ccc(cc1F)Cl 34a_100000211020_100000210202 [0,1,0,0,0,0|2,0,0]=3 2154 B11R1.81 CCNc1ccc(cc1F)F 34a_100000210720_100000210202 [0,1,0,0,0,0|2,0,0]=3 2155 B11R1.81 CCNc1ccc(cc1F)I 34a_100011215594_100000210202 [0,1,0,0,0,0|2,0,0]=3 2156 B11R1.81 CCNc1ccc(cc1F)O 34a_100000759473_100000210202 [0,1,0,0,0,0|1,0,0]=2 2157 B11R1.81 CCNc1ccc(cc1I)Br 34a_100000187925_100000210202 [0,1,0,0,0,0|2,0,0]=3 2158 B11R1.81 CCNc1ccc(cc1I)C 34a_100011356834_100000210202 [0,1,0,0,0,0|2,0,0]=3 2159 B11R1.81 CCNc1ccc(cc1I)Cl 34a_100000761889_100000210202 [0,1,0,0,0,0|2,0,0]=3 2160 B11R1.81 CCNc1ccc(cc1I)F 34a_100000760547_100000210202 [0,1,0,0,0,0|2,0,0]=3 2161 B11R1.81 CCNc1ccc(cc1I)O 34a_100010084370_100000210202 [0,1,0,0,0,0|1,0,0]=2 2162 B11R1.81 CCNc1ccc(cc1O)Br 34a_100000739049_100000210202 [0,1,0,0,0,0|2,0,0]=3 2163 B11R1.81 CCNc1ccc(cc1O)C 34a_100000211527_100000210202 [0,1,0,0,0,0|2,0,0]=3 2164 B11R1.81 CCNc1ccc(cc1O)Cl 34a_100000185728_100000210202 [0,1,0,0,0,0|2,0,0]=3 2165 B11R1.81 CCNc1ccc(cc1O)F 34a_100000753323_100000210202 [0,1,0,0,0,0|2,0,0]=3 2166 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [0,1,0,0,0,0|1,0,0]=2 2167 B11R1.81 CCOc1ccc(cc1Br)Br 34a_100000188717_100000210202 [0,1,0,0,0,0|1,0,0]=2 2168 B11R1.81 CCOc1ccc(cc1Br)Br 7a_100000188717_100000210202 [0,1,0,0,0,0|1,0,0]=2 2169 B11R1.81 CCOc1ccc(cc1Br)C 34a_100000210800_100000210202 [0,1,0,0,0,0|1,0,0]=2 2170 B11R1.81 CCOc1ccc(cc1Br)C 7a_100000210800_100000210202 [0,1,0,0,0,0|1,0,0]=2 2171 B11R1.81 CCOc1ccc(cc1Br)Cl 34a_100000211998_100000210202 [0,1,0,0,0,0|1,0,0]=2 2172 B11R1.81 CCOc1ccc(cc1Br)Cl 7a_100000211998_100000210202 [0,1,0,0,0,0|1,0,0]=2 2173 B11R1.81 CCOc1ccc(cc1Br)F 34a_100000211999_100000210202 [0,1,0,0,0,0|1,0,0]=2 2174 B11R1.81 CCOc1ccc(cc1Br)F 7a_100000211999_100000210202 [0,1,0,0,0,0|1,0,0]=2 2175 B11R1.81 CCOc1ccc(cc1Br)I 34a_100012361655_100000210202 [0,1,0,0,0,0|1,0,0]=2 2176 B11R1.81 CCOc1ccc(cc1Br)I 7a_100012361655_100000210202 [0,1,0,0,0,0|1,0,0]=2 2177 B11R1.81 CCOc1ccc(cc1Br)N 34a_100011534360_100000210202 [0,1,0,0,0,0|1,0,0]=2 2178 B11R1.81 CCOc1ccc(cc1Br)N 7a_100011534360_100000210202 [0,1,0,0,0,0|1,0,0]=2 2179 B11R1.81 CCOc1ccc(cc1C)Br 34a_100000186361_100000210202 [0,1,0,0,0,0|1,0,0]=2 2180 B11R1.81 CCOc1ccc(cc1C)Br 7a_100000186361_100000210202 [0,1,0,0,0,0|1,0,0]=2 2181 B11R1.81 CCOc1ccc(cc1C)C 34a_100000211776_100000210202 [0,1,0,0,0,0|1,0,0]=2 2182 B11R1.81 CCOc1ccc(cc1C)C 7a_100000211776_100000210202 [0,1,0,0,0,0|1,0,0]=2 2183 B11R1.81 CCOc1ccc(cc1C)Cl 34a_100000211091_100000210202 [0,1,0,0,0,0|1,0,0]=2 2184 B11R1.81 CCOc1ccc(cc1C)Cl 7a_100000211091_100000210202 [0,1,0,0,0,0|1,0,0]=2 2185 B11R1.81 CCOc1ccc(cc1C)F 34a_100000764316_100000210202 [0,1,0,0,0,0|1,0,0]=2 2186 B11R1.81 CCOc1ccc(cc1C)F 7a_100000764316_100000210202 [0,1,0,0,0,0|1,0,0]=2 2187 B11R1.81 CCOc1ccc(cc1C)I 34a_100011218673_100000210202 [0,1,0,0,0,0|1,0,0]=2 2188 B11R1.81 CCOc1ccc(cc1C)I 7a_100011218673_100000210202 [0,1,0,0,0,0|1,0,0]=2 2189 B11R1.81 CCOc1ccc(cc1C)N 34a_100011218179_100000210202 [0,1,0,0,0,0|1,0,0]=2 2190 B11R1.81 CCOc1ccc(cc1C)N 7a_100011218179_100000210202 [0,1,0,0,0,0|1,0,0]=2 2191 B11R1.81 CCOc1ccc(cc1C)O 271570a_203496583355_100011308936 [0,1,0,0,0,0|0,0,0]=1 2192 B11R1.81 CCOc1ccc(cc1Cl)Br 34a_100000186472_100000210202 [0,1,0,0,0,0|1,0,0]=2 2193 B11R1.81 CCOc1ccc(cc1Cl)Br 7a_100000186472_100000210202 [0,1,0,0,0,0|1,0,0]=2 2194 B11R1.81 CCOc1ccc(cc1Cl)C 34a_100000749699_100000210202 [0,1,0,0,0,0|1,0,0]=2 2195 B11R1.81 CCOc1ccc(cc1Cl)C 7a_100000749699_100000210202 [0,1,0,0,0,0|1,0,0]=2 2196 B11R1.81 CCOc1ccc(cc1Cl)Cl 34a_100015191787_100000210202 [0,1,0,0,0,0|1,0,0]=2 2197 B11R1.81 CCOc1ccc(cc1Cl)Cl 7a_100015191787_100000210202 [0,1,0,0,0,0|1,0,0]=2 2198 B11R1.81 CCOc1ccc(cc1Cl)F 34a_100000212004_100000210202 [0,1,0,0,0,0|1,0,0]=2 2199 B11R1.81 CCOc1ccc(cc1Cl)F 7a_100000212004_100000210202 [0,1,0,0,0,0|1,0,0]=2 2200 B11R1.81 CCOc1ccc(cc1Cl)I 34a_100012360047_100000210202 [0,1,0,0,0,0|1,0,0]=2 2201 B11R1.81 CCOc1ccc(cc1Cl)I 7a_100012360047_100000210202 [0,1,0,0,0,0|1,0,0]=2 2202 B11R1.81 CCOc1ccc(cc1Cl)N 34a_100000744943_100000210202 [0,1,0,0,0,0|1,0,0]=2 2203 B11R1.81 CCOc1ccc(cc1Cl)N 7a_100000744943_100000210202 [0,1,0,0,0,0|1,0,0]=2 2204 B11R1.81 CCOc1ccc(cc1F)Br 34a_100000185481_100000210202 [0,1,0,0,0,0|1,0,0]=2 2205 B11R1.81 CCOc1ccc(cc1F)Br 7a_100000185481_100000210202 [0,1,0,0,0,0|1,0,0]=2 2206 B11R1.81 CCOc1ccc(cc1F)C 34a_100011216688_100000210202 [0,1,0,0,0,0|1,0,0]=2 2207 B11R1.81 CCOc1ccc(cc1F)C 7a_100011216688_100000210202 [0,1,0,0,0,0|1,0,0]=2 2208 B11R1.81 CCOc1ccc(cc1F)Cl 34a_100000230166_100000210202 [0,1,0,0,0,0|1,0,0]=2 2209 B11R1.81 CCOc1ccc(cc1F)Cl 7a_100000230166_100000210202 [0,1,0,0,0,0|1,0,0]=2 2210 B11R1.81 CCOc1ccc(cc1F)F 34a_100000230127_100000210202 [0,1,0,0,0,0|1,0,0]=2 2211 B11R1.81 CCOc1ccc(cc1F)F 7a_100000230127_100000210202 [0,1,0,0,0,0|1,0,0]=2 2212 B11R1.81 CCOc1ccc(cc1F)I 34a_100011356965_100000210202 [0,1,0,0,0,0|1,0,0]=2 2213 B11R1.81 CCOc1ccc(cc1F)I 7a_100011356965_100000210202 [0,1,0,0,0,0|1,0,0]=2 2214 B11R1.81 CCOc1ccc(cc1F)N 34a_100011220035_100000210202 [0,1,0,0,0,0|1,0,0]=2 2215 B11R1.81 CCOc1ccc(cc1F)N 7a_100011220035_100000210202 [0,1,0,0,0,0|1,0,0]=2 2216 B11R1.81 CCOc1ccc(cc1F)O 271570a_203496583355_200000171753 [0,1,0,0,0,0|0,0,0]=1 2217 B11R1.81 CCOc1ccc(cc1I)Br 34a_100012355227_100000210202 [0,1,0,0,0,0|1,0,0]=2 2218 B11R1.81 CCOc1ccc(cc1I)Br 7a_100012355227_100000210202 [0,1,0,0,0,0|1,0,0]=2 2219 B11R1.81 CCOc1ccc(cc1I)C 34a_100000765521_100000210202 [0,1,0,0,0,0|1,0,0]=2 2220 B11R1.81 CCOc1ccc(cc1I)C 7a_100000765521_100000210202 [0,1,0,0,0,0|1,0,0]=2 2221 B11R1.81 CCOc1ccc(cc1I)Cl 34a_100011356953_100000210202 [0,1,0,0,0,0|1,0,0]=2 2222 B11R1.81 CCOc1ccc(cc1I)Cl 7a_100011356953_100000210202 [0,1,0,0,0,0|1,0,0]=2 2223 B11R1.81 CCOc1ccc(cc1I)F 34a_100012355409_100000210202 [0,1,0,0,0,0|1,0,0]=2 2224 B11R1.81 CCOc1ccc(cc1I)F 7a_100012355409_100000210202 [0,1,0,0,0,0|1,0,0]=2 2225 B11R1.81 CCOc1ccc(cc1I)I 7a_100010001573_100000210202 [0,1,0,0,0,0|1,0,0]=2 2226 B11R1.81 CCOc1ccc(cc1N)Br 34a_100000752626_100000210202 [0,1,0,0,0,0|1,0,0]=2 2227 B11R1.81 CCOc1ccc(cc1N)Br 7a_100000752626_100000210202 [0,1,0,0,0,0|1,0,0]=2 2228 B11R1.81 CCOc1ccc(cc1N)C 34a_100011215204_100000210202 [0,1,0,0,0,0|1,0,0]=2 2229 B11R1.81 CCOc1ccc(cc1N)C 7a_100011215204_100000210202 [0,1,0,0,0,0|1,0,0]=2 2230 B11R1.81 CCOc1ccc(cc1N)Cl 34a_100000210500_100000210202 [0,1,0,0,0,0|1,0,0]=2 2231 B11R1.81 CCOc1ccc(cc1N)Cl 7a_100000210500_100000210202 [0,1,0,0,0,0|1,0,0]=2 2232 B11R1.81 CCOc1ccc(cc1N)F 34a_100000759472_100000210202 [0,1,0,0,0,0|1,0,0]=2 2233 B11R1.81 CCOc1ccc(cc1N)F 7a_100000759472_100000210202 [0,1,0,0,0,0|1,0,0]=2 2234 B11R1.81 CCOc1ccc(cc1N)I 34a_100000753495_100000210202 [0,1,0,0,0,0|1,0,0]=2 2235 B11R1.81 CCOc1ccc(cc1N)I 7a_100000753495_100000210202 [0,1,0,0,0,0|1,0,0]=2 2236 B11R1.81 CCOc1ccc(cc1N)N 34a_100000725306_100000210202 [0,1,0,0,0,0|1,0,0]=2 2237 B11R1.81 CCOc1ccc(cc1N)O 271570a_203496583355_100000751366 [0,1,0,0,0,0|0,0,0]=1 2238 B11R1.81 CCOc1ccc(cc1O)C 271570a_203496583355_200000230997 [0,1,0,0,0,0|1,0,0]=2 2239 B11R1.81 CCOc1ccc(cc1O)F 271570a_203496583355_100000171695 [0,1,0,0,0,0|1,0,0]=2 2240 B11R1.81 CCOc1ccc(nc1Br)Br 34a_100009999766_100000210202 [0,1,0,0,0,0|2,0,0]=3 2241 B11R1.81 CCOc1ccc(nc1Br)Br 7a_100009999766_100000210202 [0,1,0,0,0,0|2,0,0]=3 2242 B11R1.81 CCOc1ccc(nc1Br)C 34a_100000702858_100000210202 [0,1,0,0,0,0|2,0,0]=3 2243 B11R1.81 CCOc1ccc(nc1Br)C 7a_100000702858_100000210202 [0,1,0,0,0,0|2,0,0]=3 2244 B11R1.81 CCOc1ccc(nc1Br)Cl 34a_100010219353_100000210202 [0,1,0,0,0,0|2,0,0]=3 2245 B11R1.81 CCOc1ccc(nc1Br)Cl 7a_100010219353_100000210202 [0,1,0,0,0,0|2,0,0]=3 2246 B11R1.81 CCOc1ccc(nc1Br)F 34a_100009887730_100000210202 [0,1,0,0,0,0|2,0,0]=3 2247 B11R1.81 CCOc1ccc(nc1Br)F 7a_100009887730_100000210202 [0,1,0,0,0,0|2,0,0]=3 2248 B11R1.81 CCOc1ccc(nc1Br)I 34a_100000725334_100000210202 [0,1,0,0,0,0|2,0,0]=3 2249 B11R1.81 CCOc1ccc(nc1Br)I 7a_100000725334_100000210202 [0,1,0,0,0,0|2,0,0]=3 2250 B11R1.81 CCOc1ccc(nc1C)Br 34a_100012002022_100000210202 [0,1,0,0,0,0|2,0,0]=3 2251 B11R1.81 CCOc1ccc(nc1C)Br 7a_100012002022_100000210202 [0,1,0,0,0,0|2,0,0]=3 2252 B11R1.81 CCOc1ccc(nc1C)C 34a_100011218912_100000210202 [0,1,0,0,0,0|2,0,0]=3 2253 B11R1.81 CCOc1ccc(nc1C)C 7a_100011218912_100000210202 [0,1,0,0,0,0|2,0,0]=3 2254 B11R1.81 CCOc1ccc(nc1C)Cl 34a_100012184626_100000210202 [0,1,0,0,0,0|2,0,0]=3 2255 B11R1.81 CCOc1ccc(nc1C)Cl 7a_100012184626_100000210202 [0,1,0,0,0,0|2,0,0]=3 2256 B11R1.81 CCOc1ccc(nc1C)F 34a_100009881036_100000210202 [0,1,0,0,0,0|2,0,0]=3 2257 B11R1.81 CCOc1ccc(nc1C)F 7a_100009881036_100000210202 [0,1,0,0,0,0|2,0,0]=3 2258 B11R1.81 CCOc1ccc(nc1C)I 34a_100010233687_100000210202 [0,1,0,0,0,0|2,0,0]=3 2259 B11R1.81 CCOc1ccc(nc1C)I 7a_100010233687_100000210202 [0,1,0,0,0,0|2,0,0]=3 2260 B11R1.81 CCOc1ccc(nc1Cl)Br 34a_100010246206_100000210202 [0,1,0,0,0,0|2,0,0]=3 2261 B11R1.81 CCOc1ccc(nc1Cl)Br 7a_100010246206_100000210202 [0,1,0,0,0,0|2,0,0]=3 2262 B11R1.81 CCOc1ccc(nc1Cl)C 34a_100000086286_100000210202 [0,1,0,0,0,0|2,0,0]=3 2263 B11R1.81 CCOc1ccc(nc1Cl)C 7a_100000086286_100000210202 [0,1,0,0,0,0|2,0,0]=3 2264 B11R1.81 CCOc1ccc(nc1Cl)Cl 34a_100000101165_100000210202 [0,1,0,0,0,0|2,0,0]=3 2265 B11R1.81 CCOc1ccc(nc1Cl)Cl 7a_100000101165_100000210202 [0,1,0,0,0,0|2,0,0]=3 2266 B11R1.81 CCOc1ccc(nc1Cl)I 34a_100000721234_100000210202 [0,1,0,0,0,0|2,0,0]=3 2267 B11R1.81 CCOc1ccc(nc1Cl)I 7a_100000721234_100000210202 [0,1,0,0,0,0|2,0,0]=3 2268 B11R1.81 CCOc1ccc(nc1F)Br 34a_100009819667_100000210202 [0,1,0,0,0,0|2,0,0]=3 2269 B11R1.81 CCOc1ccc(nc1F)Br 7a_100009819667_100000210202 [0,1,0,0,0,0|2,0,0]=3 2270 B11R1.81 CCOc1ccc(nc1F)C 34a_100000079963_100000210202 [0,1,0,0,0,0|2,0,0]=3 2271 B11R1.81 CCOc1ccc(nc1F)C 7a_100000079963_100000210202 [0,1,0,0,0,0|2,0,0]=3 2272 B11R1.81 CCOc1ccc(nc1F)Cl 34a_100009880201_100000210202 [0,1,0,0,0,0|2,0,0]=3 2273 B11R1.81 CCOc1ccc(nc1F)Cl 7a_100009880201_100000210202 [0,1,0,0,0,0|2,0,0]=3 2274 B11R1.81 CCOc1ccc(nc1F)F 34a_100000101184_100000210202 [0,1,0,0,0,0|2,0,0]=3 2275 B11R1.81 CCOc1ccc(nc1F)F 7a_100000101184_100000210202 [0,1,0,0,0,0|2,0,0]=3 2276 B11R1.81 CCOc1ccc(nc1I)Br 34a_100010253912_100000210202 [0,1,0,0,0,0|2,0,0]=3 2277 B11R1.81 CCOc1ccc(nc1I)Br 7a_100010253912_100000210202 [0,1,0,0,0,0|2,0,0]=3 2278 B11R1.81 CCOc1ccc(nc1I)C 34a_100000023897_100000210202 [0,1,0,0,0,0|2,0,0]=3 2279 B11R1.81 CCOc1ccc(nc1I)C 7a_100000023897_100000210202 [0,1,0,0,0,0|2,0,0]=3 2280 B11R1.81 CCOc1ccc(nc1I)Cl 34a_100000696390_100000210202 [0,1,0,0,0,0|2,0,0]=3 2281 B11R1.81 CCOc1ccc(nc1I)Cl 7a_100000696390_100000210202 [0,1,0,0,0,0|2,0,0]=3 2282 B11R1.81 CCOc1ccc(nc1I)F 34a_100010382442_100000210202 [0,1,0,0,0,0|2,0,0]=3 2283 B11R1.81 CCOc1ccc(nc1I)F 7a_100010382442_100000210202 [0,1,0,0,0,0|2,0,0]=3 2284 B11R1.81 CCOc1ccc(nc1N)Br 34a_100000685527_100000210202 [0,1,0,0,0,0|2,0,0]=3 2285 B11R1.81 CCOc1ccc(nc1N)Br 7a_100000685527_100000210202 [0,1,0,0,0,0|2,0,0]=3 2286 B11R1.81 CCOc1ccc(nc1N)C 34a_100000694039_100000210202 [0,1,0,0,0,0|2,0,0]=3 2287 B11R1.81 CCOc1ccc(nc1N)C 7a_100000694039_100000210202 [0,1,0,0,0,0|2,0,0]=3 2288 B11R1.81 CCOc1ccc(nc1N)Cl 34a_100000717809_100000210202 [0,1,0,0,0,0|2,0,0]=3 2289 B11R1.81 CCOc1ccc(nc1N)Cl 7a_100000717809_100000210202 [0,1,0,0,0,0|2,0,0]=3 2290 B11R1.81 CCOc1cnc(cc1Br)C 34a_100009843476_100000210202 [0,1,0,0,0,0|2,0,0]=3 2291 B11R1.81 CCOc1cnc(cc1Br)C 7a_100009843476_100000210202 [0,1,0,0,0,0|2,0,0]=3 2292 B11R1.81 CCOc1cnc(cc1C)C 34a_200000068632_100000210202 [0,1,0,0,0,0|2,0,0]=3 2293 B11R1.81 CCOc1cnc(cc1C)C 7a_200000068632_100000210202 [0,1,0,0,0,0|2,0,0]=3 2294 B11R1.81 CCOc1cnc(cc1C)Cl 34a_100000692680_100000210202 [0,1,0,0,0,0|2,0,0]=3 2295 B11R1.81 CCOc1cnc(cc1C)Cl 7a_100000692680_100000210202 [0,1,0,0,0,0|2,0,0]=3 2296 B11R1.81 CCOc1cnc(cc1C)F 34a_100009856773_100000210202 [0,1,0,0,0,0|2,0,0]=3 2297 B11R1.81 CCOc1cnc(cc1C)F 7a_100009856773_100000210202 [0,1,0,0,0,0|2,0,0]=3 2298 B11R1.81 CCOc1cnc(cc1Cl)Cl 34a_100009868576_100000210202 [0,1,0,0,0,0|2,0,0]=3 2299 B11R1.81 CCOc1cnc(cc1Cl)Cl 7a_100009868576_100000210202 [0,1,0,0,0,0|2,0,0]=3 2300 B11R1.81 CCOc1cnc(cc1F)F 34a_100009885687_100000210202 [0,1,0,0,0,0|2,0,0]=3 2301 B11R1.81 CCOc1cnc(cc1F)F 7a_100009885687_100000210202 [0,1,0,0,0,0|2,0,0]=3 2302 B11R1.81 CCOc1cnc(cc1I)Cl 34a_100000698892_100000210202 [0,1,0,0,0,0|2,0,0]=3 2303 B11R1.81 CCOc1cnc(cc1I)Cl 7a_100000698892_100000210202 [0,1,0,0,0,0|2,0,0]=3 2304 B11R1.81 CCOc1cnc(cc1N)Br 34a_100009819941_100000210202 [0,1,0,0,0,0|2,0,0]=3 2305 B11R1.81 CCOc1cnc(cc1N)Br 7a_100009819941_100000210202 [0,1,0,0,0,0|2,0,0]=3 2306 B11R1.81 CCOc1cnc(nc1C)C 34a_100009864123_100000210202 [0,1,0,0,0,0|3,0,0]=4 2307 B11R1.81 CCOc1cnc(nc1C)C 7a_100009864123_100000210202 [0,1,0,0,0,0|3,0,0]=4 2308 B11R1.81 CCOc1cnc(nc1Cl)Cl 34a_100010725077_100000210202 [0,1,0,0,0,0|3,0,0]=4 2309 B11R1.81 CCOc1cnc(nc1Cl)Cl 7a_100010725077_100000210202 [0,1,0,0,0,0|3,0,0]=4 2310 B11R1.81 CCOc1cnc(nc1N)N 7a_100025726691_100000210202 [0,1,0,0,0,0|3,0,0]=4 2311 B11R1.81 CCOc1coc(cc1=O)C 34a_100000081520_100000210202 [0,1,0,0,0,0|2,0,0]=3 2312 B11R1.81 CCOc1ncc(cc1Br)Br 34a_100000701035_100000210202 [0,1,0,0,0,0|2,0,0]=3 2313 B11R1.81 CCOc1ncc(cc1Br)C 34a_100000719714_100000210202 [0,1,0,0,0,0|2,0,0]=3 2314 B11R1.81 CCOc1ncc(cc1C)Br 34a_100000685391_100000210202 [0,1,0,0,0,0|2,0,0]=3 2315 B11R1.81 CCOc1ncc(cc1C)O 271570a_203496583355_100012351028 [0,1,0,0,0,0|1,0,0]=2 2316 B11R1.81 CCOc1ncc(cc1Cl)Br 34a_100012339560_100000210202 [0,1,0,0,0,0|2,0,0]=3 2317 B11R1.81 CCOc1ncc(cc1Cl)F 34a_100009847679_100000210202 [0,1,0,0,0,0|2,0,0]=3 2318 B11R1.81 CCOc1ncc(cc1F)Cl 34a_100011998252_100000210202 [0,1,0,0,0,0|2,0,0]=3 2319 B11R1.81 CCOc1ncc(cc1F)F 34a_100012025737_100000210202 [0,1,0,0,0,0|2,0,0]=3 2320 B11R1.81 CCOc1ncc(cc1N)Br 34a_100000743729_100000210202 [0,1,0,0,0,0|2,0,0]=3 2321 B11R1.81 CCOc1ncc(cc1N)C 34a_100012000488_100000210202 [0,1,0,0,0,0|2,0,0]=3 2322 B11R1.81 CCOc1ncc(cc1N)Cl 34a_100011998249_100000210202 [0,1,0,0,0,0|2,0,0]=3 2323 B11R1.81 CCOc1ncc(cc1N)O 271570a_203496583355_100011433076 [0,1,0,0,0,0|1,0,0]=2 2324 B11R1.81 CCOc1ncc(cc1O)Br 271570a_203496583355_200010177599 [0,1,0,0,0,0|2,0,0]=3 2325 B11R1.81 CCOc1ncc(nc1Cl)Br 34a_100010734560_100000210202 [0,1,0,0,0,0|3,0,0]=4 2326 B11R1.81 CCSc1c[nH]c(=O)cc1F 62a_100000210202_100015631685 [0,1,0,0,0,0|1,1,1]=4 2327 B11R1.81 CCSc1c[nH]c(=O)cc1F 62a_100015631685_100000210202 [0,1,0,0,0,0|1,1,1]=4 2328 B11R1.81 CCSc1cc[n+](cc1C)[O-] 62a_100000210202_100000074940 [0,1,0,0,0,0|1,1,1]=4 2329 B11R1.81 CCSc1ccc(=O)[nH]c1N 62a_100009884077_100000210202 [0,1,0,0,0,0|1,1,1]=4 2330 B11R1.81 CCSc1ccc(c[n+]1[O-])C 62a_100000210202_100009819918 [0,1,0,0,0,0|2,1,0]=4 2331 B11R1.81 CCSc1ccc(c[n+]1[O-])F 62a_100000210202_100009817261 [0,1,0,0,0,0|2,1,0]=4 2332 B11R1.81 CCSc1ccc(c[n+]1[O-])F 62a_100009817261_100000210202 [0,1,0,0,0,0|2,1,0]=4 2333 B11R1.81 CCSc1ccc(cc1Br)Br 62a_100000210202_100011484698 [0,1,0,0,0,0|1,1,0]=3 2334 B11R1.81 CCSc1ccc(cc1Br)Br 62a_100011484698_100000210202 [0,1,0,0,0,0|1,1,0]=3 2335 B11R1.81 CCSc1ccc(cc1Br)C 62a_100000210202_100009813563 [0,1,0,0,0,0|1,1,0]=3 2336 B11R1.81 CCSc1ccc(cc1Br)C 62a_100009813563_100000210202 [0,1,0,0,0,0|1,1,0]=3 2337 B11R1.81 CCSc1ccc(cc1Br)Cl 62a_100000210202_100011219703 [0,1,0,0,0,0|1,1,0]=3 2338 B11R1.81 CCSc1ccc(cc1Br)Cl 62a_100011219703_100000210202 [0,1,0,0,0,0|1,1,0]=3 2339 B11R1.81 CCSc1ccc(cc1Br)F 62a_100000210202_100011217111 [0,1,0,0,0,0|1,1,0]=3 2340 B11R1.81 CCSc1ccc(cc1Br)F 62a_100011217111_100000210202 [0,1,0,0,0,0|1,1,0]=3 2341 B11R1.81 CCSc1ccc(cc1Br)N 62a_100000210202_100000750458 [0,1,0,0,0,0|1,1,0]=3 2342 B11R1.81 CCSc1ccc(cc1Br)N 62a_100000750458_100000210202 [0,1,0,0,0,0|1,1,0]=3 2343 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000210202_100000701344 [0,1,0,0,0,0|0,1,0]=2 2344 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000701344_100000210202 [0,1,0,0,0,0|0,1,0]=2 2345 B11R1.81 CCSc1ccc(cc1C)Br 62a_100000210202_100000701812 [0,1,0,0,0,0|1,1,0]=3 2346 B11R1.81 CCSc1ccc(cc1C)Br 62a_100000701812_100000210202 [0,1,0,0,0,0|1,1,0]=3 2347 B11R1.81 CCSc1ccc(cc1C)C 62a_100000210202_100011217332 [0,1,0,0,0,0|1,1,0]=3 2348 B11R1.81 CCSc1ccc(cc1C)C 62a_100011217332_100000210202 [0,1,0,0,0,0|1,1,0]=3 2349 B11R1.81 CCSc1ccc(cc1C)Cl 62a_100000210202_100011219607 [0,1,0,0,0,0|1,1,0]=3 2350 B11R1.81 CCSc1ccc(cc1C)Cl 62a_100011219607_100000210202 [0,1,0,0,0,0|1,1,0]=3 2351 B11R1.81 CCSc1ccc(cc1C)F 62a_100000210202_100011205405 [0,1,0,0,0,0|1,1,0]=3 2352 B11R1.81 CCSc1ccc(cc1C)F 62a_100011205405_100000210202 [0,1,0,0,0,0|1,1,0]=3 2353 B11R1.81 CCSc1ccc(cc1C)N 62a_100000210202_100000210723 [0,1,0,0,0,0|1,1,0]=3 2354 B11R1.81 CCSc1ccc(cc1C)N 62a_100000210723_100000210202 [0,1,0,0,0,0|1,1,0]=3 2355 B11R1.81 CCSc1ccc(cc1C)O 62a_100000210202_100000690111 [0,1,0,0,0,0|0,1,0]=2 2356 B11R1.81 CCSc1ccc(cc1Cl)Br 62a_100000210202_100011216062 [0,1,0,0,0,0|1,1,0]=3 2357 B11R1.81 CCSc1ccc(cc1Cl)Br 62a_100011216062_100000210202 [0,1,0,0,0,0|1,1,0]=3 2358 B11R1.81 CCSc1ccc(cc1Cl)C 62a_100000210202_100011263221 [0,1,0,0,0,0|1,1,0]=3 2359 B11R1.81 CCSc1ccc(cc1Cl)C 62a_100011263221_100000210202 [0,1,0,0,0,0|1,1,0]=3 2360 B11R1.81 CCSc1ccc(cc1Cl)Cl 62a_100000210202_100000699841 [0,1,0,0,0,0|1,1,0]=3 2361 B11R1.81 CCSc1ccc(cc1Cl)Cl 62a_100000699841_100000210202 [0,1,0,0,0,0|1,1,0]=3 2362 B11R1.81 CCSc1ccc(cc1Cl)F 62a_100000210202_100000733362 [0,1,0,0,0,0|1,1,0]=3 2363 B11R1.81 CCSc1ccc(cc1Cl)F 62a_100000733362_100000210202 [0,1,0,0,0,0|1,1,0]=3 2364 B11R1.81 CCSc1ccc(cc1Cl)N 62a_100000210202_100000761885 [0,1,0,0,0,0|1,1,0]=3 2365 B11R1.81 CCSc1ccc(cc1Cl)N 62a_100000761885_100000210202 [0,1,0,0,0,0|1,1,0]=3 2366 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000047559_100000210202 [0,1,0,0,0,0|0,1,0]=2 2367 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000210202_100000047559 [0,1,0,0,0,0|0,1,0]=2 2368 B11R1.81 CCSc1ccc(cc1F)Br 62a_100000210202_100009814013 [0,1,0,0,0,0|1,1,0]=3 2369 B11R1.81 CCSc1ccc(cc1F)Br 62a_100009814013_100000210202 [0,1,0,0,0,0|1,1,0]=3 2370 B11R1.81 CCSc1ccc(cc1F)C 62a_100000210202_100011216119 [0,1,0,0,0,0|1,1,0]=3 2371 B11R1.81 CCSc1ccc(cc1F)C 62a_100011216119_100000210202 [0,1,0,0,0,0|1,1,0]=3 2372 B11R1.81 CCSc1ccc(cc1F)Cl 62a_100000210202_100011216042 [0,1,0,0,0,0|1,1,0]=3 2373 B11R1.81 CCSc1ccc(cc1F)Cl 62a_100011216042_100000210202 [0,1,0,0,0,0|1,1,0]=3 2374 B11R1.81 CCSc1ccc(cc1F)F 62a_100000210202_100000750030 [0,1,0,0,0,0|1,1,0]=3 2375 B11R1.81 CCSc1ccc(cc1F)F 62a_100000750030_100000210202 [0,1,0,0,0,0|1,1,0]=3 2376 B11R1.81 CCSc1ccc(cc1F)N 62a_100000210202_100011356925 [0,1,0,0,0,0|1,1,0]=3 2377 B11R1.81 CCSc1ccc(cc1F)N 62a_100011356925_100000210202 [0,1,0,0,0,0|1,1,0]=3 2378 B11R1.81 CCSc1ccc(cc1F)O 62a_100000210202_100000755031 [0,1,0,0,0,0|0,1,0]=2 2379 B11R1.81 CCSc1ccc(cc1F)O 62a_100000755031_100000210202 [0,1,0,0,0,0|0,1,0]=2 2380 B11R1.81 CCSc1ccc(cc1N)Br 62a_100000210202_100000743836 [0,1,0,0,0,0|1,1,0]=3 2381 B11R1.81 CCSc1ccc(cc1N)Br 62a_100000743836_100000210202 [0,1,0,0,0,0|1,1,0]=3 2382 B11R1.81 CCSc1ccc(cc1N)C 62a_100000210202_100011216686 [0,1,0,0,0,0|1,1,0]=3 2383 B11R1.81 CCSc1ccc(cc1N)C 62a_100011216686_100000210202 [0,1,0,0,0,0|1,1,0]=3 2384 B11R1.81 CCSc1ccc(cc1N)Cl 62a_100000210202_100000761886 [0,1,0,0,0,0|1,1,0]=3 2385 B11R1.81 CCSc1ccc(cc1N)Cl 62a_100000761886_100000210202 [0,1,0,0,0,0|1,1,0]=3 2386 B11R1.81 CCSc1ccc(cc1N)F 62a_100000210202_100000687223 [0,1,0,0,0,0|1,1,0]=3 2387 B11R1.81 CCSc1ccc(cc1N)F 62a_100000687223_100000210202 [0,1,0,0,0,0|1,1,0]=3 2388 B11R1.81 CCSc1ccc(cc1N)N 62a_100000210202_200012175722 [0,1,0,0,0,0|1,1,0]=3 2389 B11R1.81 CCSc1ccc(cc1N)N 62a_200012175722_100000210202 [0,1,0,0,0,0|1,1,0]=3 2390 B11R1.81 CCSc1ccc(cc1N)O 62a_100000210202_100011999798 [0,1,0,0,0,0|0,1,0]=2 2391 B11R1.81 CCSc1ccc(cc1N)O 62a_100011999798_100000210202 [0,1,0,0,0,0|0,1,0]=2 2392 B11R1.81 CCSc1ccc(cc1O)Br 62a_100000210202_100012344904 [0,1,0,0,0,0|1,1,0]=3 2393 B11R1.81 CCSc1ccc(cc1O)Br 62a_100012344904_100000210202 [0,1,0,0,0,0|1,1,0]=3 2394 B11R1.81 CCSc1ccc(cc1O)C 62a_100000210202_100012002257 [0,1,0,0,0,0|1,1,0]=3 2395 B11R1.81 CCSc1ccc(cc1O)C 62a_100012002257_100000210202 [0,1,0,0,0,0|1,1,0]=3 2396 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000050036_100000210202 [0,1,0,0,0,0|1,1,0]=3 2397 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000210202_100000050036 [0,1,0,0,0,0|1,1,0]=3 2398 B11R1.81 CCSc1ccc(cc1O)F 62a_100000210202_100000690578 [0,1,0,0,0,0|1,1,0]=3 2399 B11R1.81 CCSc1ccc(cc1O)F 62a_100000690578_100000210202 [0,1,0,0,0,0|1,1,0]=3 2400 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [0,1,0,0,0,0|0,1,0]=2 2401 B11R1.81 CCSc1ccc(nc1Br)N 62a_100000210202_100010734177 [0,1,0,0,0,0|2,1,0]=4 2402 B11R1.81 CCSc1ccc(nc1Br)N 62a_100010734177_100000210202 [0,1,0,0,0,0|2,1,0]=4 2403 B11R1.81 CCSc1ccc(nc1C)C 62a_100000210202_100009813853 [0,1,0,0,0,0|2,1,0]=4 2404 B11R1.81 CCSc1ccc(nc1C)C 62a_100009813853_100000210202 [0,1,0,0,0,0|2,1,0]=4 2405 B11R1.81 CCSc1ccc(nc1C)Cl 62a_100000062408_100000210202 [0,1,0,0,0,0|2,1,0]=4 2406 B11R1.81 CCSc1ccc(nc1C)Cl 62a_100000210202_100000062408 [0,1,0,0,0,0|2,1,0]=4 2407 B11R1.81 CCSc1ccc(nc1C)F 62a_100000210202_100000688911 [0,1,0,0,0,0|2,1,0]=4 2408 B11R1.81 CCSc1ccc(nc1C)F 62a_100000688911_100000210202 [0,1,0,0,0,0|2,1,0]=4 2409 B11R1.81 CCSc1ccc(nc1C)N 62a_100000187202_100000210202 [0,1,0,0,0,0|2,1,0]=4 2410 B11R1.81 CCSc1ccc(nc1C)N 62a_100000210202_100000187202 [0,1,0,0,0,0|2,1,0]=4 2411 B11R1.81 CCSc1ccc(nc1C)O 62a_100000210202_100000691680 [0,1,0,0,0,0|1,1,0]=3 2412 B11R1.81 CCSc1ccc(nc1C)O 62a_100000691680_100000210202 [0,1,0,0,0,0|1,1,0]=3 2413 B11R1.81 CCSc1ccc(nc1Cl)Br 62a_100000210202_100010246183 [0,1,0,0,0,0|2,1,0]=4 2414 B11R1.81 CCSc1ccc(nc1Cl)Br 62a_100010246183_100000210202 [0,1,0,0,0,0|2,1,0]=4 2415 B11R1.81 CCSc1ccc(nc1Cl)Cl 62a_100000210202_100000043682 [0,1,0,0,0,0|2,1,0]=4 2416 B11R1.81 CCSc1ccc(nc1Cl)N 62a_100000210202_100010270343 [0,1,0,0,0,0|2,1,0]=4 2417 B11R1.81 CCSc1ccc(nc1Cl)N 62a_100010270343_100000210202 [0,1,0,0,0,0|2,1,0]=4 2418 B11R1.81 CCSc1ccc(nc1F)C 62a_100000210202_100010006597 [0,1,0,0,0,0|2,1,0]=4 2419 B11R1.81 CCSc1ccc(nc1F)C 62a_100010006597_100000210202 [0,1,0,0,0,0|2,1,0]=4 2420 B11R1.81 CCSc1ccc(nc1F)Cl 62a_100000210202_100010168078 [0,1,0,0,0,0|2,1,0]=4 2421 B11R1.81 CCSc1ccc(nc1F)Cl 62a_100010168078_100000210202 [0,1,0,0,0,0|2,1,0]=4 2422 B11R1.81 CCSc1ccc(nc1F)F 62a_100000070099_100000210202 [0,1,0,0,0,0|2,1,0]=4 2423 B11R1.81 CCSc1ccc(nc1F)F 62a_100000210202_100000070099 [0,1,0,0,0,0|2,1,0]=4 2424 B11R1.81 CCSc1ccc(nc1F)N 62a_100000210202_100009882772 [0,1,0,0,0,0|2,1,0]=4 2425 B11R1.81 CCSc1ccc(nc1F)N 62a_100009882772_100000210202 [0,1,0,0,0,0|2,1,0]=4 2426 B11R1.81 CCSc1ccc(nc1F)O 62a_100000210202_100009879308 [0,1,0,0,0,0|1,1,0]=3 2427 B11R1.81 CCSc1ccc(nc1F)O 62a_100009879308_100000210202 [0,1,0,0,0,0|1,1,0]=3 2428 B11R1.81 CCSc1ccc(nc1N)C 62a_100000210202_100009816662 [0,1,0,0,0,0|2,1,0]=4 2429 B11R1.81 CCSc1ccc(nc1N)C 62a_100009816662_100000210202 [0,1,0,0,0,0|2,1,0]=4 2430 B11R1.81 CCSc1ccc(nc1N)Cl 62a_100000210202_100010171640 [0,1,0,0,0,0|2,1,0]=4 2431 B11R1.81 CCSc1ccc(nc1N)Cl 62a_100010171640_100000210202 [0,1,0,0,0,0|2,1,0]=4 2432 B11R1.81 CCSc1ccc(nc1N)F 62a_100000210202_100009854977 [0,1,0,0,0,0|2,1,0]=4 2433 B11R1.81 CCSc1ccc(nc1N)F 62a_100009854977_100000210202 [0,1,0,0,0,0|2,1,0]=4 2434 B11R1.81 CCSc1ccc(nc1N)N 62a_100011356871_100000210202 [0,1,0,0,0,0|2,1,0]=4 2435 B11R1.81 CCSc1ccc(nc1O)C 62a_100000210202_100009817604 [0,1,0,0,0,0|2,1,0]=4 2436 B11R1.81 CCSc1ccc(nc1O)C 62a_100009817604_100000210202 [0,1,0,0,0,0|2,1,0]=4 2437 B11R1.81 CCSc1cnc([nH]c1=O)O 62a_100000210202_100011215686 [0,1,0,0,0,0|2,1,0]=4 2438 B11R1.81 CCSc1cnc(cc1Br)F 62a_100000210202_100015451857 [0,1,0,0,0,0|2,1,0]=4 2439 B11R1.81 CCSc1cnc(cc1Br)F 62a_100015451857_100000210202 [0,1,0,0,0,0|2,1,0]=4 2440 B11R1.81 CCSc1cnc(cc1Br)N 62a_100000210202_100010074611 [0,1,0,0,0,0|2,1,0]=4 2441 B11R1.81 CCSc1cnc(cc1Br)N 62a_100010074611_100000210202 [0,1,0,0,0,0|2,1,0]=4 2442 B11R1.81 CCSc1cnc(cc1C)Br 62a_100000210202_100009816104 [0,1,0,0,0,0|2,1,0]=4 2443 B11R1.81 CCSc1cnc(cc1C)Br 62a_100009816104_100000210202 [0,1,0,0,0,0|2,1,0]=4 2444 B11R1.81 CCSc1cnc(cc1C)C 62a_100000210202_100009819613 [0,1,0,0,0,0|2,1,0]=4 2445 B11R1.81 CCSc1cnc(cc1C)C 62a_100009819613_100000210202 [0,1,0,0,0,0|2,1,0]=4 2446 B11R1.81 CCSc1cnc(cc1C)Cl 62a_100000210202_100010172789 [0,1,0,0,0,0|2,1,0]=4 2447 B11R1.81 CCSc1cnc(cc1C)Cl 62a_100010172789_100000210202 [0,1,0,0,0,0|2,1,0]=4 2448 B11R1.81 CCSc1cnc(cc1C)F 62a_100000210202_100009820716 [0,1,0,0,0,0|2,1,0]=4 2449 B11R1.81 CCSc1cnc(cc1C)F 62a_100009820716_100000210202 [0,1,0,0,0,0|2,1,0]=4 2450 B11R1.81 CCSc1cnc(cc1C)N 62a_100000050067_100000210202 [0,1,0,0,0,0|2,1,0]=4 2451 B11R1.81 CCSc1cnc(cc1C)N 62a_100000210202_100000050067 [0,1,0,0,0,0|2,1,0]=4 2452 B11R1.81 CCSc1cnc(cc1C)O 62a_100000210202_100000766222 [0,1,0,0,0,0|1,1,0]=3 2453 B11R1.81 CCSc1cnc(cc1C)O 62a_100000766222_100000210202 [0,1,0,0,0,0|1,1,0]=3 2454 B11R1.81 CCSc1cnc(cc1Cl)Br 62a_100000210202_100010381092 [0,1,0,0,0,0|2,1,0]=4 2455 B11R1.81 CCSc1cnc(cc1Cl)Br 62a_100010381092_100000210202 [0,1,0,0,0,0|2,1,0]=4 2456 B11R1.81 CCSc1cnc(cc1Cl)Cl 62a_100000210202_100010200927 [0,1,0,0,0,0|2,1,0]=4 2457 B11R1.81 CCSc1cnc(cc1Cl)Cl 62a_100010200927_100000210202 [0,1,0,0,0,0|2,1,0]=4 2458 B11R1.81 CCSc1cnc(cc1Cl)N 62a_100000210202_100000694920 [0,1,0,0,0,0|2,1,0]=4 2459 B11R1.81 CCSc1cnc(cc1Cl)N 62a_100000694920_100000210202 [0,1,0,0,0,0|2,1,0]=4 2460 B11R1.81 CCSc1cnc(cc1F)Cl 62a_100000210202_100010128100 [0,1,0,0,0,0|2,1,0]=4 2461 B11R1.81 CCSc1cnc(cc1F)Cl 62a_100010128100_100000210202 [0,1,0,0,0,0|2,1,0]=4 2462 B11R1.81 CCSc1cnc(cc1F)N 62a_100000210202_100009844730 [0,1,0,0,0,0|2,1,0]=4 2463 B11R1.81 CCSc1cnc(cc1F)N 62a_100009844730_100000210202 [0,1,0,0,0,0|2,1,0]=4 2464 B11R1.81 CCSc1cnc(cc1N)C 62a_100000210202_100009817891 [0,1,0,0,0,0|2,1,0]=4 2465 B11R1.81 CCSc1cnc(cc1N)C 62a_100009817891_100000210202 [0,1,0,0,0,0|2,1,0]=4 2466 B11R1.81 CCSc1cnc(cc1N)Cl 62a_100000210202_100010209552 [0,1,0,0,0,0|2,1,0]=4 2467 B11R1.81 CCSc1cnc(cc1N)Cl 62a_100010209552_100000210202 [0,1,0,0,0,0|2,1,0]=4 2468 B11R1.81 CCSc1cnc(cc1N)N 62a_100000210202_200009857908 [0,1,0,0,0,0|2,1,0]=4 2469 B11R1.81 CCSc1cnc(cc1N)N 62a_200009857908_100000210202 [0,1,0,0,0,0|2,1,0]=4 2470 B11R1.81 CCSc1cnc(cc1O)C 62a_100000210202_100011016184 [0,1,0,0,0,0|2,1,0]=4 2471 B11R1.81 CCSc1cnc(cc1O)C 62a_100011016184_100000210202 [0,1,0,0,0,0|2,1,0]=4 2472 B11R1.81 CCSc1ncc(cc1Br)Cl 62a_100000210202_100012154958 [0,1,0,0,0,0|2,1,0]=4 2473 B11R1.81 CCSc1ncc(cc1Br)Cl 62a_100012154958_100000210202 [0,1,0,0,0,0|2,1,0]=4 2474 B11R1.81 CCSc1ncc(cc1C)Br 62a_100000210202_100012353652 [0,1,0,0,0,0|2,1,0]=4 2475 B11R1.81 CCSc1ncc(cc1C)Br 62a_100012353652_100000210202 [0,1,0,0,0,0|2,1,0]=4 2476 B11R1.81 CCSc1ncc(cc1C)C 62a_100000210202_100009864548 [0,1,0,0,0,0|2,1,0]=4 2477 B11R1.81 CCSc1ncc(cc1C)C 62a_100009864548_100000210202 [0,1,0,0,0,0|2,1,0]=4 2478 B11R1.81 CCSc1ncc(cc1C)F 62a_100000210202_100009817009 [0,1,0,0,0,0|2,1,0]=4 2479 B11R1.81 CCSc1ncc(cc1C)F 62a_100009817009_100000210202 [0,1,0,0,0,0|2,1,0]=4 2480 B11R1.81 CCSc1ncc(cc1C)N 62a_100000210202_100000761747 [0,1,0,0,0,0|2,1,0]=4 2481 B11R1.81 CCSc1ncc(cc1C)N 62a_100000761747_100000210202 [0,1,0,0,0,0|2,1,0]=4 2482 B11R1.81 CCSc1ncc(cc1C)O 62a_100000210202_100012000486 [0,1,0,0,0,0|1,1,0]=3 2483 B11R1.81 CCSc1ncc(cc1C)O 62a_100012000486_100000210202 [0,1,0,0,0,0|1,1,0]=3 2484 B11R1.81 CCSc1ncc(cc1F)Br 62a_100000210202_100012348576 [0,1,0,0,0,0|2,1,0]=4 2485 B11R1.81 CCSc1ncc(cc1F)Br 62a_100012348576_100000210202 [0,1,0,0,0,0|2,1,0]=4 2486 B11R1.81 CCSc1ncc(cc1F)C 62a_100000210202_100009819633 [0,1,0,0,0,0|2,1,0]=4 2487 B11R1.81 CCSc1ncc(cc1F)C 62a_100009819633_100000210202 [0,1,0,0,0,0|2,1,0]=4 2488 B11R1.81 CCSc1ncc(cc1F)Cl 62a_100000210202_100012348686 [0,1,0,0,0,0|2,1,0]=4 2489 B11R1.81 CCSc1ncc(cc1F)Cl 62a_100012348686_100000210202 [0,1,0,0,0,0|2,1,0]=4 2490 B11R1.81 CCSc1ncc(cc1F)F 62a_100000210202_100011219543 [0,1,0,0,0,0|2,1,0]=4 2491 B11R1.81 CCSc1ncc(cc1F)F 62a_100011219543_100000210202 [0,1,0,0,0,0|2,1,0]=4 2492 B11R1.81 CCSc1ncc(cc1F)N 62a_100000210202_100010280766 [0,1,0,0,0,0|2,1,0]=4 2493 B11R1.81 CCSc1ncc(cc1F)N 62a_100010280766_100000210202 [0,1,0,0,0,0|2,1,0]=4 2494 B11R1.81 CCSc1ncc(cc1F)O 62a_100000210202_100000063512 [0,1,0,0,0,0|1,1,0]=3 2495 B11R1.81 CCSc1ncc(cc1N)Br 62a_100000210202_100010090555 [0,1,0,0,0,0|2,1,0]=4 2496 B11R1.81 CCSc1ncc(cc1N)Br 62a_100010090555_100000210202 [0,1,0,0,0,0|2,1,0]=4 2497 B11R1.81 CCSc1ncc(cc1N)C 62a_100000210202_100000733613 [0,1,0,0,0,0|2,1,0]=4 2498 B11R1.81 CCSc1ncc(cc1N)C 62a_100000733613_100000210202 [0,1,0,0,0,0|2,1,0]=4 2499 B11R1.81 CCSc1ncc(cc1N)F 62a_100000210202_100009817643 [0,1,0,0,0,0|2,1,0]=4 2500 B11R1.81 CCSc1ncc(cc1N)F 62a_100009817643_100000210202 [0,1,0,0,0,0|2,1,0]=4 2501 B11R1.81 CCSc1ncc(cc1N)N 62a_100000210202_200000093520 [0,1,0,0,0,0|2,1,0]=4 2502 B11R1.81 CCSc1ncc(cc1N)N 62a_200000093520_100000210202 [0,1,0,0,0,0|2,1,0]=4 2503 B11R1.81 CCSc1ncc(cc1O)Br 62a_100000210202_100010210634 [0,1,0,0,0,0|2,1,0]=4 2504 B11R1.81 CCSc1ncc(cc1O)Br 62a_100010210634_100000210202 [0,1,0,0,0,0|2,1,0]=4 2505 B11R1.81 CCSc1ncc(cc1O)C 62a_100000210202_100012000487 [0,1,0,0,0,0|2,1,0]=4 2506 B11R1.81 CCSc1ncc(cc1O)Cl 62a_100000210202_100010233512 [0,1,0,0,0,0|2,1,0]=4 2507 B11R1.81 CCSc1ncc(cc1O)Cl 62a_100010233512_100000210202 [0,1,0,0,0,0|2,1,0]=4 2508 B11R1.81 CCSc1ncc(cc1O)F 62a_100000210202_100000079967 [0,1,0,0,0,0|2,1,0]=4 2509 B11R1.81 CCSc1ncc(cc1O)F 62a_100009820119_100000210202 [0,1,0,0,0,0|2,1,0]=4 2510 B11R1.81 CNCc1ccc(cc1Br)Br 207a_100102657272_100012351556 [0,1,0,0,0,0|3,0,0]=4 2511 B11R1.81 CNCc1ccc(cc1Br)Br 2230a_106832991635_200012351560 [0,1,0,0,0,0|3,0,0]=4 2512 B11R1.81 CNCc1ccc(cc1Br)Br 26a_100102657272_100000188717 [0,1,0,0,0,0|3,0,0]=4 2513 B11R1.81 CNCc1ccc(cc1Br)Br 270004a_106832991635_100012351556 [0,1,0,0,0,0|3,0,0]=4 2514 B11R1.81 CNCc1ccc(cc1Br)Br 34a_100102657272_200012351560 [0,1,0,0,0,0|3,0,0]=4 2515 B11R1.81 CNCc1ccc(cc1Br)Br 7a_106832991635_200012351560 [0,1,0,0,0,0|3,0,0]=4 2516 B11R1.81 CNCc1ccc(cc1Br)C 207a_100102657272_100000692596 [0,1,0,0,0,0|3,0,0]=4 2517 B11R1.81 CNCc1ccc(cc1Br)C 26a_100102657272_100000210800 [0,1,0,0,0,0|3,0,0]=4 2518 B11R1.81 CNCc1ccc(cc1Br)C 270004a_106832991635_100000692596 [0,1,0,0,0,0|3,0,0]=4 2519 B11R1.81 CNCc1ccc(cc1Br)Cl 207a_100102657272_100000687667 [0,1,0,0,0,0|3,0,0]=4 2520 B11R1.81 CNCc1ccc(cc1Br)Cl 2230a_106832991635_100000755608 [0,1,0,0,0,0|3,0,0]=4 2521 B11R1.81 CNCc1ccc(cc1Br)Cl 26a_100102657272_100000211998 [0,1,0,0,0,0|3,0,0]=4 2522 B11R1.81 CNCc1ccc(cc1Br)Cl 270004a_106832991635_100000687667 [0,1,0,0,0,0|3,0,0]=4 2523 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102657272_100000755608 [0,1,0,0,0,0|3,0,0]=4 2524 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102692131_200000210301 [0,1,0,0,0,0|3,0,0]=4 2525 B11R1.81 CNCc1ccc(cc1Br)Cl 7a_106832991635_100000755608 [0,1,0,0,0,0|3,0,0]=4 2526 B11R1.81 CNCc1ccc(cc1Br)F 207a_100102657272_100000685661 [0,1,0,0,0,0|3,0,0]=4 2527 B11R1.81 CNCc1ccc(cc1Br)F 2230a_106832991635_100000243222 [0,1,0,0,0,0|3,0,0]=4 2528 B11R1.81 CNCc1ccc(cc1Br)F 26a_100102657272_100000211999 [0,1,0,0,0,0|3,0,0]=4 2529 B11R1.81 CNCc1ccc(cc1Br)F 270004a_106832991635_100000685661 [0,1,0,0,0,0|3,0,0]=4 2530 B11R1.81 CNCc1ccc(cc1Br)F 34a_100000708791_200000210301 [0,1,0,0,0,0|3,0,0]=4 2531 B11R1.81 CNCc1ccc(cc1Br)F 34a_100102657272_100000243222 [0,1,0,0,0,0|3,0,0]=4 2532 B11R1.81 CNCc1ccc(cc1Br)F 7a_106832991635_100000243222 [0,1,0,0,0,0|3,0,0]=4 2533 B11R1.81 CNCc1ccc(cc1Br)I 207a_100102657272_100010185650 [0,1,0,0,0,0|3,0,0]=4 2534 B11R1.81 CNCc1ccc(cc1Br)I 2230a_106832991635_100010146610 [0,1,0,0,0,0|3,0,0]=4 2535 B11R1.81 CNCc1ccc(cc1Br)I 26a_100102657272_100012361655 [0,1,0,0,0,0|3,0,0]=4 2536 B11R1.81 CNCc1ccc(cc1Br)I 34a_100102657272_100010146610 [0,1,0,0,0,0|3,0,0]=4 2537 B11R1.81 CNCc1ccc(cc1Br)I 7a_106832991635_100010146610 [0,1,0,0,0,0|3,0,0]=4 2538 B11R1.81 CNCc1ccc(cc1C)Br 207a_100102657272_100000687586 [0,1,0,0,0,0|3,0,0]=4 2539 B11R1.81 CNCc1ccc(cc1C)Br 2230a_106832991635_100000708836 [0,1,0,0,0,0|3,0,0]=4 2540 B11R1.81 CNCc1ccc(cc1C)Br 26a_100102657272_100000186361 [0,1,0,0,0,0|3,0,0]=4 2541 B11R1.81 CNCc1ccc(cc1C)Br 270004a_106832991635_100000687586 [0,1,0,0,0,0|3,0,0]=4 2542 B11R1.81 CNCc1ccc(cc1C)Br 34a_100000753881_200000210301 [0,1,0,0,0,0|3,0,0]=4 2543 B11R1.81 CNCc1ccc(cc1C)Br 34a_100102657272_100000708836 [0,1,0,0,0,0|3,0,0]=4 2544 B11R1.81 CNCc1ccc(cc1C)Br 7a_106832991635_100000708836 [0,1,0,0,0,0|3,0,0]=4 2545 B11R1.81 CNCc1ccc(cc1C)C 207a_100102657272_100000211342 [0,1,0,0,0,0|3,0,0]=4 2546 B11R1.81 CNCc1ccc(cc1C)C 2230a_106832991635_100011219618 [0,1,0,0,0,0|3,0,0]=4 2547 B11R1.81 CNCc1ccc(cc1C)C 270004a_106832991635_100000211342 [0,1,0,0,0,0|3,0,0]=4 2548 B11R1.81 CNCc1ccc(cc1C)C 34a_100000737523_200000210301 [0,1,0,0,0,0|3,0,0]=4 2549 B11R1.81 CNCc1ccc(cc1C)C 34a_100102657272_100011219618 [0,1,0,0,0,0|3,0,0]=4 2550 B11R1.81 CNCc1ccc(cc1C)C 7a_106832991635_100011219618 [0,1,0,0,0,0|3,0,0]=4 2551 B11R1.81 CNCc1ccc(cc1C)Cl 207a_100102657272_100000766358 [0,1,0,0,0,0|3,0,0]=4 2552 B11R1.81 CNCc1ccc(cc1C)Cl 2230a_106832991635_100012361307 [0,1,0,0,0,0|3,0,0]=4 2553 B11R1.81 CNCc1ccc(cc1C)Cl 270004a_106832991635_100000766358 [0,1,0,0,0,0|3,0,0]=4 2554 B11R1.81 CNCc1ccc(cc1C)Cl 34a_100102657272_100012361307 [0,1,0,0,0,0|3,0,0]=4 2555 B11R1.81 CNCc1ccc(cc1C)Cl 34a_103436540063_200000210301 [0,1,0,0,0,0|3,0,0]=4 2556 B11R1.81 CNCc1ccc(cc1C)Cl 7a_106832991635_100012361307 [0,1,0,0,0,0|3,0,0]=4 2557 B11R1.81 CNCc1ccc(cc1C)F 207a_100102657272_100000745986 [0,1,0,0,0,0|3,0,0]=4 2558 B11R1.81 CNCc1ccc(cc1C)F 2230a_106832991635_100000700533 [0,1,0,0,0,0|3,0,0]=4 2559 B11R1.81 CNCc1ccc(cc1C)F 270004a_106832991635_100000745986 [0,1,0,0,0,0|3,0,0]=4 2560 B11R1.81 CNCc1ccc(cc1C)F 34a_100102657272_100000700533 [0,1,0,0,0,0|3,0,0]=4 2561 B11R1.81 CNCc1ccc(cc1C)F 34a_100137329023_200000210301 [0,1,0,0,0,0|3,0,0]=4 2562 B11R1.81 CNCc1ccc(cc1C)F 7a_106832991635_100000700533 [0,1,0,0,0,0|3,0,0]=4 2563 B11R1.81 CNCc1ccc(cc1Cl)Br 207a_100102657272_100000764164 [0,1,0,0,0,0|3,0,0]=4 2564 B11R1.81 CNCc1ccc(cc1Cl)Br 2230a_106832991635_100011740631 [0,1,0,0,0,0|3,0,0]=4 2565 B11R1.81 CNCc1ccc(cc1Cl)Br 26a_100102657272_100000186472 [0,1,0,0,0,0|3,0,0]=4 2566 B11R1.81 CNCc1ccc(cc1Cl)Br 270004a_106832991635_100000764164 [0,1,0,0,0,0|3,0,0]=4 2567 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100020628970_200000210301 [0,1,0,0,0,0|3,0,0]=4 2568 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100102657272_100011740631 [0,1,0,0,0,0|3,0,0]=4 2569 B11R1.81 CNCc1ccc(cc1Cl)Br 7a_106832991635_100011740631 [0,1,0,0,0,0|3,0,0]=4 2570 B11R1.81 CNCc1ccc(cc1Cl)C 207a_100102657272_100011935181 [0,1,0,0,0,0|3,0,0]=4 2571 B11R1.81 CNCc1ccc(cc1Cl)C 2230a_106832991635_100012349684 [0,1,0,0,0,0|3,0,0]=4 2572 B11R1.81 CNCc1ccc(cc1Cl)C 26a_100102657272_100000749699 [0,1,0,0,0,0|3,0,0]=4 2573 B11R1.81 CNCc1ccc(cc1Cl)C 270004a_106832991635_100011935181 [0,1,0,0,0,0|3,0,0]=4 2574 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100011997539_200000210301 [0,1,0,0,0,0|3,0,0]=4 2575 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100102657272_100012349684 [0,1,0,0,0,0|3,0,0]=4 2576 B11R1.81 CNCc1ccc(cc1Cl)C 7a_106832991635_100012349684 [0,1,0,0,0,0|3,0,0]=4 2577 B11R1.81 CNCc1ccc(cc1Cl)Cl 207a_100102657272_100000188887 [0,1,0,0,0,0|3,0,0]=4 2578 B11R1.81 CNCc1ccc(cc1Cl)Cl 2230a_106832991635_100000188473 [0,1,0,0,0,0|3,0,0]=4 2579 B11R1.81 CNCc1ccc(cc1Cl)Cl 26a_100102657272_100015191787 [0,1,0,0,0,0|3,0,0]=4 2580 B11R1.81 CNCc1ccc(cc1Cl)Cl 270004a_106832991635_100000188887 [0,1,0,0,0,0|3,0,0]=4 2581 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100000174880_200000210301 [0,1,0,0,0,0|3,0,0]=4 2582 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100102657272_100000188473 [0,1,0,0,0,0|3,0,0]=4 2583 B11R1.81 CNCc1ccc(cc1Cl)Cl 7a_106832991635_100000188473 [0,1,0,0,0,0|3,0,0]=4 2584 B11R1.81 CNCc1ccc(cc1Cl)F 207a_100102657272_100000752949 [0,1,0,0,0,0|3,0,0]=4 2585 B11R1.81 CNCc1ccc(cc1Cl)F 2230a_106832991635_100011216360 [0,1,0,0,0,0|3,0,0]=4 2586 B11R1.81 CNCc1ccc(cc1Cl)F 26a_100102657272_100000212004 [0,1,0,0,0,0|3,0,0]=4 2587 B11R1.81 CNCc1ccc(cc1Cl)F 270004a_106832991635_100000752949 [0,1,0,0,0,0|3,0,0]=4 2588 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100000174946_200000210301 [0,1,0,0,0,0|3,0,0]=4 2589 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100102657272_100011216360 [0,1,0,0,0,0|3,0,0]=4 2590 B11R1.81 CNCc1ccc(cc1Cl)F 7a_106832991635_100011216360 [0,1,0,0,0,0|3,0,0]=4 2591 B11R1.81 CNCc1ccc(cc1Cl)I 207a_100102657272_100000727542 [0,1,0,0,0,0|3,0,0]=4 2592 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [0,1,0,0,0,0|2,0,0]=3 2593 B11R1.81 CNCc1ccc(cc1F)Br 207a_100102657272_100000211676 [0,1,0,0,0,0|3,0,0]=4 2594 B11R1.81 CNCc1ccc(cc1F)Br 2230a_106832991635_100000211606 [0,1,0,0,0,0|3,0,0]=4 2595 B11R1.81 CNCc1ccc(cc1F)Br 26a_100102657272_100000185481 [0,1,0,0,0,0|3,0,0]=4 2596 B11R1.81 CNCc1ccc(cc1F)Br 270004a_106832991635_100000211676 [0,1,0,0,0,0|3,0,0]=4 2597 B11R1.81 CNCc1ccc(cc1F)Br 34a_100000754580_200000210301 [0,1,0,0,0,0|3,0,0]=4 2598 B11R1.81 CNCc1ccc(cc1F)Br 34a_100102657272_100000211606 [0,1,0,0,0,0|3,0,0]=4 2599 B11R1.81 CNCc1ccc(cc1F)Br 7a_106832991635_100000211606 [0,1,0,0,0,0|3,0,0]=4 2600 B11R1.81 CNCc1ccc(cc1F)C 207a_100102657272_100011217368 [0,1,0,0,0,0|3,0,0]=4 2601 B11R1.81 CNCc1ccc(cc1F)C 2230a_106832991635_100011217900 [0,1,0,0,0,0|3,0,0]=4 2602 B11R1.81 CNCc1ccc(cc1F)C 270004a_106832991635_100011217368 [0,1,0,0,0,0|3,0,0]=4 2603 B11R1.81 CNCc1ccc(cc1F)C 34a_100102657272_100012002367 [0,1,0,0,0,0|3,0,0]=4 2604 B11R1.81 CNCc1ccc(cc1F)C 34a_100102887089_200000210301 [0,1,0,0,0,0|3,0,0]=4 2605 B11R1.81 CNCc1ccc(cc1F)C 7a_106832991635_100012002367 [0,1,0,0,0,0|3,0,0]=4 2606 B11R1.81 CNCc1ccc(cc1F)Cl 207a_100102657272_100000697372 [0,1,0,0,0,0|3,0,0]=4 2607 B11R1.81 CNCc1ccc(cc1F)Cl 2230a_106832991635_100000709361 [0,1,0,0,0,0|3,0,0]=4 2608 B11R1.81 CNCc1ccc(cc1F)Cl 270004a_106832991635_100000697372 [0,1,0,0,0,0|3,0,0]=4 2609 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100000708496_200000210301 [0,1,0,0,0,0|3,0,0]=4 2610 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100102657272_100000709361 [0,1,0,0,0,0|3,0,0]=4 2611 B11R1.81 CNCc1ccc(cc1F)Cl 7a_106832991635_100000709361 [0,1,0,0,0,0|3,0,0]=4 2612 B11R1.81 CNCc1ccc(cc1F)F 207a_100102657272_100000211964 [0,1,0,0,0,0|3,0,0]=4 2613 B11R1.81 CNCc1ccc(cc1F)F 2230a_106832991635_100000748237 [0,1,0,0,0,0|3,0,0]=4 2614 B11R1.81 CNCc1ccc(cc1F)F 270004a_106832991635_100000211964 [0,1,0,0,0,0|3,0,0]=4 2615 B11R1.81 CNCc1ccc(cc1F)F 34a_100000737868_200000210301 [0,1,0,0,0,0|3,0,0]=4 2616 B11R1.81 CNCc1ccc(cc1F)F 34a_100102657272_100000748237 [0,1,0,0,0,0|3,0,0]=4 2617 B11R1.81 CNCc1ccc(cc1F)F 7a_106832991635_100000748237 [0,1,0,0,0,0|3,0,0]=4 2618 B11R1.81 CNCc1ccc(cc1F)I 207a_100102657272_100000050965 [0,1,0,0,0,0|3,0,0]=4 2619 B11R1.81 CNCc1ccc(cc1F)I 2230a_106832991635_100010244991 [0,1,0,0,0,0|3,0,0]=4 2620 B11R1.81 CNCc1ccc(cc1F)I 34a_100102657272_100010244991 [0,1,0,0,0,0|3,0,0]=4 2621 B11R1.81 CNCc1ccc(cc1F)I 7a_106832991635_100010244991 [0,1,0,0,0,0|3,0,0]=4 2622 B11R1.81 CNCc1ccc(cc1I)Br 207a_100102657272_100010146562 [0,1,0,0,0,0|3,0,0]=4 2623 B11R1.81 CNCc1ccc(cc1I)Br 2230a_106832991635_100010146615 [0,1,0,0,0,0|3,0,0]=4 2624 B11R1.81 CNCc1ccc(cc1I)Br 26a_100102657272_100012355227 [0,1,0,0,0,0|3,0,0]=4 2625 B11R1.81 CNCc1ccc(cc1I)Br 270004a_106832991635_100010146562 [0,1,0,0,0,0|3,0,0]=4 2626 B11R1.81 CNCc1ccc(cc1I)Br 34a_100102657272_100010146615 [0,1,0,0,0,0|3,0,0]=4 2627 B11R1.81 CNCc1ccc(cc1I)Br 7a_106832991635_100010146615 [0,1,0,0,0,0|3,0,0]=4 2628 B11R1.81 CNCc1ccc(cc1I)C 207a_100102657272_100010150104 [0,1,0,0,0,0|3,0,0]=4 2629 B11R1.81 CNCc1ccc(cc1I)C 270004a_106832991635_100010150104 [0,1,0,0,0,0|3,0,0]=4 2630 B11R1.81 CNCc1ccc(cc1I)Cl 2230a_106832991635_100010254388 [0,1,0,0,0,0|3,0,0]=4 2631 B11R1.81 CNCc1ccc(cc1I)Cl 34a_100102657272_100010254388 [0,1,0,0,0,0|3,0,0]=4 2632 B11R1.81 CNCc1ccc(cc1I)Cl 7a_106832991635_100010254388 [0,1,0,0,0,0|3,0,0]=4 2633 B11R1.81 CNCc1ccc(cc1I)F 207a_100102657272_100010254405 [0,1,0,0,0,0|3,0,0]=4 2634 B11R1.81 CNCc1ccc(cc1I)F 2230a_106832991635_100012354799 [0,1,0,0,0,0|3,0,0]=4 2635 B11R1.81 CNCc1ccc(cc1I)F 34a_100102657272_100012354799 [0,1,0,0,0,0|3,0,0]=4 2636 B11R1.81 CNCc1ccc(cc1I)F 7a_106832991635_100012354799 [0,1,0,0,0,0|3,0,0]=4 2637 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [0,1,0,0,0,0|3,0,0]=4 2638 B11R1.81 COCc1ccc(cc1Br)Br 34a_100012357508_200000210301 [0,1,0,0,0,0|3,0,0]=4 2639 B11R1.81 COCc1ccc(cc1Br)Br 34a_100138415774_200012351560 [0,1,0,0,0,0|3,0,0]=4 2640 B11R1.81 COCc1ccc(cc1Br)Br 7a_100012357508_200000210301 [0,1,0,0,0,0|3,0,0]=4 2641 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100000707881_200000210301 [0,1,0,0,0,0|3,0,0]=4 2642 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100138415774_100000755608 [0,1,0,0,0,0|3,0,0]=4 2643 B11R1.81 COCc1ccc(cc1Br)Cl 7a_100000707881_200000210301 [0,1,0,0,0,0|3,0,0]=4 2644 B11R1.81 COCc1ccc(cc1Br)F 34a_100000744086_200000210301 [0,1,0,0,0,0|3,0,0]=4 2645 B11R1.81 COCc1ccc(cc1Br)F 34a_100138415774_100000243222 [0,1,0,0,0,0|3,0,0]=4 2646 B11R1.81 COCc1ccc(cc1Br)F 7a_100000744086_200000210301 [0,1,0,0,0,0|3,0,0]=4 2647 B11R1.81 COCc1ccc(cc1Br)I 34a_100138415774_100010146610 [0,1,0,0,0,0|3,0,0]=4 2648 B11R1.81 COCc1ccc(cc1Br)I 7a_100010240206_200000210301 [0,1,0,0,0,0|3,0,0]=4 2649 B11R1.81 COCc1ccc(cc1C)Br 34a_100000748258_200000210301 [0,1,0,0,0,0|3,0,0]=4 2650 B11R1.81 COCc1ccc(cc1C)Br 34a_100138415774_100000708836 [0,1,0,0,0,0|3,0,0]=4 2651 B11R1.81 COCc1ccc(cc1C)Br 7a_100000748258_200000210301 [0,1,0,0,0,0|3,0,0]=4 2652 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [0,1,0,0,0,0|3,0,0]=4 2653 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [0,1,0,0,0,0|3,0,0]=4 2654 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [0,1,0,0,0,0|3,0,0]=4 2655 B11R1.81 COCc1ccc(cc1C)Cl 34a_100000702939_200000210301 [0,1,0,0,0,0|3,0,0]=4 2656 B11R1.81 COCc1ccc(cc1C)Cl 34a_100138415774_100012361307 [0,1,0,0,0,0|3,0,0]=4 2657 B11R1.81 COCc1ccc(cc1C)Cl 7a_100000702939_200000210301 [0,1,0,0,0,0|3,0,0]=4 2658 B11R1.81 COCc1ccc(cc1C)F 34a_100000700136_200000210301 [0,1,0,0,0,0|3,0,0]=4 2659 B11R1.81 COCc1ccc(cc1C)F 34a_100138415774_100000700533 [0,1,0,0,0,0|3,0,0]=4 2660 B11R1.81 COCc1ccc(cc1C)F 7a_100000700136_200000210301 [0,1,0,0,0,0|3,0,0]=4 2661 B11R1.81 COCc1ccc(cc1C)N 34a_100000102464_200000210301 [0,1,0,0,0,0|3,0,0]=4 2662 B11R1.81 COCc1ccc(cc1C)N 7a_100000102464_200000210301 [0,1,0,0,0,0|3,0,0]=4 2663 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100000756401_200000210301 [0,1,0,0,0,0|3,0,0]=4 2664 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100138415774_100011740631 [0,1,0,0,0,0|3,0,0]=4 2665 B11R1.81 COCc1ccc(cc1Cl)Br 7a_100000756401_200000210301 [0,1,0,0,0,0|3,0,0]=4 2666 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [0,1,0,0,0,0|3,0,0]=4 2667 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [0,1,0,0,0,0|3,0,0]=4 2668 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [0,1,0,0,0,0|3,0,0]=4 2669 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100000215721_200000210301 [0,1,0,0,0,0|3,0,0]=4 2670 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100138415774_100000188473 [0,1,0,0,0,0|3,0,0]=4 2671 B11R1.81 COCc1ccc(cc1Cl)Cl 7a_100000215721_200000210301 [0,1,0,0,0,0|3,0,0]=4 2672 B11R1.81 COCc1ccc(cc1Cl)F 34a_100011219954_200000210301 [0,1,0,0,0,0|3,0,0]=4 2673 B11R1.81 COCc1ccc(cc1Cl)F 34a_100138415774_100011216360 [0,1,0,0,0,0|3,0,0]=4 2674 B11R1.81 COCc1ccc(cc1Cl)F 7a_100011219954_200000210301 [0,1,0,0,0,0|3,0,0]=4 2675 B11R1.81 COCc1ccc(cc1Cl)N 34a_100000689119_200000210301 [0,1,0,0,0,0|3,0,0]=4 2676 B11R1.81 COCc1ccc(cc1F)Br 34a_100011191541_200000210301 [0,1,0,0,0,0|3,0,0]=4 2677 B11R1.81 COCc1ccc(cc1F)Br 34a_100138415774_100000211606 [0,1,0,0,0,0|3,0,0]=4 2678 B11R1.81 COCc1ccc(cc1F)Br 7a_100011191541_200000210301 [0,1,0,0,0,0|3,0,0]=4 2679 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [0,1,0,0,0,0|3,0,0]=4 2680 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [0,1,0,0,0,0|3,0,0]=4 2681 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [0,1,0,0,0,0|3,0,0]=4 2682 B11R1.81 COCc1ccc(cc1F)Cl 34a_100011217562_200000210301 [0,1,0,0,0,0|3,0,0]=4 2683 B11R1.81 COCc1ccc(cc1F)Cl 34a_100138415774_100000709361 [0,1,0,0,0,0|3,0,0]=4 2684 B11R1.81 COCc1ccc(cc1F)Cl 7a_100011217562_200000210301 [0,1,0,0,0,0|3,0,0]=4 2685 B11R1.81 COCc1ccc(cc1F)F 34a_100011215441_200000210301 [0,1,0,0,0,0|3,0,0]=4 2686 B11R1.81 COCc1ccc(cc1F)F 34a_100138415774_100000748237 [0,1,0,0,0,0|3,0,0]=4 2687 B11R1.81 COCc1ccc(cc1F)F 7a_100011215441_200000210301 [0,1,0,0,0,0|3,0,0]=4 2688 B11R1.81 COCc1ccc(cc1F)I 34a_100138415774_100010244991 [0,1,0,0,0,0|3,0,0]=4 2689 B11R1.81 COCc1ccc(cc1F)I 34a_200010202041_200000210301 [0,1,0,0,0,0|3,0,0]=4 2690 B11R1.81 COCc1ccc(cc1F)I 7a_200010202041_200000210301 [0,1,0,0,0,0|3,0,0]=4 2691 B11R1.81 COCc1ccc(cc1I)Br 34a_100138415774_100010146615 [0,1,0,0,0,0|3,0,0]=4 2692 B11R1.81 COCc1ccc(cc1I)Br 7a_100010146605_200000210301 [0,1,0,0,0,0|3,0,0]=4 2693 B11R1.81 COCc1ccc(cc1I)Cl 34a_100000722340_200000210301 [0,1,0,0,0,0|3,0,0]=4 2694 B11R1.81 COCc1ccc(cc1I)Cl 34a_100138415774_100010254388 [0,1,0,0,0,0|3,0,0]=4 2695 B11R1.81 COCc1ccc(cc1I)Cl 7a_100000722340_200000210301 [0,1,0,0,0,0|3,0,0]=4 2696 B11R1.81 COCc1ccc(cc1I)F 34a_100011356828_200000210301 [0,1,0,0,0,0|3,0,0]=4 2697 B11R1.81 COCc1ccc(cc1I)F 34a_100138415774_100012354799 [0,1,0,0,0,0|3,0,0]=4 2698 B11R1.81 COCc1ccc(cc1I)F 7a_100011356828_200000210301 [0,1,0,0,0,0|3,0,0]=4 2699 B11R1.81 COCc1ccc(cc1N)Br 34a_100000718831_200000210301 [0,1,0,0,0,0|3,0,0]=4 2700 B11R1.81 COCc1ccc(cc1N)Br 7a_100000718831_200000210301 [0,1,0,0,0,0|3,0,0]=4 2701 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [0,1,0,0,0,0|3,0,0]=4 2702 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [0,1,0,0,0,0|3,0,0]=4 2703 B11R1.81 COCc1ccc(cc1N)Cl 34a_100000238622_200000210301 [0,1,0,0,0,0|3,0,0]=4 2704 B11R1.81 COCc1ccc(cc1N)Cl 7a_100000238622_200000210301 [0,1,0,0,0,0|3,0,0]=4 2705 B11R1.81 COCc1ccc(cc1N)F 34a_100011996588_200000210301 [0,1,0,0,0,0|3,0,0]=4 2706 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [0,1,0,0,0,0|2,0,0]=3 2707 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200000210301_200012351560 [0,1,0,0,0,0|3,0,0]=4 2708 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200012351560_200000210301 [0,1,0,0,0,0|3,0,0]=4 2709 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_100000755608_200000210301 [0,1,0,0,0,0|3,0,0]=4 2710 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_200000210301_100000755608 [0,1,0,0,0,0|3,0,0]=4 2711 B11R1.81 CSCc1ccc(cc1Br)F 62a_100000243222_200000210301 [0,1,0,0,0,0|3,0,0]=4 2712 B11R1.81 CSCc1ccc(cc1Br)F 62a_200000210301_100000243222 [0,1,0,0,0,0|3,0,0]=4 2713 B11R1.81 CSCc1ccc(cc1Br)I 62a_100010146610_200000210301 [0,1,0,0,0,0|3,0,0]=4 2714 B11R1.81 CSCc1ccc(cc1Br)I 62a_200000210301_100010146610 [0,1,0,0,0,0|3,0,0]=4 2715 B11R1.81 CSCc1ccc(cc1C)Br 62a_100000708836_200000210301 [0,1,0,0,0,0|3,0,0]=4 2716 B11R1.81 CSCc1ccc(cc1C)Br 62a_200000210301_100000708836 [0,1,0,0,0,0|3,0,0]=4 2717 B11R1.81 CSCc1ccc(cc1C)C 62a_100011219618_200000210301 [0,1,0,0,0,0|3,0,0]=4 2718 B11R1.81 CSCc1ccc(cc1C)C 62a_200000210301_100011219618 [0,1,0,0,0,0|3,0,0]=4 2719 B11R1.81 CSCc1ccc(cc1C)Cl 62a_100012361307_200000210301 [0,1,0,0,0,0|3,0,0]=4 2720 B11R1.81 CSCc1ccc(cc1C)Cl 62a_200000210301_100012361307 [0,1,0,0,0,0|3,0,0]=4 2721 B11R1.81 CSCc1ccc(cc1C)F 62a_100000700533_200000210301 [0,1,0,0,0,0|3,0,0]=4 2722 B11R1.81 CSCc1ccc(cc1C)F 62a_200000210301_100000700533 [0,1,0,0,0,0|3,0,0]=4 2723 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_100011740631_200000210301 [0,1,0,0,0,0|3,0,0]=4 2724 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_200000210301_100011740631 [0,1,0,0,0,0|3,0,0]=4 2725 B11R1.81 CSCc1ccc(cc1Cl)C 62a_100012349684_200000210301 [0,1,0,0,0,0|3,0,0]=4 2726 B11R1.81 CSCc1ccc(cc1Cl)C 62a_200000210301_100012349684 [0,1,0,0,0,0|3,0,0]=4 2727 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_100000188473_200000210301 [0,1,0,0,0,0|3,0,0]=4 2728 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_200000210301_100000188473 [0,1,0,0,0,0|3,0,0]=4 2729 B11R1.81 CSCc1ccc(cc1Cl)F 62a_100000187853_200000210301 [0,1,0,0,0,0|3,0,0]=4 2730 B11R1.81 CSCc1ccc(cc1Cl)F 62a_200000210301_100000187853 [0,1,0,0,0,0|3,0,0]=4 2731 B11R1.81 CSCc1ccc(cc1F)Br 62a_100000211606_200000210301 [0,1,0,0,0,0|3,0,0]=4 2732 B11R1.81 CSCc1ccc(cc1F)Br 62a_200000210301_100000211606 [0,1,0,0,0,0|3,0,0]=4 2733 B11R1.81 CSCc1ccc(cc1F)C 62a_100011217900_200000210301 [0,1,0,0,0,0|3,0,0]=4 2734 B11R1.81 CSCc1ccc(cc1F)C 62a_200000210301_100011217900 [0,1,0,0,0,0|3,0,0]=4 2735 B11R1.81 CSCc1ccc(cc1F)Cl 62a_100000709361_200000210301 [0,1,0,0,0,0|3,0,0]=4 2736 B11R1.81 CSCc1ccc(cc1F)Cl 62a_200000210301_100000709361 [0,1,0,0,0,0|3,0,0]=4 2737 B11R1.81 CSCc1ccc(cc1F)F 62a_100000748237_200000210301 [0,1,0,0,0,0|3,0,0]=4 2738 B11R1.81 CSCc1ccc(cc1F)F 62a_200000210301_100000748237 [0,1,0,0,0,0|3,0,0]=4 2739 B11R1.81 CSCc1ccc(cc1F)I 62a_100010244991_200000210301 [0,1,0,0,0,0|3,0,0]=4 2740 B11R1.81 CSCc1ccc(cc1F)I 62a_200000210301_100010244991 [0,1,0,0,0,0|3,0,0]=4 2741 B11R1.81 CSCc1ccc(cc1I)Br 62a_100010146615_200000210301 [0,1,0,0,0,0|3,0,0]=4 2742 B11R1.81 CSCc1ccc(cc1I)Br 62a_200000210301_100010146615 [0,1,0,0,0,0|3,0,0]=4 2743 B11R1.81 CSCc1ccc(cc1I)Cl 62a_100010254388_200000210301 [0,1,0,0,0,0|3,0,0]=4 2744 B11R1.81 CSCc1ccc(cc1I)Cl 62a_200000210301_100010254388 [0,1,0,0,0,0|3,0,0]=4 2745 B11R1.81 CSCc1ccc(cc1I)F 62a_100012354799_200000210301 [0,1,0,0,0,0|3,0,0]=4 2746 B11R1.81 CSCc1ccc(cc1I)F 62a_200000210301_100012354799 [0,1,0,0,0,0|3,0,0]=4 2747 B11R1.81 Cc1cc(=O)c(co1)OCF 34a_100000081520_100015361967 [0,1,0,0,0,0|3,0,0]=4 2748 B11R1.81 Cc1cc(c(cn1)OCF)Br 34a_100009843476_100015361967 [0,1,0,0,0,0|3,0,0]=4 2749 B11R1.81 Cc1cc(c(cn1)OCF)Br 7a_100009843476_100015361967 [0,1,0,0,0,0|3,0,0]=4 2750 B11R1.81 Cc1cc(c(cn1)OCF)C 34a_200000068632_100015361967 [0,1,0,0,0,0|3,0,0]=4 2751 B11R1.81 Cc1cc(c(cn1)OCF)C 7a_200000068632_100015361967 [0,1,0,0,0,0|3,0,0]=4 2752 B11R1.81 Cc1cc(ccc1CC#N)O 271570a_203496583355_100000697864 [0,1,0,0,0,0|2,0,1]=4 2753 B11R1.81 Cc1cc(ccc1CN[13CH3])Br 34a_100000753881_200025704644 [0,1,0,0,0,0|3,0,0]=4 2754 B11R1.81 Cc1cc(ccc1CN[13CH3])Cl 34a_103436540063_200025704644 [0,1,0,0,0,0|3,0,0]=4 2755 B11R1.81 Cc1cc(ccc1CN[13CH3])F 34a_100137329023_200025704644 [0,1,0,0,0,0|3,0,0]=4 2756 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 34a_100000748258_200025704644 [0,1,0,0,0,0|3,0,0]=4 2757 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 7a_100000748258_200025704644 [0,1,0,0,0,0|3,0,0]=4 2758 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 34a_100000702939_200025704644 [0,1,0,0,0,0|3,0,0]=4 2759 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 7a_100000702939_200025704644 [0,1,0,0,0,0|3,0,0]=4 2760 B11R1.81 Cc1cc(ccc1CO[13CH3])F 34a_100000700136_200025704644 [0,1,0,0,0,0|3,0,0]=4 2761 B11R1.81 Cc1cc(ccc1CO[13CH3])F 7a_100000700136_200025704644 [0,1,0,0,0,0|3,0,0]=4 2762 B11R1.81 Cc1cc(ccc1CO[13CH3])N 34a_100000102464_200025704644 [0,1,0,0,0,0|3,0,0]=4 2763 B11R1.81 Cc1cc(ccc1CO[13CH3])N 7a_100000102464_200025704644 [0,1,0,0,0,0|3,0,0]=4 2764 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_100000708836_200025704644 [0,1,0,0,0,0|3,0,0]=4 2765 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_200025704644_100000708836 [0,1,0,0,0,0|3,0,0]=4 2766 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_100012361307_200025704644 [0,1,0,0,0,0|3,0,0]=4 2767 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_200025704644_100012361307 [0,1,0,0,0,0|3,0,0]=4 2768 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_100000700533_200025704644 [0,1,0,0,0,0|3,0,0]=4 2769 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_200025704644_100000700533 [0,1,0,0,0,0|3,0,0]=4 2770 B11R1.81 Cc1cc(ccc1NCF)Br 34a_100000211769_100015361967 [0,1,0,0,0,0|3,0,0]=4 2771 B11R1.81 Cc1cc(ccc1NCF)Br 7a_100000211769_100015361967 [0,1,0,0,0,0|3,0,0]=4 2772 B11R1.81 Cc1cc(ccc1NCF)Cl 34a_100000210418_100015361967 [0,1,0,0,0,0|3,0,0]=4 2773 B11R1.81 Cc1cc(ccc1NCF)Cl 7a_100000210418_100015361967 [0,1,0,0,0,0|3,0,0]=4 2774 B11R1.81 Cc1cc(ccc1NCF)F 34a_100000211637_100015361967 [0,1,0,0,0,0|3,0,0]=4 2775 B11R1.81 Cc1cc(ccc1NCF)F 7a_100000211637_100015361967 [0,1,0,0,0,0|3,0,0]=4 2776 B11R1.81 Cc1cc(ccc1NCF)I 34a_100000184554_100015361967 [0,1,0,0,0,0|3,0,0]=4 2777 B11R1.81 Cc1cc(ccc1NCF)I 7a_100000184554_100015361967 [0,1,0,0,0,0|3,0,0]=4 2778 B11R1.81 Cc1cc(ccc1NCF)O 34a_100000756630_100015361967 [0,1,0,0,0,0|2,0,0]=3 2779 B11R1.81 Cc1cc(ccc1OCF)Br 34a_100000186361_100015361967 [0,1,0,0,0,0|2,0,0]=3 2780 B11R1.81 Cc1cc(ccc1OCF)Br 7a_100000186361_100015361967 [0,1,0,0,0,0|2,0,0]=3 2781 B11R1.81 Cc1cc(ccc1OCF)Cl 34a_100000211091_100015361967 [0,1,0,0,0,0|2,0,0]=3 2782 B11R1.81 Cc1cc(ccc1OCF)Cl 7a_100000211091_100015361967 [0,1,0,0,0,0|2,0,0]=3 2783 B11R1.81 Cc1cc(ccc1OCF)F 34a_100000764316_100015361967 [0,1,0,0,0,0|2,0,0]=3 2784 B11R1.81 Cc1cc(ccc1OCF)F 7a_100000764316_100015361967 [0,1,0,0,0,0|2,0,0]=3 2785 B11R1.81 Cc1cc(ccc1OCF)I 34a_100011218673_100015361967 [0,1,0,0,0,0|2,0,0]=3 2786 B11R1.81 Cc1cc(ccc1OCF)I 7a_100011218673_100015361967 [0,1,0,0,0,0|2,0,0]=3 2787 B11R1.81 Cc1cc(ccc1OCF)N 34a_100011218179_100015361967 [0,1,0,0,0,0|2,0,0]=3 2788 B11R1.81 Cc1cc(ccc1OCF)N 7a_100011218179_100015361967 [0,1,0,0,0,0|2,0,0]=3 2789 B11R1.81 Cc1cc(ccc1SCF)Br 62a_100000701812_100015361967 [0,1,0,0,0,0|2,1,0]=4 2790 B11R1.81 Cc1cc(ccc1SCF)Br 62a_100015361967_100000701812 [0,1,0,0,0,0|2,1,0]=4 2791 B11R1.81 Cc1cc(ccc1SCF)Cl 62a_100011219607_100015361967 [0,1,0,0,0,0|2,1,0]=4 2792 B11R1.81 Cc1cc(ccc1SCF)Cl 62a_100015361967_100011219607 [0,1,0,0,0,0|2,1,0]=4 2793 B11R1.81 Cc1cc(ccc1SCF)F 62a_100011205405_100015361967 [0,1,0,0,0,0|2,1,0]=4 2794 B11R1.81 Cc1cc(ccc1SCF)F 62a_100015361967_100011205405 [0,1,0,0,0,0|2,1,0]=4 2795 B11R1.81 Cc1cc(ccc1SCF)N 62a_100000210723_100015361967 [0,1,0,0,0,0|2,1,0]=4 2796 B11R1.81 Cc1cc(ccc1SCF)N 62a_100015361967_100000210723 [0,1,0,0,0,0|2,1,0]=4 2797 B11R1.81 Cc1cc(ccc1SCF)O 62a_100015361967_100000690111 [0,1,0,0,0,0|1,1,0]=3 2798 B11R1.81 Cc1cc(cnc1OCF)Br 34a_100000685391_100015361967 [0,1,0,0,0,0|3,0,0]=4 2799 B11R1.81 Cc1cc(cnc1SCF)O 62a_100012000486_100015361967 [0,1,0,0,0,0|2,1,0]=4 2800 B11R1.81 Cc1cc(cnc1SCF)O 62a_100015361967_100012000486 [0,1,0,0,0,0|2,1,0]=4 2801 B11R1.81 Cc1cc(ncc1OCF)Cl 34a_100000692680_100015361967 [0,1,0,0,0,0|3,0,0]=4 2802 B11R1.81 Cc1cc(ncc1OCF)Cl 7a_100000692680_100015361967 [0,1,0,0,0,0|3,0,0]=4 2803 B11R1.81 Cc1cc(ncc1OCF)F 34a_100009856773_100015361967 [0,1,0,0,0,0|3,0,0]=4 2804 B11R1.81 Cc1cc(ncc1OCF)F 7a_100009856773_100015361967 [0,1,0,0,0,0|3,0,0]=4 2805 B11R1.81 Cc1cc(ncc1SCF)O 62a_100000766222_100015361967 [0,1,0,0,0,0|2,1,0]=4 2806 B11R1.81 Cc1cc(ncc1SCF)O 62a_100015361967_100000766222 [0,1,0,0,0,0|2,1,0]=4 2807 B11R1.81 Cc1ccc(c(c1)Br)NCF 34a_100000210942_100015361967 [0,1,0,0,0,0|3,0,0]=4 2808 B11R1.81 Cc1ccc(c(c1)Br)OCF 34a_100000210800_100015361967 [0,1,0,0,0,0|2,0,0]=3 2809 B11R1.81 Cc1ccc(c(c1)Br)OCF 7a_100000210800_100015361967 [0,1,0,0,0,0|2,0,0]=3 2810 B11R1.81 Cc1ccc(c(c1)Br)SCF 62a_100009813563_100015361967 [0,1,0,0,0,0|2,1,0]=4 2811 B11R1.81 Cc1ccc(c(c1)Br)SCF 62a_100015361967_100009813563 [0,1,0,0,0,0|2,1,0]=4 2812 B11R1.81 Cc1ccc(c(c1)C)CN[13CH3] 34a_100000737523_200025704644 [0,1,0,0,0,0|3,0,0]=4 2813 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [0,1,0,0,0,0|3,0,0]=4 2814 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [0,1,0,0,0,0|3,0,0]=4 2815 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_100011219618_200025704644 [0,1,0,0,0,0|3,0,0]=4 2816 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_200025704644_100011219618 [0,1,0,0,0,0|3,0,0]=4 2817 B11R1.81 Cc1ccc(c(c1)C)NCF 34a_100000736561_100015361967 [0,1,0,0,0,0|3,0,0]=4 2818 B11R1.81 Cc1ccc(c(c1)C)NCF 7a_100000736561_100015361967 [0,1,0,0,0,0|3,0,0]=4 2819 B11R1.81 Cc1ccc(c(c1)C)OCF 34a_100000211776_100015361967 [0,1,0,0,0,0|2,0,0]=3 2820 B11R1.81 Cc1ccc(c(c1)C)OCF 7a_100000211776_100015361967 [0,1,0,0,0,0|2,0,0]=3 2821 B11R1.81 Cc1ccc(c(c1)C)SCF 62a_100011217332_100015361967 [0,1,0,0,0,0|2,1,0]=4 2822 B11R1.81 Cc1ccc(c(c1)C)SCF 62a_100015361967_100011217332 [0,1,0,0,0,0|2,1,0]=4 2823 B11R1.81 Cc1ccc(c(c1)Cl)CN[13CH3] 34a_100011997539_200025704644 [0,1,0,0,0,0|3,0,0]=4 2824 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [0,1,0,0,0,0|3,0,0]=4 2825 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [0,1,0,0,0,0|3,0,0]=4 2826 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_100012349684_200025704644 [0,1,0,0,0,0|3,0,0]=4 2827 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_100012349684 [0,1,0,0,0,0|3,0,0]=4 2828 B11R1.81 Cc1ccc(c(c1)Cl)NCF 34a_100000210522_100015361967 [0,1,0,0,0,0|3,0,0]=4 2829 B11R1.81 Cc1ccc(c(c1)Cl)OCF 34a_100000749699_100015361967 [0,1,0,0,0,0|2,0,0]=3 2830 B11R1.81 Cc1ccc(c(c1)Cl)OCF 7a_100000749699_100015361967 [0,1,0,0,0,0|2,0,0]=3 2831 B11R1.81 Cc1ccc(c(c1)Cl)SCF 62a_100011263221_100015361967 [0,1,0,0,0,0|2,1,0]=4 2832 B11R1.81 Cc1ccc(c(c1)Cl)SCF 62a_100015361967_100011263221 [0,1,0,0,0,0|2,1,0]=4 2833 B11R1.81 Cc1ccc(c(c1)F)CN[13CH3] 34a_100102887089_200025704644 [0,1,0,0,0,0|3,0,0]=4 2834 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [0,1,0,0,0,0|3,0,0]=4 2835 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [0,1,0,0,0,0|3,0,0]=4 2836 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_100011217900_200025704644 [0,1,0,0,0,0|3,0,0]=4 2837 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011217900 [0,1,0,0,0,0|3,0,0]=4 2838 B11R1.81 Cc1ccc(c(c1)F)NCF 34a_100000211023_100015361967 [0,1,0,0,0,0|3,0,0]=4 2839 B11R1.81 Cc1ccc(c(c1)F)OCF 34a_100011216688_100015361967 [0,1,0,0,0,0|2,0,0]=3 2840 B11R1.81 Cc1ccc(c(c1)F)OCF 7a_100011216688_100015361967 [0,1,0,0,0,0|2,0,0]=3 2841 B11R1.81 Cc1ccc(c(c1)F)SCF 62a_100011216119_100015361967 [0,1,0,0,0,0|2,1,0]=4 2842 B11R1.81 Cc1ccc(c(c1)F)SCF 62a_100015361967_100011216119 [0,1,0,0,0,0|2,1,0]=4 2843 B11R1.81 Cc1ccc(c(c1)I)NCF 34a_100011356834_100015361967 [0,1,0,0,0,0|3,0,0]=4 2844 B11R1.81 Cc1ccc(c(c1)I)OCF 34a_100000765521_100015361967 [0,1,0,0,0,0|2,0,0]=3 2845 B11R1.81 Cc1ccc(c(c1)I)OCF 7a_100000765521_100015361967 [0,1,0,0,0,0|2,0,0]=3 2846 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [0,1,0,0,0,0|3,0,0]=4 2847 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [0,1,0,0,0,0|3,0,0]=4 2848 B11R1.81 Cc1ccc(c(c1)N)OCF 34a_100011215204_100015361967 [0,1,0,0,0,0|2,0,0]=3 2849 B11R1.81 Cc1ccc(c(c1)N)OCF 7a_100011215204_100015361967 [0,1,0,0,0,0|2,0,0]=3 2850 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100011216686_100015361967 [0,1,0,0,0,0|2,1,0]=4 2851 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100015361967_100011216686 [0,1,0,0,0,0|2,1,0]=4 2852 B11R1.81 Cc1ccc(c(c1)O)NCF 34a_100000211527_100015361967 [0,1,0,0,0,0|3,0,0]=4 2853 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100012002257_100015361967 [0,1,0,0,0,0|2,1,0]=4 2854 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100015361967_100012002257 [0,1,0,0,0,0|2,1,0]=4 2855 B11R1.81 Cc1ccc(c(n1)Br)OCF 34a_100000702858_100015361967 [0,1,0,0,0,0|3,0,0]=4 2856 B11R1.81 Cc1ccc(c(n1)Br)OCF 7a_100000702858_100015361967 [0,1,0,0,0,0|3,0,0]=4 2857 B11R1.81 Cc1ccc(c(n1)C)OCF 34a_100011218912_100015361967 [0,1,0,0,0,0|3,0,0]=4 2858 B11R1.81 Cc1ccc(c(n1)C)OCF 7a_100011218912_100015361967 [0,1,0,0,0,0|3,0,0]=4 2859 B11R1.81 Cc1ccc(c(n1)Cl)OCF 34a_100000086286_100015361967 [0,1,0,0,0,0|3,0,0]=4 2860 B11R1.81 Cc1ccc(c(n1)Cl)OCF 7a_100000086286_100015361967 [0,1,0,0,0,0|3,0,0]=4 2861 B11R1.81 Cc1ccc(c(n1)F)OCF 34a_100000079963_100015361967 [0,1,0,0,0,0|3,0,0]=4 2862 B11R1.81 Cc1ccc(c(n1)F)OCF 7a_100000079963_100015361967 [0,1,0,0,0,0|3,0,0]=4 2863 B11R1.81 Cc1ccc(c(n1)I)OCF 34a_100000023897_100015361967 [0,1,0,0,0,0|3,0,0]=4 2864 B11R1.81 Cc1ccc(c(n1)I)OCF 7a_100000023897_100015361967 [0,1,0,0,0,0|3,0,0]=4 2865 B11R1.81 Cc1ccc(c(n1)N)OCF 34a_100000694039_100015361967 [0,1,0,0,0,0|3,0,0]=4 2866 B11R1.81 Cc1ccc(c(n1)N)OCF 7a_100000694039_100015361967 [0,1,0,0,0,0|3,0,0]=4 2867 B11R1.81 Cc1cnc(c(c1)Br)OCF 34a_100000719714_100015361967 [0,1,0,0,0,0|3,0,0]=4 2868 B11R1.81 Cc1cnc(c(c1)N)OCF 34a_100012000488_100015361967 [0,1,0,0,0,0|3,0,0]=4 2869 B11R1.81 Cc1nc(ccc1OCF)Br 34a_100012002022_100015361967 [0,1,0,0,0,0|3,0,0]=4 2870 B11R1.81 Cc1nc(ccc1OCF)Br 7a_100012002022_100015361967 [0,1,0,0,0,0|3,0,0]=4 2871 B11R1.81 Cc1nc(ccc1OCF)Cl 34a_100012184626_100015361967 [0,1,0,0,0,0|3,0,0]=4 2872 B11R1.81 Cc1nc(ccc1OCF)Cl 7a_100012184626_100015361967 [0,1,0,0,0,0|3,0,0]=4 2873 B11R1.81 Cc1nc(ccc1OCF)F 34a_100009881036_100015361967 [0,1,0,0,0,0|3,0,0]=4 2874 B11R1.81 Cc1nc(ccc1OCF)F 7a_100009881036_100015361967 [0,1,0,0,0,0|3,0,0]=4 2875 B11R1.81 Cc1nc(ccc1OCF)I 34a_100010233687_100015361967 [0,1,0,0,0,0|3,0,0]=4 2876 B11R1.81 Cc1nc(ccc1OCF)I 7a_100010233687_100015361967 [0,1,0,0,0,0|3,0,0]=4 2877 B11R1.81 Cc1nc(ccc1SCF)O 62a_100000691680_100015361967 [0,1,0,0,0,0|2,1,0]=4 2878 B11R1.81 Cc1nc(ccc1SCF)O 62a_100015361967_100000691680 [0,1,0,0,0,0|2,1,0]=4 2879 B11R1.81 FCNc1ccc(cc1Br)Br 34a_100000211012_100015361967 [0,1,0,0,0,0|3,0,0]=4 2880 B11R1.81 FCNc1ccc(cc1Br)Cl 34a_100000752454_100015361967 [0,1,0,0,0,0|3,0,0]=4 2881 B11R1.81 FCNc1ccc(cc1Br)F 34a_100000738039_100015361967 [0,1,0,0,0,0|3,0,0]=4 2882 B11R1.81 FCNc1ccc(cc1Cl)Br 34a_100000211467_100015361967 [0,1,0,0,0,0|3,0,0]=4 2883 B11R1.81 FCNc1ccc(cc1Cl)Cl 34a_100000185861_100015361967 [0,1,0,0,0,0|3,0,0]=4 2884 B11R1.81 FCNc1ccc(cc1Cl)F 34a_100000212003_100015361967 [0,1,0,0,0,0|3,0,0]=4 2885 B11R1.81 FCNc1ccc(cc1Cl)I 34a_100011218065_100015361967 [0,1,0,0,0,0|3,0,0]=4 2886 B11R1.81 FCNc1ccc(cc1F)Br 34a_100000210722_100015361967 [0,1,0,0,0,0|3,0,0]=4 2887 B11R1.81 FCNc1ccc(cc1F)Cl 34a_100000211020_100015361967 [0,1,0,0,0,0|3,0,0]=4 2888 B11R1.81 FCNc1ccc(cc1F)F 34a_100000210720_100015361967 [0,1,0,0,0,0|3,0,0]=4 2889 B11R1.81 FCNc1ccc(cc1F)I 34a_100011215594_100015361967 [0,1,0,0,0,0|3,0,0]=4 2890 B11R1.81 FCNc1ccc(cc1I)Br 34a_100000187925_100015361967 [0,1,0,0,0,0|3,0,0]=4 2891 B11R1.81 FCNc1ccc(cc1I)Cl 34a_100000761889_100015361967 [0,1,0,0,0,0|3,0,0]=4 2892 B11R1.81 FCNc1ccc(cc1I)F 34a_100000760547_100015361967 [0,1,0,0,0,0|3,0,0]=4 2893 B11R1.81 FCOc1ccc(cc1Br)Br 34a_100000188717_100015361967 [0,1,0,0,0,0|2,0,0]=3 2894 B11R1.81 FCOc1ccc(cc1Br)Br 7a_100000188717_100015361967 [0,1,0,0,0,0|2,0,0]=3 2895 B11R1.81 FCOc1ccc(cc1Br)Cl 34a_100000211998_100015361967 [0,1,0,0,0,0|2,0,0]=3 2896 B11R1.81 FCOc1ccc(cc1Br)Cl 7a_100000211998_100015361967 [0,1,0,0,0,0|2,0,0]=3 2897 B11R1.81 FCOc1ccc(cc1Br)F 34a_100000211999_100015361967 [0,1,0,0,0,0|2,0,0]=3 2898 B11R1.81 FCOc1ccc(cc1Br)F 7a_100000211999_100015361967 [0,1,0,0,0,0|2,0,0]=3 2899 B11R1.81 FCOc1ccc(cc1Br)I 34a_100012361655_100015361967 [0,1,0,0,0,0|2,0,0]=3 2900 B11R1.81 FCOc1ccc(cc1Br)I 7a_100012361655_100015361967 [0,1,0,0,0,0|2,0,0]=3 2901 B11R1.81 FCOc1ccc(cc1Cl)Br 34a_100000186472_100015361967 [0,1,0,0,0,0|2,0,0]=3 2902 B11R1.81 FCOc1ccc(cc1Cl)Br 7a_100000186472_100015361967 [0,1,0,0,0,0|2,0,0]=3 2903 B11R1.81 FCOc1ccc(cc1Cl)Cl 34a_100015191787_100015361967 [0,1,0,0,0,0|2,0,0]=3 2904 B11R1.81 FCOc1ccc(cc1Cl)Cl 7a_100015191787_100015361967 [0,1,0,0,0,0|2,0,0]=3 2905 B11R1.81 FCOc1ccc(cc1Cl)F 34a_100000212004_100015361967 [0,1,0,0,0,0|2,0,0]=3 2906 B11R1.81 FCOc1ccc(cc1Cl)F 7a_100000212004_100015361967 [0,1,0,0,0,0|2,0,0]=3 2907 B11R1.81 FCOc1ccc(cc1Cl)I 34a_100012360047_100015361967 [0,1,0,0,0,0|2,0,0]=3 2908 B11R1.81 FCOc1ccc(cc1Cl)I 7a_100012360047_100015361967 [0,1,0,0,0,0|2,0,0]=3 2909 B11R1.81 FCOc1ccc(cc1F)Br 34a_100000185481_100015361967 [0,1,0,0,0,0|2,0,0]=3 2910 B11R1.81 FCOc1ccc(cc1F)Br 7a_100000185481_100015361967 [0,1,0,0,0,0|2,0,0]=3 2911 B11R1.81 FCOc1ccc(cc1F)Cl 34a_100000230166_100015361967 [0,1,0,0,0,0|2,0,0]=3 2912 B11R1.81 FCOc1ccc(cc1F)Cl 7a_100000230166_100015361967 [0,1,0,0,0,0|2,0,0]=3 2913 B11R1.81 FCOc1ccc(cc1F)F 34a_100000230127_100015361967 [0,1,0,0,0,0|2,0,0]=3 2914 B11R1.81 FCOc1ccc(cc1F)F 7a_100000230127_100015361967 [0,1,0,0,0,0|2,0,0]=3 2915 B11R1.81 FCOc1ccc(cc1F)I 34a_100011356965_100015361967 [0,1,0,0,0,0|2,0,0]=3 2916 B11R1.81 FCOc1ccc(cc1F)I 7a_100011356965_100015361967 [0,1,0,0,0,0|2,0,0]=3 2917 B11R1.81 FCOc1ccc(cc1I)Br 34a_100012355227_100015361967 [0,1,0,0,0,0|2,0,0]=3 2918 B11R1.81 FCOc1ccc(cc1I)Br 7a_100012355227_100015361967 [0,1,0,0,0,0|2,0,0]=3 2919 B11R1.81 FCOc1ccc(cc1I)Cl 34a_100011356953_100015361967 [0,1,0,0,0,0|2,0,0]=3 2920 B11R1.81 FCOc1ccc(cc1I)Cl 7a_100011356953_100015361967 [0,1,0,0,0,0|2,0,0]=3 2921 B11R1.81 FCOc1ccc(cc1I)F 34a_100012355409_100015361967 [0,1,0,0,0,0|2,0,0]=3 2922 B11R1.81 FCOc1ccc(cc1I)F 7a_100012355409_100015361967 [0,1,0,0,0,0|2,0,0]=3 2923 B11R1.81 FCOc1ccc(cc1I)I 7a_100010001573_100015361967 [0,1,0,0,0,0|2,0,0]=3 2924 B11R1.81 FCOc1ccc(nc1Br)Br 34a_100009999766_100015361967 [0,1,0,0,0,0|3,0,0]=4 2925 B11R1.81 FCOc1ccc(nc1Br)Br 7a_100009999766_100015361967 [0,1,0,0,0,0|3,0,0]=4 2926 B11R1.81 FCOc1ccc(nc1Br)Cl 34a_100010219353_100015361967 [0,1,0,0,0,0|3,0,0]=4 2927 B11R1.81 FCOc1ccc(nc1Br)Cl 7a_100010219353_100015361967 [0,1,0,0,0,0|3,0,0]=4 2928 B11R1.81 FCOc1ccc(nc1Br)F 34a_100009887730_100015361967 [0,1,0,0,0,0|3,0,0]=4 2929 B11R1.81 FCOc1ccc(nc1Br)F 7a_100009887730_100015361967 [0,1,0,0,0,0|3,0,0]=4 2930 B11R1.81 FCOc1ccc(nc1Br)I 34a_100000725334_100015361967 [0,1,0,0,0,0|3,0,0]=4 2931 B11R1.81 FCOc1ccc(nc1Br)I 7a_100000725334_100015361967 [0,1,0,0,0,0|3,0,0]=4 2932 B11R1.81 FCOc1ccc(nc1Cl)Br 34a_100010246206_100015361967 [0,1,0,0,0,0|3,0,0]=4 2933 B11R1.81 FCOc1ccc(nc1Cl)Br 7a_100010246206_100015361967 [0,1,0,0,0,0|3,0,0]=4 2934 B11R1.81 FCOc1ccc(nc1Cl)Cl 34a_100000101165_100015361967 [0,1,0,0,0,0|3,0,0]=4 2935 B11R1.81 FCOc1ccc(nc1Cl)Cl 7a_100000101165_100015361967 [0,1,0,0,0,0|3,0,0]=4 2936 B11R1.81 FCOc1ccc(nc1Cl)I 34a_100000721234_100015361967 [0,1,0,0,0,0|3,0,0]=4 2937 B11R1.81 FCOc1ccc(nc1Cl)I 7a_100000721234_100015361967 [0,1,0,0,0,0|3,0,0]=4 2938 B11R1.81 FCOc1ccc(nc1F)Br 34a_100009819667_100015361967 [0,1,0,0,0,0|3,0,0]=4 2939 B11R1.81 FCOc1ccc(nc1F)Br 7a_100009819667_100015361967 [0,1,0,0,0,0|3,0,0]=4 2940 B11R1.81 FCOc1ccc(nc1F)Cl 34a_100009880201_100015361967 [0,1,0,0,0,0|3,0,0]=4 2941 B11R1.81 FCOc1ccc(nc1F)Cl 7a_100009880201_100015361967 [0,1,0,0,0,0|3,0,0]=4 2942 B11R1.81 FCOc1ccc(nc1F)F 34a_100000101184_100015361967 [0,1,0,0,0,0|3,0,0]=4 2943 B11R1.81 FCOc1ccc(nc1F)F 7a_100000101184_100015361967 [0,1,0,0,0,0|3,0,0]=4 2944 B11R1.81 FCOc1ccc(nc1I)Br 34a_100010253912_100015361967 [0,1,0,0,0,0|3,0,0]=4 2945 B11R1.81 FCOc1ccc(nc1I)Br 7a_100010253912_100015361967 [0,1,0,0,0,0|3,0,0]=4 2946 B11R1.81 FCOc1ccc(nc1I)Cl 34a_100000696390_100015361967 [0,1,0,0,0,0|3,0,0]=4 2947 B11R1.81 FCOc1ccc(nc1I)Cl 7a_100000696390_100015361967 [0,1,0,0,0,0|3,0,0]=4 2948 B11R1.81 FCOc1ccc(nc1I)F 34a_100010382442_100015361967 [0,1,0,0,0,0|3,0,0]=4 2949 B11R1.81 FCOc1ccc(nc1I)F 7a_100010382442_100015361967 [0,1,0,0,0,0|3,0,0]=4 2950 B11R1.81 FCOc1cnc(cc1Cl)Cl 34a_100009868576_100015361967 [0,1,0,0,0,0|3,0,0]=4 2951 B11R1.81 FCOc1cnc(cc1Cl)Cl 7a_100009868576_100015361967 [0,1,0,0,0,0|3,0,0]=4 2952 B11R1.81 FCOc1cnc(cc1F)F 34a_100009885687_100015361967 [0,1,0,0,0,0|3,0,0]=4 2953 B11R1.81 FCOc1cnc(cc1F)F 7a_100009885687_100015361967 [0,1,0,0,0,0|3,0,0]=4 2954 B11R1.81 FCOc1cnc(cc1I)Cl 34a_100000698892_100015361967 [0,1,0,0,0,0|3,0,0]=4 2955 B11R1.81 FCOc1cnc(cc1I)Cl 7a_100000698892_100015361967 [0,1,0,0,0,0|3,0,0]=4 2956 B11R1.81 FCOc1ncc(cc1Br)Br 34a_100000701035_100015361967 [0,1,0,0,0,0|3,0,0]=4 2957 B11R1.81 FCOc1ncc(cc1Cl)Br 34a_100012339560_100015361967 [0,1,0,0,0,0|3,0,0]=4 2958 B11R1.81 FCOc1ncc(cc1Cl)F 34a_100009847679_100015361967 [0,1,0,0,0,0|3,0,0]=4 2959 B11R1.81 FCOc1ncc(cc1F)Cl 34a_100011998252_100015361967 [0,1,0,0,0,0|3,0,0]=4 2960 B11R1.81 FCOc1ncc(cc1F)F 34a_100012025737_100015361967 [0,1,0,0,0,0|3,0,0]=4 2961 B11R1.81 FCSc1ccc(cc1Br)Br 62a_100011484698_100015361967 [0,1,0,0,0,0|2,1,0]=4 2962 B11R1.81 FCSc1ccc(cc1Br)Br 62a_100015361967_100011484698 [0,1,0,0,0,0|2,1,0]=4 2963 B11R1.81 FCSc1ccc(cc1Br)Cl 62a_100011219703_100015361967 [0,1,0,0,0,0|2,1,0]=4 2964 B11R1.81 FCSc1ccc(cc1Br)Cl 62a_100015361967_100011219703 [0,1,0,0,0,0|2,1,0]=4 2965 B11R1.81 FCSc1ccc(cc1Br)F 62a_100011217111_100015361967 [0,1,0,0,0,0|2,1,0]=4 2966 B11R1.81 FCSc1ccc(cc1Br)F 62a_100015361967_100011217111 [0,1,0,0,0,0|2,1,0]=4 2967 B11R1.81 FCSc1ccc(cc1Cl)Br 62a_100011216062_100015361967 [0,1,0,0,0,0|2,1,0]=4 2968 B11R1.81 FCSc1ccc(cc1Cl)Br 62a_100015361967_100011216062 [0,1,0,0,0,0|2,1,0]=4 2969 B11R1.81 FCSc1ccc(cc1Cl)Cl 62a_100000699841_100015361967 [0,1,0,0,0,0|2,1,0]=4 2970 B11R1.81 FCSc1ccc(cc1Cl)Cl 62a_100015361967_100000699841 [0,1,0,0,0,0|2,1,0]=4 2971 B11R1.81 FCSc1ccc(cc1Cl)F 62a_100000733362_100015361967 [0,1,0,0,0,0|2,1,0]=4 2972 B11R1.81 FCSc1ccc(cc1Cl)F 62a_100015361967_100000733362 [0,1,0,0,0,0|2,1,0]=4 2973 B11R1.81 FCSc1ccc(cc1F)Br 62a_100009814013_100015361967 [0,1,0,0,0,0|2,1,0]=4 2974 B11R1.81 FCSc1ccc(cc1F)Br 62a_100015361967_100009814013 [0,1,0,0,0,0|2,1,0]=4 2975 B11R1.81 FCSc1ccc(cc1F)Cl 62a_100011216042_100015361967 [0,1,0,0,0,0|2,1,0]=4 2976 B11R1.81 FCSc1ccc(cc1F)Cl 62a_100015361967_100011216042 [0,1,0,0,0,0|2,1,0]=4 2977 B11R1.81 FCSc1ccc(cc1F)F 62a_100000750030_100015361967 [0,1,0,0,0,0|2,1,0]=4 2978 B11R1.81 FCSc1ccc(cc1F)F 62a_100015361967_100000750030 [0,1,0,0,0,0|2,1,0]=4 2979 B11R1.81 N#CCc1ccc(cc1F)O 271570a_203496583355_100011295474 [0,1,0,0,0,0|2,0,1]=4 2980 B11R1.81 N#CSc1ccc(cc1F)O 271570a_203496583355_100025703542 [0,1,0,0,0,0|1,1,1]=4 2981 B11R1.81 Nc1cc(ccc1OCF)Br 34a_100000752626_100015361967 [0,1,0,0,0,0|2,0,0]=3 2982 B11R1.81 Nc1cc(ccc1OCF)Br 7a_100000752626_100015361967 [0,1,0,0,0,0|2,0,0]=3 2983 B11R1.81 Nc1cc(ccc1OCF)Cl 34a_100000210500_100015361967 [0,1,0,0,0,0|2,0,0]=3 2984 B11R1.81 Nc1cc(ccc1OCF)Cl 7a_100000210500_100015361967 [0,1,0,0,0,0|2,0,0]=3 2985 B11R1.81 Nc1cc(ccc1OCF)F 34a_100000759472_100015361967 [0,1,0,0,0,0|2,0,0]=3 2986 B11R1.81 Nc1cc(ccc1OCF)F 7a_100000759472_100015361967 [0,1,0,0,0,0|2,0,0]=3 2987 B11R1.81 Nc1cc(ccc1OCF)I 34a_100000753495_100015361967 [0,1,0,0,0,0|2,0,0]=3 2988 B11R1.81 Nc1cc(ccc1OCF)I 7a_100000753495_100015361967 [0,1,0,0,0,0|2,0,0]=3 2989 B11R1.81 Nc1cc(ccc1SCF)Br 62a_100000743836_100015361967 [0,1,0,0,0,0|2,1,0]=4 2990 B11R1.81 Nc1cc(ccc1SCF)Br 62a_100015361967_100000743836 [0,1,0,0,0,0|2,1,0]=4 2991 B11R1.81 Nc1cc(ccc1SCF)Cl 62a_100000761886_100015361967 [0,1,0,0,0,0|2,1,0]=4 2992 B11R1.81 Nc1cc(ccc1SCF)Cl 62a_100015361967_100000761886 [0,1,0,0,0,0|2,1,0]=4 2993 B11R1.81 Nc1cc(ccc1SCF)F 62a_100000687223_100015361967 [0,1,0,0,0,0|2,1,0]=4 2994 B11R1.81 Nc1cc(ccc1SCF)F 62a_100015361967_100000687223 [0,1,0,0,0,0|2,1,0]=4 2995 B11R1.81 Nc1cc(ccc1SCF)O 62a_100011999798_100015361967 [0,1,0,0,0,0|1,1,0]=3 2996 B11R1.81 Nc1cc(ccc1SCF)O 62a_100015361967_100011999798 [0,1,0,0,0,0|1,1,0]=3 2997 B11R1.81 Nc1cc(cnc1OCF)Br 34a_100000743729_100015361967 [0,1,0,0,0,0|3,0,0]=4 2998 B11R1.81 Nc1cc(cnc1OCF)Cl 34a_100011998249_100015361967 [0,1,0,0,0,0|3,0,0]=4 2999 B11R1.81 Nc1cc(ncc1OCF)Br 34a_100009819941_100015361967 [0,1,0,0,0,0|3,0,0]=4 3000 B11R1.81 Nc1cc(ncc1OCF)Br 7a_100009819941_100015361967 [0,1,0,0,0,0|3,0,0]=4 3001 B11R1.81 Nc1ccc(c(c1)Br)OCF 34a_100011534360_100015361967 [0,1,0,0,0,0|2,0,0]=3 3002 B11R1.81 Nc1ccc(c(c1)Br)OCF 7a_100011534360_100015361967 [0,1,0,0,0,0|2,0,0]=3 3003 B11R1.81 Nc1ccc(c(c1)Br)SCF 62a_100000750458_100015361967 [0,1,0,0,0,0|2,1,0]=4 3004 B11R1.81 Nc1ccc(c(c1)Br)SCF 62a_100015361967_100000750458 [0,1,0,0,0,0|2,1,0]=4 3005 B11R1.81 Nc1ccc(c(c1)Cl)OCF 34a_100000744943_100015361967 [0,1,0,0,0,0|2,0,0]=3 3006 B11R1.81 Nc1ccc(c(c1)Cl)OCF 7a_100000744943_100015361967 [0,1,0,0,0,0|2,0,0]=3 3007 B11R1.81 Nc1ccc(c(c1)Cl)SCF 62a_100000761885_100015361967 [0,1,0,0,0,0|2,1,0]=4 3008 B11R1.81 Nc1ccc(c(c1)Cl)SCF 62a_100015361967_100000761885 [0,1,0,0,0,0|2,1,0]=4 3009 B11R1.81 Nc1ccc(c(c1)F)OCF 34a_100011220035_100015361967 [0,1,0,0,0,0|2,0,0]=3 3010 B11R1.81 Nc1ccc(c(c1)F)OCF 7a_100011220035_100015361967 [0,1,0,0,0,0|2,0,0]=3 3011 B11R1.81 Nc1ccc(c(c1)F)SCF 62a_100011356925_100015361967 [0,1,0,0,0,0|2,1,0]=4 3012 B11R1.81 Nc1ccc(c(c1)F)SCF 62a_100015361967_100011356925 [0,1,0,0,0,0|2,1,0]=4 3013 B11R1.81 Nc1ccc(c(c1)N)OCF 34a_100000725306_100015361967 [0,1,0,0,0,0|2,0,0]=3 3014 B11R1.81 Nc1ccc(c(c1)N)SCF 62a_100015361967_200012175722 [0,1,0,0,0,0|2,1,0]=4 3015 B11R1.81 Nc1ccc(c(c1)N)SCF 62a_200012175722_100015361967 [0,1,0,0,0,0|2,1,0]=4 3016 B11R1.81 Nc1nc(ccc1OCF)Br 34a_100000685527_100015361967 [0,1,0,0,0,0|3,0,0]=4 3017 B11R1.81 Nc1nc(ccc1OCF)Br 7a_100000685527_100015361967 [0,1,0,0,0,0|3,0,0]=4 3018 B11R1.81 Nc1nc(ccc1OCF)Cl 34a_100000717809_100015361967 [0,1,0,0,0,0|3,0,0]=4 3019 B11R1.81 Nc1nc(ccc1OCF)Cl 7a_100000717809_100015361967 [0,1,0,0,0,0|3,0,0]=4 3020 B11R1.81 OCCc1ccc(cc1F)O 271570a_203496583355_100011962869 [0,1,0,0,0,0|2,0,0]=3 3021 B11R1.81 Oc1cc(ccc1NCF)Br 34a_100000739049_100015361967 [0,1,0,0,0,0|3,0,0]=4 3022 B11R1.81 Oc1cc(ccc1NCF)Cl 34a_100000185728_100015361967 [0,1,0,0,0,0|3,0,0]=4 3023 B11R1.81 Oc1cc(ccc1NCF)F 34a_100000753323_100015361967 [0,1,0,0,0,0|3,0,0]=4 3024 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100012344904_100015361967 [0,1,0,0,0,0|2,1,0]=4 3025 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100015361967_100012344904 [0,1,0,0,0,0|2,1,0]=4 3026 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100000050036_100015361967 [0,1,0,0,0,0|2,1,0]=4 3027 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100015361967_100000050036 [0,1,0,0,0,0|2,1,0]=4 3028 B11R1.81 Oc1cc(ccc1SCF)F 62a_100000690578_100015361967 [0,1,0,0,0,0|2,1,0]=4 3029 B11R1.81 Oc1cc(ccc1SCF)F 62a_100015361967_100000690578 [0,1,0,0,0,0|2,1,0]=4 3030 B11R1.81 Oc1ccc(c(c1)Br)NCF 34a_100012001276_100015361967 [0,1,0,0,0,0|2,0,0]=3 3031 B11R1.81 Oc1ccc(c(c1)Br)SCF 62a_100000701344_100015361967 [0,1,0,0,0,0|1,1,0]=3 3032 B11R1.81 Oc1ccc(c(c1)Br)SCF 62a_100015361967_100000701344 [0,1,0,0,0,0|1,1,0]=3 3033 B11R1.81 Oc1ccc(c(c1)Cl)NCF 34a_100011215599_100015361967 [0,1,0,0,0,0|2,0,0]=3 3034 B11R1.81 Oc1ccc(c(c1)Cl)SCF 62a_100000047559_100015361967 [0,1,0,0,0,0|1,1,0]=3 3035 B11R1.81 Oc1ccc(c(c1)Cl)SCF 62a_100015361967_100000047559 [0,1,0,0,0,0|1,1,0]=3 3036 B11R1.81 Oc1ccc(c(c1)F)NCF 34a_100000759473_100015361967 [0,1,0,0,0,0|2,0,0]=3 3037 B11R1.81 Oc1ccc(c(c1)F)SCF 62a_100000755031_100015361967 [0,1,0,0,0,0|1,1,0]=3 3038 B11R1.81 Oc1ccc(c(c1)F)SCF 62a_100015361967_100000755031 [0,1,0,0,0,0|1,1,0]=3 3039 B11R1.81 Oc1ccc(c(c1)I)NCF 34a_100010084370_100015361967 [0,1,0,0,0,0|2,0,0]=3 3040 B11R1.81 Oc1ccc(c(c1)O)NCF 34a_100000106777_100015361967 [0,1,0,0,0,0|2,0,0]=3 3041 B11R1.81 Oc1ccc(c(c1)O)SCF 62a_100015361967_100009813921 [0,1,0,0,0,0|1,1,0]=3 3042 B11R1.81 Oc1ccc(c(n1)F)SCF 62a_100009879308_100015361967 [0,1,0,0,0,0|2,1,0]=4 3043 B11R1.81 Oc1ccc(c(n1)F)SCF 62a_100015361967_100009879308 [0,1,0,0,0,0|2,1,0]=4 3044 B11R1.81 Oc1cnc(c(c1)F)SCF 62a_100015361967_100000063512 [0,1,0,0,0,0|2,1,0]=4 3045 B11R1.81 [13CH3]NCc1ccc(cc1Br)Cl 34a_100102692131_200025704644 [0,1,0,0,0,0|3,0,0]=4 3046 B11R1.81 [13CH3]NCc1ccc(cc1Br)F 34a_100000708791_200025704644 [0,1,0,0,0,0|3,0,0]=4 3047 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Br 34a_100020628970_200025704644 [0,1,0,0,0,0|3,0,0]=4 3048 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Cl 34a_100000174880_200025704644 [0,1,0,0,0,0|3,0,0]=4 3049 B11R1.81 [13CH3]NCc1ccc(cc1Cl)F 34a_100000174946_200025704644 [0,1,0,0,0,0|3,0,0]=4 3050 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [0,1,0,0,0,0|2,0,0]=3 3051 B11R1.81 [13CH3]NCc1ccc(cc1F)Br 34a_100000754580_200025704644 [0,1,0,0,0,0|3,0,0]=4 3052 B11R1.81 [13CH3]NCc1ccc(cc1F)Cl 34a_100000708496_200025704644 [0,1,0,0,0,0|3,0,0]=4 3053 B11R1.81 [13CH3]NCc1ccc(cc1F)F 34a_100000737868_200025704644 [0,1,0,0,0,0|3,0,0]=4 3054 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 34a_100012357508_200025704644 [0,1,0,0,0,0|3,0,0]=4 3055 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 7a_100012357508_200025704644 [0,1,0,0,0,0|3,0,0]=4 3056 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 34a_100000707881_200025704644 [0,1,0,0,0,0|3,0,0]=4 3057 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 7a_100000707881_200025704644 [0,1,0,0,0,0|3,0,0]=4 3058 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 34a_100000744086_200025704644 [0,1,0,0,0,0|3,0,0]=4 3059 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 7a_100000744086_200025704644 [0,1,0,0,0,0|3,0,0]=4 3060 B11R1.81 [13CH3]OCc1ccc(cc1Br)I 7a_100010240206_200025704644 [0,1,0,0,0,0|3,0,0]=4 3061 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 34a_100000756401_200025704644 [0,1,0,0,0,0|3,0,0]=4 3062 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 7a_100000756401_200025704644 [0,1,0,0,0,0|3,0,0]=4 3063 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 34a_100000215721_200025704644 [0,1,0,0,0,0|3,0,0]=4 3064 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 7a_100000215721_200025704644 [0,1,0,0,0,0|3,0,0]=4 3065 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 34a_100011219954_200025704644 [0,1,0,0,0,0|3,0,0]=4 3066 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 7a_100011219954_200025704644 [0,1,0,0,0,0|3,0,0]=4 3067 B11R1.81 [13CH3]OCc1ccc(cc1Cl)N 34a_100000689119_200025704644 [0,1,0,0,0,0|3,0,0]=4 3068 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 34a_100011191541_200025704644 [0,1,0,0,0,0|3,0,0]=4 3069 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 7a_100011191541_200025704644 [0,1,0,0,0,0|3,0,0]=4 3070 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 34a_100011217562_200025704644 [0,1,0,0,0,0|3,0,0]=4 3071 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 7a_100011217562_200025704644 [0,1,0,0,0,0|3,0,0]=4 3072 B11R1.81 [13CH3]OCc1ccc(cc1F)F 34a_100011215441_200025704644 [0,1,0,0,0,0|3,0,0]=4 3073 B11R1.81 [13CH3]OCc1ccc(cc1F)F 7a_100011215441_200025704644 [0,1,0,0,0,0|3,0,0]=4 3074 B11R1.81 [13CH3]OCc1ccc(cc1F)I 34a_200010202041_200025704644 [0,1,0,0,0,0|3,0,0]=4 3075 B11R1.81 [13CH3]OCc1ccc(cc1F)I 7a_200010202041_200025704644 [0,1,0,0,0,0|3,0,0]=4 3076 B11R1.81 [13CH3]OCc1ccc(cc1I)Br 7a_100010146605_200025704644 [0,1,0,0,0,0|3,0,0]=4 3077 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 34a_100000722340_200025704644 [0,1,0,0,0,0|3,0,0]=4 3078 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 7a_100000722340_200025704644 [0,1,0,0,0,0|3,0,0]=4 3079 B11R1.81 [13CH3]OCc1ccc(cc1I)F 34a_100011356828_200025704644 [0,1,0,0,0,0|3,0,0]=4 3080 B11R1.81 [13CH3]OCc1ccc(cc1I)F 7a_100011356828_200025704644 [0,1,0,0,0,0|3,0,0]=4 3081 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 34a_100000718831_200025704644 [0,1,0,0,0,0|3,0,0]=4 3082 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 7a_100000718831_200025704644 [0,1,0,0,0,0|3,0,0]=4 3083 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 34a_100000238622_200025704644 [0,1,0,0,0,0|3,0,0]=4 3084 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 7a_100000238622_200025704644 [0,1,0,0,0,0|3,0,0]=4 3085 B11R1.81 [13CH3]OCc1ccc(cc1N)F 34a_100011996588_200025704644 [0,1,0,0,0,0|3,0,0]=4 3086 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200012351560_200025704644 [0,1,0,0,0,0|3,0,0]=4 3087 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200025704644_200012351560 [0,1,0,0,0,0|3,0,0]=4 3088 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_100000755608_200025704644 [0,1,0,0,0,0|3,0,0]=4 3089 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_200025704644_100000755608 [0,1,0,0,0,0|3,0,0]=4 3090 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_100000243222_200025704644 [0,1,0,0,0,0|3,0,0]=4 3091 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_200025704644_100000243222 [0,1,0,0,0,0|3,0,0]=4 3092 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_100010146610_200025704644 [0,1,0,0,0,0|3,0,0]=4 3093 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_200025704644_100010146610 [0,1,0,0,0,0|3,0,0]=4 3094 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_100011740631_200025704644 [0,1,0,0,0,0|3,0,0]=4 3095 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_200025704644_100011740631 [0,1,0,0,0,0|3,0,0]=4 3096 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_100000188473_200025704644 [0,1,0,0,0,0|3,0,0]=4 3097 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_200025704644_100000188473 [0,1,0,0,0,0|3,0,0]=4 3098 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_100000187853_200025704644 [0,1,0,0,0,0|3,0,0]=4 3099 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_200025704644_100000187853 [0,1,0,0,0,0|3,0,0]=4 3100 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_100000211606_200025704644 [0,1,0,0,0,0|3,0,0]=4 3101 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_200025704644_100000211606 [0,1,0,0,0,0|3,0,0]=4 3102 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_100000709361_200025704644 [0,1,0,0,0,0|3,0,0]=4 3103 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_200025704644_100000709361 [0,1,0,0,0,0|3,0,0]=4 3104 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_100000748237_200025704644 [0,1,0,0,0,0|3,0,0]=4 3105 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_200025704644_100000748237 [0,1,0,0,0,0|3,0,0]=4 3106 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_100010244991_200025704644 [0,1,0,0,0,0|3,0,0]=4 3107 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_200025704644_100010244991 [0,1,0,0,0,0|3,0,0]=4 3108 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_100010146615_200025704644 [0,1,0,0,0,0|3,0,0]=4 3109 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_200025704644_100010146615 [0,1,0,0,0,0|3,0,0]=4 3110 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_100010254388_200025704644 [0,1,0,0,0,0|3,0,0]=4 3111 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_200025704644_100010254388 [0,1,0,0,0,0|3,0,0]=4 3112 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_100012354799_200025704644 [0,1,0,0,0,0|3,0,0]=4 3113 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_200025704644_100012354799 [0,1,0,0,0,0|3,0,0]=4 3114 B11R1.83 C#Cc1ccc(cc1)CNC 207a_100102657272_100011361452 [0,1,0,0,0,0|3,0,0]=4 3115 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_100015199678_200000210301 [0,1,0,0,0,0|3,0,0]=4 3116 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_106832991635_100000140223 [0,1,0,0,0,0|3,0,0]=4 3117 B11R1.83 C#Cc1ccc(cc1)CNC 270004a_106832991635_100011361452 [0,1,0,0,0,0|3,0,0]=4 3118 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100015199678_200000210301 [0,1,0,0,0,0|3,0,0]=4 3119 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100102657272_100000140223 [0,1,0,0,0,0|3,0,0]=4 3120 B11R1.83 C#Cc1ccc(cc1)CNC 7a_106832991635_100000140223 [0,1,0,0,0,0|3,0,0]=4 3121 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 2230a_100015199678_200025704644 [0,1,0,0,0,0|3,0,0]=4 3122 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 34a_100015199678_200025704644 [0,1,0,0,0,0|3,0,0]=4 3123 B11R1.83 C#Cc1ccc(cc1)COC 34a_100000054647_200000210301 [0,1,0,0,0,0|3,0,0]=4 3124 B11R1.83 C#Cc1ccc(cc1)COC 34a_100138415774_100000140223 [0,1,0,0,0,0|3,0,0]=4 3125 B11R1.83 C#Cc1ccc(cc1)COC 7a_100000054647_200000210301 [0,1,0,0,0,0|3,0,0]=4 3126 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 34a_100000054647_200025704644 [0,1,0,0,0,0|3,0,0]=4 3127 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 7a_100000054647_200025704644 [0,1,0,0,0,0|3,0,0]=4 3128 B11R1.83 C#Cc1ccc(cc1)CSC 62a_200000210301_100000140223 [0,1,0,0,0,0|3,0,0]=4 3129 B11R1.83 C#Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000140223 [0,1,0,0,0,0|3,0,0]=4 3130 B11R1.83 C#Cc1ccc(cc1)NCC 34a_100011215031_100000210202 [0,1,0,0,0,0|2,0,0]=3 3131 B11R1.83 C#Cc1ccc(cc1)NCF 34a_100011215031_100015361967 [0,1,0,0,0,0|3,0,0]=4 3132 B11R1.83 C#Cc1ccc(nc1)OCC 34a_200009884252_100000210202 [0,1,0,0,0,0|2,0,0]=3 3133 B11R1.83 C#Cc1ccc(nc1)OCF 34a_200009884252_100015361967 [0,1,0,0,0,0|3,0,0]=4 3134 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_100016259036_200000210301 [0,1,0,0,0,0|1,1,1]=4 3135 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_200000210301_100016259036 [0,1,0,0,0,0|1,1,1]=4 3136 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_100016259036_200025704644 [0,1,0,0,0,0|1,1,1]=4 3137 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100016259036 [0,1,0,0,0,0|1,1,1]=4 3138 B11R1.83 C=C=Cc1ccc(cc1)CO 271570a_100015277604_100000690907 [0,1,0,0,0,0|1,0,2]=4 3139 B11R1.83 C=C=Cc1ccc(cc1)OC 271570a_100015277604_100000171711 [0,1,0,0,0,0|1,0,2]=4 3140 B11R1.83 C=CCc1ccc(cc1)OC 34a_100000078792_200000210301 [0,1,0,0,0,0|1,0,2]=4 3141 B11R1.83 C=CCc1ccc(cc1)OC 7a_100000078792_200000210301 [0,1,0,0,0,0|1,0,2]=4 3142 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 34a_100000078792_200025704644 [0,1,0,0,0,0|1,0,2]=4 3143 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 7a_100000078792_200025704644 [0,1,0,0,0,0|1,0,2]=4 3144 B11R1.83 C=COc1ccc(cc1)SC 62a_100000704263_200000210301 [0,1,0,0,0,0|0,1,2]=4 3145 B11R1.83 C=COc1ccc(cc1)SC 62a_200000210301_100000704263 [0,1,0,0,0,0|0,1,2]=4 3146 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_100000704263_200025704644 [0,1,0,0,0,0|0,1,2]=4 3147 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_200025704644_100000704263 [0,1,0,0,0,0|0,1,2]=4 3148 B11R1.83 C=Cc1ccc(cc1)/C=C/C 271570a_100011290941_100016259036 [0,1,0,0,0,0|2,0,1]=4 3149 B11R1.83 C=Cc1ccc(cc1)CCC 271570a_100011290941_100000750032 [0,1,0,0,0,0|2,0,0]=3 3150 B11R1.83 C=Cc1ccc(cc1)CCN 271570a_100011290941_100000755846 [0,1,0,0,0,0|3,0,0]=4 3151 B11R1.83 C=Cc1ccc(cc1)CCO 271570a_100011290941_100000766406 [0,1,0,0,0,0|3,0,0]=4 3152 B11R1.83 C=Cc1ccc(cc1)CNC 2230a_106832991635_100000034074 [0,1,0,0,0,0|3,0,0]=4 3153 B11R1.83 C=Cc1ccc(cc1)CNC 26a_100102657272_100000189437 [0,1,0,0,0,0|3,0,0]=4 3154 B11R1.83 C=Cc1ccc(cc1)CNC 270004a_106832991635_100011361436 [0,1,0,0,0,0|3,0,0]=4 3155 B11R1.83 C=Cc1ccc(cc1)CNC 271570a_100011290941_100000180866 [0,1,0,0,0,0|3,0,0]=4 3156 B11R1.83 C=Cc1ccc(cc1)CNC 34a_100102657272_100000034074 [0,1,0,0,0,0|3,0,0]=4 3157 B11R1.83 C=Cc1ccc(cc1)CNC 34a_200011934891_200000210301 [0,1,0,0,0,0|3,0,0]=4 3158 B11R1.83 C=Cc1ccc(cc1)CNC 7a_106832991635_100000034074 [0,1,0,0,0,0|3,0,0]=4 3159 B11R1.83 C=Cc1ccc(cc1)CN[13CH3] 34a_200011934891_200025704644 [0,1,0,0,0,0|3,0,0]=4 3160 B11R1.83 C=Cc1ccc(cc1)COC 271570a_100011290941_100011493685 [0,1,0,0,0,0|3,0,0]=4 3161 B11R1.83 C=Cc1ccc(cc1)COC 34a_100000073583_200000210301 [0,1,0,0,0,0|3,0,0]=4 3162 B11R1.83 C=Cc1ccc(cc1)COC 34a_100138415774_100000034074 [0,1,0,0,0,0|3,0,0]=4 3163 B11R1.83 C=Cc1ccc(cc1)COC 7a_100000073583_200000210301 [0,1,0,0,0,0|3,0,0]=4 3164 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 34a_100000073583_200025704644 [0,1,0,0,0,0|3,0,0]=4 3165 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 7a_100000073583_200025704644 [0,1,0,0,0,0|3,0,0]=4 3166 B11R1.83 C=Cc1ccc(cc1)CSC 62a_100000034074_200000210301 [0,1,0,0,0,0|3,0,0]=4 3167 B11R1.83 C=Cc1ccc(cc1)CSC 62a_200000210301_100000034074 [0,1,0,0,0,0|3,0,0]=4 3168 B11R1.83 C=Cc1ccc(cc1)CS[13CH3] 62a_100000034074_200025704644 [0,1,0,0,0,0|3,0,0]=4 3169 B11R1.83 C=Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000034074 [0,1,0,0,0,0|3,0,0]=4 3170 B11R1.83 C=Cc1ccc(cc1)NCC 271570a_100011290941_100000219632 [0,1,0,0,0,0|2,0,0]=3 3171 B11R1.83 C=Cc1ccc(cc1)NCC 34a_100011218248_100000210202 [0,1,0,0,0,0|2,0,0]=3 3172 B11R1.83 C=Cc1ccc(cc1)NCF 34a_100011218248_100015361967 [0,1,0,0,0,0|3,0,0]=4 3173 B11R1.83 C=Cc1ccc(cc1)OCC 271570a_100011290941_100000169946 [0,1,0,0,0,0|1,0,0]=2 3174 B11R1.83 C=Cc1ccc(cc1)OCC 34a_100000189437_100000210202 [0,1,0,0,0,0|1,0,0]=2 3175 B11R1.83 C=Cc1ccc(cc1)OCC 7a_100000189437_100000210202 [0,1,0,0,0,0|1,0,0]=2 3176 B11R1.83 C=Cc1ccc(cc1)OCF 34a_100000189437_100015361967 [0,1,0,0,0,0|2,0,0]=3 3177 B11R1.83 C=Cc1ccc(cc1)OCF 7a_100000189437_100015361967 [0,1,0,0,0,0|2,0,0]=3 3178 B11R1.83 C=Cc1ccc(cc1)SCC 271570a_100011290941_200009811893 [0,1,0,0,0,0|1,1,0]=3 3179 B11R1.83 C=Cc1ccc(cc1)SCC 62a_100000210202_100000748128 [0,1,0,0,0,0|1,1,0]=3 3180 B11R1.83 C=Cc1ccc(cc1)SCC 62a_100000748128_100000210202 [0,1,0,0,0,0|1,1,0]=3 3181 B11R1.83 C=Cc1ccc(cc1)SCF 62a_100000748128_100015361967 [0,1,0,0,0,0|2,1,0]=4 3182 B11R1.83 C=Cc1ccc(cc1)SCF 62a_100015361967_100000748128 [0,1,0,0,0,0|2,1,0]=4 3183 B11R1.83 C=Cc1ccc(cn1)OCC 271570a_100011290941_100000753957 [0,1,0,0,0,0|2,0,0]=3 3184 B11R1.83 C=Cc1ccc(nc1)NCC 271570a_100011290941_100000741496 [0,1,0,0,0,0|3,0,0]=4 3185 B11R1.83 C=Cc1ccc(nc1)OCC 271570a_100011290941_100011219444 [0,1,0,0,0,0|2,0,0]=3 3186 B11R1.83 C=Cc1ccc(nc1)SCC 271570a_100011290941_100000690189 [0,1,0,0,0,0|2,1,0]=4 3187 B11R1.83 C=Cc1ccc(nc1)SCC 62a_100000210202_103436540071 [0,1,0,0,0,0|2,1,0]=4 3188 B11R1.83 C=Cc1ccc(nc1)SCC 62a_103436540071_100000210202 [0,1,0,0,0,0|2,1,0]=4 3189 B11R1.83 C=Cc1ccc(nn1)OCC 271570a_100011290941_100000757289 [0,1,0,0,0,0|3,0,0]=4 3190 B11R1.83 C=Cc1cnc(cn1)OCC 271570a_100011290941_200012356188 [0,1,0,0,0,0|3,0,0]=4 3191 B11R1.83 C=Cc1cnc(nc1)OCC 271570a_100011290941_100011934766 [0,1,0,0,0,0|3,0,0]=4 3192 B11R1.83 C=Cc1ncc(cn1)OCC 271570a_100011290941_100000099823 [0,1,0,0,0,0|3,0,0]=4 3193 B11R1.83 CC=Cc1ccc(cc1)C#N 271570a_100016259895_100000179745 [0,1,0,0,0,0|2,0,1]=4 3194 B11R1.83 CC=Cc1ccc(cc1)C=O 271570a_100016259895_100000186029 [0,1,0,0,0,0|1,0,2]=4 3195 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [0,1,0,0,0,0|2,0,1]=4 3196 B11R1.83 CC=Cc1ccc(cc1)CF 271570a_100016259895_100010268989 [0,1,0,0,0,0|2,0,1]=4 3197 B11R1.83 CC=Cc1ccc(cc1)CN 271570a_100016259895_100016989417 [0,1,0,0,0,0|2,0,1]=4 3198 B11R1.83 CC=Cc1ccc(cc1)CO 271570a_100016259895_100000690907 [0,1,0,0,0,0|1,0,1]=3 3199 B11R1.83 CC=Cc1ccc(cc1)NC 271570a_100016259895_100000219623 [0,1,0,0,0,0|2,0,1]=4 3200 B11R1.83 CC=Cc1ccc(cc1)NN 271570a_100016259895_100016988836 [0,1,0,0,0,0|2,0,1]=4 3201 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [0,1,0,0,0,0|1,0,1]=3 3202 B11R1.83 CC=Cc1ccc(cc1)SC 271570a_100016259895_100011263217 [0,1,0,0,0,0|1,1,1]=4 3203 B11R1.83 CC=Cc1ccc(cn1)CO 271570a_100016259895_100009816760 [0,1,0,0,0,0|2,0,1]=4 3204 B11R1.83 CC=Cc1ccc(cn1)OC 271570a_100016259895_100000755202 [0,1,0,0,0,0|2,0,1]=4 3205 B11R1.83 CC=Cc1ccc(nc1)CO 271570a_100016259895_100000754261 [0,1,0,0,0,0|2,0,1]=4 3206 B11R1.83 CC=Cc1ccc(nc1)OC 271570a_100016259895_100000047065 [0,1,0,0,0,0|2,0,1]=4 3207 B11R1.83 CCCc1ccc(cc1)NC 2230a_100000211780_200000210301 [0,1,0,0,0,0|2,0,0]=3 3208 B11R1.83 CCCc1ccc(cc1)NC 34a_100000211780_200000210301 [0,1,0,0,0,0|2,0,0]=3 3209 B11R1.83 CCCc1ccc(cc1)N[13CH3] 2230a_100000211780_200025704644 [0,1,0,0,0,0|2,0,0]=3 3210 B11R1.83 CCCc1ccc(cc1)N[13CH3] 34a_100000211780_200025704644 [0,1,0,0,0,0|2,0,0]=3 3211 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [0,1,0,0,0,0|1,0,0]=2 3212 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [0,1,0,0,0,0|1,0,0]=2 3213 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [0,1,0,0,0,0|1,0,0]=2 3214 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [0,1,0,0,0,0|1,0,0]=2 3215 B11R1.83 CCCc1ccc(cc1)SC 62a_100000750032_200000210301 [0,1,0,0,0,0|1,1,0]=3 3216 B11R1.83 CCCc1ccc(cc1)SC 62a_200000210301_100000750032 [0,1,0,0,0,0|1,1,0]=3 3217 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_100000750032_200025704644 [0,1,0,0,0,0|1,1,0]=3 3218 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000750032 [0,1,0,0,0,0|1,1,0]=3 3219 B11R1.83 CCNc1ccc(cc1)C#N 34a_100000185469_100000210202 [0,1,0,0,0,0|2,0,0]=3 3220 B11R1.83 CCNc1ccc(cc1)CC 2230a_100000211069_100000210202 [0,1,0,0,0,0|2,0,0]=3 3221 B11R1.83 CCNc1ccc(cc1)CC 34a_100000211069_100000210202 [0,1,0,0,0,0|2,0,0]=3 3222 B11R1.83 CCNc1ccc(cc1)CO 2230a_100011215238_100000210202 [0,1,0,0,0,0|1,0,0]=2 3223 B11R1.83 CCNc1ccc(cc1)CO 34a_100011215238_100000210202 [0,1,0,0,0,0|1,0,0]=2 3224 B11R1.83 CCNc1ccc(cc1)OC 34a_100000184247_100000210202 [0,1,0,0,0,0|1,0,0]=2 3225 B11R1.83 CCNc1ccc(cc1)OC 34a_100011337800_200000210301 [0,1,0,0,0,0|1,0,0]=2 3226 B11R1.83 CCNc1ccc(cc1)OC 7a_100011337800_200000210301 [0,1,0,0,0,0|1,0,0]=2 3227 B11R1.83 CCNc1ccc(cc1)O[13CH3] 34a_100011337800_200025704644 [0,1,0,0,0,0|1,0,0]=2 3228 B11R1.83 CCNc1ccc(cc1)O[13CH3] 7a_100011337800_200025704644 [0,1,0,0,0,0|1,0,0]=2 3229 B11R1.83 CCNc1ccc(cc1)SC 34a_100000212337_100000210202 [0,1,0,0,0,0|1,1,0]=3 3230 B11R1.83 CCNc1ccc(cc1)SC 62a_200000210301_100000219632 [0,1,0,0,0,0|1,1,0]=3 3231 B11R1.83 CCNc1ccc(cc1)S[13CH3] 62a_200025704644_100000219632 [0,1,0,0,0,0|1,1,0]=3 3232 B11R1.83 CCNc1ccc(cn1)C#N 27a_100015525214_100000241038 [0,1,0,0,0,0|3,0,0]=4 3233 B11R1.83 CCNc1ccc(cn1)SC 27a_100015525214_100009820866 [0,1,0,0,0,0|2,1,0]=4 3234 B11R1.83 CCNc1ccc(cn1)SC 62a_100000741496_200000210301 [0,1,0,0,0,0|2,1,0]=4 3235 B11R1.83 CCNc1ccc(cn1)SC 62a_200000210301_100000741496 [0,1,0,0,0,0|2,1,0]=4 3236 B11R1.83 CCNc1ccc(cn1)S[13CH3] 62a_100000741496_200025704644 [0,1,0,0,0,0|2,1,0]=4 3237 B11R1.83 CCNc1ccc(cn1)S[13CH3] 62a_200025704644_100000741496 [0,1,0,0,0,0|2,1,0]=4 3238 B11R1.83 CCNc1ccc(nn1)OC 27a_100015525214_100010231723 [0,1,0,0,0,0|3,0,0]=4 3239 B11R1.83 CCNc1cnc(cn1)CO 27a_100015525214_100012002382 [0,1,0,0,0,0|3,0,0]=4 3240 B11R1.83 CCNc1ncc(cn1)CO 27a_100015525214_100009855073 [0,1,0,0,0,0|3,0,0]=4 3241 B11R1.83 CCNc1ncc(cn1)OC 27a_100015525214_100000069167 [0,1,0,0,0,0|3,0,0]=4 3242 B11R1.83 CCOc1ccc(cc1)C#N 34a_100000210344_100000210202 [0,1,0,0,0,0|1,0,0]=2 3243 B11R1.83 CCOc1ccc(cc1)C#N 7a_100000210344_100000210202 [0,1,0,0,0,0|1,0,0]=2 3244 B11R1.83 CCOc1ccc(cc1)CC 34a_100000211359_100000210202 [0,1,0,0,0,0|1,0,0]=2 3245 B11R1.83 CCOc1ccc(cc1)CC 7a_100000211359_100000210202 [0,1,0,0,0,0|1,0,0]=2 3246 B11R1.83 CCOc1ccc(cc1)CN 34a_100000185549_100000210202 [0,1,0,0,0,0|1,0,0]=2 3247 B11R1.83 CCOc1ccc(cc1)CO 34a_100000211755_100000210202 [0,1,0,0,0,0|0,0,0]=1 3248 B11R1.83 CCOc1ccc(cc1)NC 2230a_100000739623_200000210301 [0,1,0,0,0,0|1,0,0]=2 3249 B11R1.83 CCOc1ccc(cc1)NC 34a_100000182112_100000210202 [0,1,0,0,0,0|1,0,0]=2 3250 B11R1.83 CCOc1ccc(cc1)NC 34a_100000739623_200000210301 [0,1,0,0,0,0|1,0,0]=2 3251 B11R1.83 CCOc1ccc(cc1)N[13CH3] 2230a_100000739623_200025704644 [0,1,0,0,0,0|1,0,0]=2 3252 B11R1.83 CCOc1ccc(cc1)N[13CH3] 34a_100000739623_200025704644 [0,1,0,0,0,0|1,0,0]=2 3253 B11R1.83 CCOc1ccc(cc1)OC 34a_100000185467_200000210301 [0,1,0,0,0,0|0,0,0]=1 3254 B11R1.83 CCOc1ccc(cc1)OC 34a_100000210503_100000210202 [0,1,0,0,0,0|0,0,0]=1 3255 B11R1.83 CCOc1ccc(cc1)O[13CH3] 34a_100000185467_200025704644 [0,1,0,0,0,0|0,0,0]=1 3256 B11R1.83 CCOc1ccc(cc1)SC 34a_100000211864_100000210202 [0,1,0,0,0,0|0,1,0]=2 3257 B11R1.83 CCOc1ccc(cc1)SC 62a_200000210301_100000171712 [0,1,0,0,0,0|0,1,0]=2 3258 B11R1.83 CCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000171712 [0,1,0,0,0,0|0,1,0]=2 3259 B11R1.83 CCOc1ccc(cn1)CN 34a_100000757128_100000210202 [0,1,0,0,0,0|2,0,0]=3 3260 B11R1.83 CCOc1ccc(cn1)OC 34a_100012002028_100000210202 [0,1,0,0,0,0|1,0,0]=2 3261 B11R1.83 CCOc1ccc(cn1)SC 62a_100011219444_200000210301 [0,1,0,0,0,0|1,1,0]=3 3262 B11R1.83 CCOc1ccc(cn1)SC 62a_200000210301_100011219444 [0,1,0,0,0,0|1,1,0]=3 3263 B11R1.83 CCOc1ccc(cn1)S[13CH3] 62a_100011219444_200025704644 [0,1,0,0,0,0|1,1,0]=3 3264 B11R1.83 CCOc1ccc(cn1)S[13CH3] 62a_200025704644_100011219444 [0,1,0,0,0,0|1,1,0]=3 3265 B11R1.83 CCOc1ccc(nc1)C#N 34a_100011934750_100000210202 [0,1,0,0,0,0|2,0,0]=3 3266 B11R1.83 CCOc1ccc(nc1)C#N 7a_100011934750_100000210202 [0,1,0,0,0,0|2,0,0]=3 3267 B11R1.83 CCOc1ccc(nc1)CN 34a_100020605196_100000210202 [0,1,0,0,0,0|2,0,0]=3 3268 B11R1.83 CCOc1ccc(nc1)CO 34a_103436540053_100000210202 [0,1,0,0,0,0|1,0,0]=2 3269 B11R1.83 CCOc1ccc(nc1)OC 34a_100011934560_100000210202 [0,1,0,0,0,0|1,0,0]=2 3270 B11R1.83 CCOc1ccc(nc1)SC 62a_100012355646_200000210301 [0,1,0,0,0,0|1,1,0]=3 3271 B11R1.83 CCOc1ccc(nc1)SC 62a_200000210301_100000753957 [0,1,0,0,0,0|1,1,0]=3 3272 B11R1.83 CCOc1ccc(nc1)S[13CH3] 62a_100012355646_200025704644 [0,1,0,0,0,0|1,1,0]=3 3273 B11R1.83 CCOc1ccc(nc1)S[13CH3] 62a_200025704644_100000753957 [0,1,0,0,0,0|1,1,0]=3 3274 B11R1.83 CCOc1ccc(nn1)NC 27a_100102657272_100000757289 [0,1,0,0,0,0|3,0,0]=4 3275 B11R1.83 CCOc1ccc(nn1)SC 62a_200000210301_100000757289 [0,1,0,0,0,0|2,1,0]=4 3276 B11R1.83 CCOc1ccc(nn1)S[13CH3] 62a_200025704644_100000757289 [0,1,0,0,0,0|2,1,0]=4 3277 B11R1.83 CCOc1cnc(cn1)SC 62a_200000210301_200012356188 [0,1,0,0,0,0|2,1,0]=4 3278 B11R1.83 CCOc1cnc(cn1)SC 62a_200012356188_200000210301 [0,1,0,0,0,0|2,1,0]=4 3279 B11R1.83 CCOc1cnc(cn1)S[13CH3] 62a_200012356188_200025704644 [0,1,0,0,0,0|2,1,0]=4 3280 B11R1.83 CCOc1cnc(cn1)S[13CH3] 62a_200025704644_200012356188 [0,1,0,0,0,0|2,1,0]=4 3281 B11R1.83 CCOc1cnc(nc1)C#N 7a_100000707606_100000210202 [0,1,0,0,0,0|3,0,0]=4 3282 B11R1.83 CCOc1cnc(nc1)NC 27a_100102657272_100000099823 [0,1,0,0,0,0|3,0,0]=4 3283 B11R1.83 CCOc1cnc(nc1)OC 34a_100000099601_100000210202 [0,1,0,0,0,0|2,0,0]=3 3284 B11R1.83 CCOc1cnc(nc1)OC 7a_100000099601_100000210202 [0,1,0,0,0,0|2,0,0]=3 3285 B11R1.83 CCOc1cnc(nc1)SC 34a_100000075549_100000210202 [0,1,0,0,0,0|2,1,0]=4 3286 B11R1.83 CCOc1cnc(nc1)SC 62a_100000099823_200000210301 [0,1,0,0,0,0|2,1,0]=4 3287 B11R1.83 CCOc1cnc(nc1)SC 62a_200000210301_100000099823 [0,1,0,0,0,0|2,1,0]=4 3288 B11R1.83 CCOc1cnc(nc1)SC 7a_100000075549_100000210202 [0,1,0,0,0,0|2,1,0]=4 3289 B11R1.83 CCOc1cnc(nc1)S[13CH3] 62a_100000099823_200025704644 [0,1,0,0,0,0|2,1,0]=4 3290 B11R1.83 CCOc1cnc(nc1)S[13CH3] 62a_200025704644_100000099823 [0,1,0,0,0,0|2,1,0]=4 3291 B11R1.83 CCOc1ncc(cn1)SC 62a_100011934766_200000210301 [0,1,0,0,0,0|2,1,0]=4 3292 B11R1.83 CCOc1ncc(cn1)SC 62a_200000210301_100011934766 [0,1,0,0,0,0|2,1,0]=4 3293 B11R1.83 CCOc1ncc(cn1)S[13CH3] 62a_100011934766_200025704644 [0,1,0,0,0,0|2,1,0]=4 3294 B11R1.83 CCOc1ncc(cn1)S[13CH3] 62a_200025704644_100011934766 [0,1,0,0,0,0|2,1,0]=4 3295 B11R1.83 CCSc1ccc(cc1)C#N 62a_100000210202_100000184291 [0,1,0,0,0,0|1,1,0]=3 3296 B11R1.83 CCSc1ccc(cc1)C=O 62a_100000188517_100000210202 [0,1,0,0,0,0|0,1,1]=3 3297 B11R1.83 CCSc1ccc(cc1)C=O 62a_100000210202_100000188517 [0,1,0,0,0,0|0,1,1]=3 3298 B11R1.83 CCSc1ccc(cc1)CC 62a_100000210202_100011215824 [0,1,0,0,0,0|1,1,0]=3 3299 B11R1.83 CCSc1ccc(cc1)CC 62a_100011215824_100000210202 [0,1,0,0,0,0|1,1,0]=3 3300 B11R1.83 CCSc1ccc(cc1)CF 62a_100000210202_100010268989 [0,1,0,0,0,0|1,1,0]=3 3301 B11R1.83 CCSc1ccc(cc1)CF 62a_100010268989_100000210202 [0,1,0,0,0,0|1,1,0]=3 3302 B11R1.83 CCSc1ccc(cc1)CN 62a_100000210202_100016989417 [0,1,0,0,0,0|1,1,0]=3 3303 B11R1.83 CCSc1ccc(cc1)CN 62a_100016989417_100000210202 [0,1,0,0,0,0|1,1,0]=3 3304 B11R1.83 CCSc1ccc(cc1)CO 62a_100000210202_100000690907 [0,1,0,0,0,0|0,1,0]=2 3305 B11R1.83 CCSc1ccc(cc1)CO 62a_100000690907_100000210202 [0,1,0,0,0,0|0,1,0]=2 3306 B11R1.83 CCSc1ccc(cc1)NC 34a_100015187087_200000210301 [0,1,0,0,0,0|1,1,0]=3 3307 B11R1.83 CCSc1ccc(cc1)NC 62a_100000210202_100000743151 [0,1,0,0,0,0|1,1,0]=3 3308 B11R1.83 CCSc1ccc(cc1)NC 62a_100000743151_100000210202 [0,1,0,0,0,0|1,1,0]=3 3309 B11R1.83 CCSc1ccc(cc1)NN 62a_100000210202_100016988836 [0,1,0,0,0,0|1,1,0]=3 3310 B11R1.83 CCSc1ccc(cc1)NN 62a_100016988836_100000210202 [0,1,0,0,0,0|1,1,0]=3 3311 B11R1.83 CCSc1ccc(cc1)N[13CH3] 34a_100015187087_200025704644 [0,1,0,0,0,0|1,1,0]=3 3312 B11R1.83 CCSc1ccc(cc1)OC 62a_100000210202_100000171711 [0,1,0,0,0,0|0,1,0]=2 3313 B11R1.83 CCSc1ccc(cc1)SC 62a_100000210202_100011263217 [0,1,0,0,0,0|0,2,0]=3 3314 B11R1.83 CCSc1ccc(cc1)SC 62a_100011263217_100000210202 [0,1,0,0,0,0|0,2,0]=3 3315 B11R1.83 CCSc1ccc(cc1)SC 62a_200000210301_200009811893 [0,1,0,0,0,0|0,2,0]=3 3316 B11R1.83 CCSc1ccc(cc1)SC 62a_200009811893_200000210301 [0,1,0,0,0,0|0,2,0]=3 3317 B11R1.83 CCSc1ccc(cc1)S[13CH3] 62a_200009811893_200025704644 [0,1,0,0,0,0|0,2,0]=3 3318 B11R1.83 CCSc1ccc(cc1)S[13CH3] 62a_200025704644_200009811893 [0,1,0,0,0,0|0,2,0]=3 3319 B11R1.83 CCSc1ccc(cn1)C#N 62a_100000210202_100000241038 [0,1,0,0,0,0|2,1,0]=4 3320 B11R1.83 CCSc1ccc(cn1)C=O 62a_100000210202_100000766901 [0,1,0,0,0,0|1,1,1]=4 3321 B11R1.83 CCSc1ccc(cn1)C=O 62a_100000766901_100000210202 [0,1,0,0,0,0|1,1,1]=4 3322 B11R1.83 CCSc1ccc(cn1)CC 62a_100000210202_100009843584 [0,1,0,0,0,0|2,1,0]=4 3323 B11R1.83 CCSc1ccc(cn1)CC 62a_100009843584_100000210202 [0,1,0,0,0,0|2,1,0]=4 3324 B11R1.83 CCSc1ccc(cn1)CN 62a_100000210202_100000735879 [0,1,0,0,0,0|2,1,0]=4 3325 B11R1.83 CCSc1ccc(cn1)CN 62a_100000735879_100000210202 [0,1,0,0,0,0|2,1,0]=4 3326 B11R1.83 CCSc1ccc(cn1)CO 62a_100000210202_100009816760 [0,1,0,0,0,0|1,1,0]=3 3327 B11R1.83 CCSc1ccc(cn1)CO 62a_100009816760_100000210202 [0,1,0,0,0,0|1,1,0]=3 3328 B11R1.83 CCSc1ccc(cn1)NC 62a_100000210202_100000764248 [0,1,0,0,0,0|2,1,0]=4 3329 B11R1.83 CCSc1ccc(cn1)NC 62a_100000764248_100000210202 [0,1,0,0,0,0|2,1,0]=4 3330 B11R1.83 CCSc1ccc(cn1)NN 62a_100000210202_100000119030 [0,1,0,0,0,0|2,1,0]=4 3331 B11R1.83 CCSc1ccc(cn1)NN 62a_100000755011_100000210202 [0,1,0,0,0,0|2,1,0]=4 3332 B11R1.83 CCSc1ccc(cn1)OC 62a_100000210202_100000744180 [0,1,0,0,0,0|1,1,0]=3 3333 B11R1.83 CCSc1ccc(cn1)OC 62a_100000755202_100000210202 [0,1,0,0,0,0|1,1,0]=3 3334 B11R1.83 CCSc1ccc(cn1)SC 62a_100000210202_100009820866 [0,1,0,0,0,0|1,2,0]=4 3335 B11R1.83 CCSc1ccc(cn1)SC 62a_100000690189_200000210301 [0,1,0,0,0,0|1,2,0]=4 3336 B11R1.83 CCSc1ccc(cn1)SC 62a_100009820866_100000210202 [0,1,0,0,0,0|1,2,0]=4 3337 B11R1.83 CCSc1ccc(cn1)SC 62a_200000210301_100000690189 [0,1,0,0,0,0|1,2,0]=4 3338 B11R1.83 CCSc1ccc(cn1)S[13CH3] 62a_100000690189_200025704644 [0,1,0,0,0,0|1,2,0]=4 3339 B11R1.83 CCSc1ccc(cn1)S[13CH3] 62a_200025704644_100000690189 [0,1,0,0,0,0|1,2,0]=4 3340 B11R1.83 CCSc1ccc(nc1)C#N 62a_100000210202_100000760455 [0,1,0,0,0,0|2,1,0]=4 3341 B11R1.83 CCSc1ccc(nc1)C=O 62a_100000210202_100000754260 [0,1,0,0,0,0|1,1,1]=4 3342 B11R1.83 CCSc1ccc(nc1)C=O 62a_100000754260_100000210202 [0,1,0,0,0,0|1,1,1]=4 3343 B11R1.83 CCSc1ccc(nc1)CC 62a_100000210202_100009820025 [0,1,0,0,0,0|2,1,0]=4 3344 B11R1.83 CCSc1ccc(nc1)CC 62a_100009820025_100000210202 [0,1,0,0,0,0|2,1,0]=4 3345 B11R1.83 CCSc1ccc(nc1)CN 62a_100000210202_100015188789 [0,1,0,0,0,0|2,1,0]=4 3346 B11R1.83 CCSc1ccc(nc1)CN 62a_100015188789_100000210202 [0,1,0,0,0,0|2,1,0]=4 3347 B11R1.83 CCSc1ccc(nc1)CO 62a_100000210202_100000754261 [0,1,0,0,0,0|1,1,0]=3 3348 B11R1.83 CCSc1ccc(nc1)CO 62a_100000754261_100000210202 [0,1,0,0,0,0|1,1,0]=3 3349 B11R1.83 CCSc1ccc(nc1)NC 62a_100000210202_100000741341 [0,1,0,0,0,0|2,1,0]=4 3350 B11R1.83 CCSc1ccc(nc1)NC 62a_100000741341_100000210202 [0,1,0,0,0,0|2,1,0]=4 3351 B11R1.83 CCSc1ccc(nc1)NN 62a_100000210202_100000750576 [0,1,0,0,0,0|2,1,0]=4 3352 B11R1.83 CCSc1ccc(nc1)NN 62a_100000750576_100000210202 [0,1,0,0,0,0|2,1,0]=4 3353 B11R1.83 CCSc1ccc(nc1)OC 62a_100000047065_100000210202 [0,1,0,0,0,0|1,1,0]=3 3354 B11R1.83 CCSc1ccc(nc1)OC 62a_100000210202_100000047065 [0,1,0,0,0,0|1,1,0]=3 3355 B11R1.83 CCSc1ccc(nc1)SC 62a_100000210202_100011408404 [0,1,0,0,0,0|1,2,0]=4 3356 B11R1.83 CCSc1ccc(nc1)SC 62a_100011408404_100000210202 [0,1,0,0,0,0|1,2,0]=4 3357 B11R1.83 CCSc1ccc(nn1)OC 62a_100000210202_100009819040 [0,1,0,0,0,0|2,1,0]=4 3358 B11R1.83 CCSc1ccc(nn1)OC 62a_100009819040_100000210202 [0,1,0,0,0,0|2,1,0]=4 3359 B11R1.83 CCSc1cnc(cn1)CO 62a_100000210202_100012002382 [0,1,0,0,0,0|2,1,0]=4 3360 B11R1.83 CCSc1cnc(cn1)CO 62a_100012002382_100000210202 [0,1,0,0,0,0|2,1,0]=4 3361 B11R1.83 CCSc1cnc(cn1)OC 62a_100000210202_100011998698 [0,1,0,0,0,0|2,1,0]=4 3362 B11R1.83 CCSc1cnc(cn1)OC 62a_100011998698_100000210202 [0,1,0,0,0,0|2,1,0]=4 3363 B11R1.83 CCSc1cnc(nc1)CO 62a_100000210202_100009867226 [0,1,0,0,0,0|2,1,0]=4 3364 B11R1.83 CCSc1cnc(nc1)CO 62a_100009867226_100000210202 [0,1,0,0,0,0|2,1,0]=4 3365 B11R1.83 CCSc1cnc(nc1)OC 62a_100000210202_100000686852 [0,1,0,0,0,0|2,1,0]=4 3366 B11R1.83 CCSc1cnc(nc1)OC 62a_100000686852_100000210202 [0,1,0,0,0,0|2,1,0]=4 3367 B11R1.83 CCSc1ncc(cn1)CO 62a_100000210202_100009855073 [0,1,0,0,0,0|2,1,0]=4 3368 B11R1.83 CCSc1ncc(cn1)CO 62a_100009855073_100000210202 [0,1,0,0,0,0|2,1,0]=4 3369 B11R1.83 CCSc1ncc(cn1)OC 62a_100000069167_100000210202 [0,1,0,0,0,0|2,1,0]=4 3370 B11R1.83 CCSc1ncc(cn1)OC 62a_100000210202_100000069167 [0,1,0,0,0,0|2,1,0]=4 3371 B11R1.83 CCc1ccc(cc1)CNC 207a_100102657272_100000211036 [0,1,0,0,0,0|3,0,0]=4 3372 B11R1.83 CCc1ccc(cc1)CNC 2230a_100000721222_200000210301 [0,1,0,0,0,0|3,0,0]=4 3373 B11R1.83 CCc1ccc(cc1)CNC 2230a_106832991635_100000747183 [0,1,0,0,0,0|3,0,0]=4 3374 B11R1.83 CCc1ccc(cc1)CNC 26a_100102657272_100000211359 [0,1,0,0,0,0|3,0,0]=4 3375 B11R1.83 CCc1ccc(cc1)CNC 270004a_106832991635_100000211036 [0,1,0,0,0,0|3,0,0]=4 3376 B11R1.83 CCc1ccc(cc1)CNC 34a_100000721222_200000210301 [0,1,0,0,0,0|3,0,0]=4 3377 B11R1.83 CCc1ccc(cc1)CNC 34a_100102657272_100000747183 [0,1,0,0,0,0|3,0,0]=4 3378 B11R1.83 CCc1ccc(cc1)CNC 7a_106832991635_100000747183 [0,1,0,0,0,0|3,0,0]=4 3379 B11R1.83 CCc1ccc(cc1)CN[13CH3] 2230a_100000721222_200025704644 [0,1,0,0,0,0|3,0,0]=4 3380 B11R1.83 CCc1ccc(cc1)CN[13CH3] 34a_100000721222_200025704644 [0,1,0,0,0,0|3,0,0]=4 3381 B11R1.83 CCc1ccc(cc1)COC 34a_100000702245_200000210301 [0,1,0,0,0,0|3,0,0]=4 3382 B11R1.83 CCc1ccc(cc1)COC 34a_100138415774_100000747183 [0,1,0,0,0,0|3,0,0]=4 3383 B11R1.83 CCc1ccc(cc1)COC 7a_100000702245_200000210301 [0,1,0,0,0,0|3,0,0]=4 3384 B11R1.83 CCc1ccc(cc1)CO[13CH3] 34a_100000702245_200025704644 [0,1,0,0,0,0|3,0,0]=4 3385 B11R1.83 CCc1ccc(cc1)CO[13CH3] 7a_100000702245_200025704644 [0,1,0,0,0,0|3,0,0]=4 3386 B11R1.83 CCc1ccc(cc1)CSC 62a_100000757233_200000210301 [0,1,0,0,0,0|3,0,0]=4 3387 B11R1.83 CCc1ccc(cc1)CSC 62a_200000210301_100000747183 [0,1,0,0,0,0|3,0,0]=4 3388 B11R1.83 CCc1ccc(cc1)CS[13CH3] 62a_100000757233_200025704644 [0,1,0,0,0,0|3,0,0]=4 3389 B11R1.83 CCc1ccc(cc1)CS[13CH3] 62a_200025704644_100000747183 [0,1,0,0,0,0|3,0,0]=4 3390 B11R1.83 CCc1ccc(cc1)NCF 34a_100000211069_100015361967 [0,1,0,0,0,0|3,0,0]=4 3391 B11R1.83 CCc1ccc(cc1)OCF 34a_100000211359_100015361967 [0,1,0,0,0,0|2,0,0]=3 3392 B11R1.83 CCc1ccc(cc1)OCF 7a_100000211359_100015361967 [0,1,0,0,0,0|2,0,0]=3 3393 B11R1.83 CCc1ccc(cc1)SCF 62a_100011215824_100015361967 [0,1,0,0,0,0|2,1,0]=4 3394 B11R1.83 CCc1ccc(cc1)SCF 62a_100015361967_100011215824 [0,1,0,0,0,0|2,1,0]=4 3395 B11R1.83 CNCc1ccc(cc1)C#N 207a_100102657272_100000211122 [0,1,0,0,0,0|3,0,0]=4 3396 B11R1.83 CNCc1ccc(cc1)C#N 2230a_106832991635_100000184898 [0,1,0,0,0,0|3,0,0]=4 3397 B11R1.83 CNCc1ccc(cc1)C#N 26a_100102657272_100000210344 [0,1,0,0,0,0|3,0,0]=4 3398 B11R1.83 CNCc1ccc(cc1)C#N 270004a_106832991635_100000211122 [0,1,0,0,0,0|3,0,0]=4 3399 B11R1.83 CNCc1ccc(cc1)C#N 34a_100015207190_200000210301 [0,1,0,0,0,0|3,0,0]=4 3400 B11R1.83 CNCc1ccc(cc1)C#N 34a_100102657272_100000184898 [0,1,0,0,0,0|3,0,0]=4 3401 B11R1.83 CNCc1ccc(cc1)C#N 7a_106832991635_100000184898 [0,1,0,0,0,0|3,0,0]=4 3402 B11R1.83 CNCc1ccc(cc1)C=O 2230a_106832991635_100009816848 [0,1,0,0,0,0|2,0,1]=4 3403 B11R1.83 CNCc1ccc(cc1)C=O 34a_100102657272_100009816848 [0,1,0,0,0,0|2,0,1]=4 3404 B11R1.83 CNCc1ccc(cc1)C=O 7a_106832991635_100009816848 [0,1,0,0,0,0|2,0,1]=4 3405 B11R1.83 CNCc1ccc(cc1)CO 207a_100102657272_100009832023 [0,1,0,0,0,0|2,0,0]=3 3406 B11R1.83 CNCc1ccc(cc1)CO 2230a_100015189231_200000210301 [0,1,0,0,0,0|2,0,0]=3 3407 B11R1.83 CNCc1ccc(cc1)CO 2230a_106832991635_100000067286 [0,1,0,0,0,0|2,0,0]=3 3408 B11R1.83 CNCc1ccc(cc1)CO 26a_100102657272_100000211755 [0,1,0,0,0,0|2,0,0]=3 3409 B11R1.83 CNCc1ccc(cc1)CO 270004a_106832991635_100009832023 [0,1,0,0,0,0|2,0,0]=3 3410 B11R1.83 CNCc1ccc(cc1)CO 34a_100015189231_200000210301 [0,1,0,0,0,0|2,0,0]=3 3411 B11R1.83 CNCc1ccc(cc1)CO 34a_100102657272_100000067286 [0,1,0,0,0,0|2,0,0]=3 3412 B11R1.83 CNCc1ccc(cc1)CO 7a_106832991635_100000067286 [0,1,0,0,0,0|2,0,0]=3 3413 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [0,1,0,0,0,0|2,0,0]=3 3414 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [0,1,0,0,0,0|2,0,0]=3 3415 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [0,1,0,0,0,0|2,0,0]=3 3416 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [0,1,0,0,0,0|2,0,0]=3 3417 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [0,1,0,0,0,0|2,0,0]=3 3418 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [0,1,0,0,0,0|2,0,0]=3 3419 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [0,1,0,0,0,0|2,0,0]=3 3420 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [0,1,0,0,0,0|2,0,0]=3 3421 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [0,1,0,0,0,0|2,0,0]=3 3422 B11R1.83 CNCc1ccc(cc1)SC 207a_100102657272_100000211154 [0,1,0,0,0,0|2,1,0]=4 3423 B11R1.83 CNCc1ccc(cc1)SC 2230a_100000174980_200000210301 [0,1,0,0,0,0|2,1,0]=4 3424 B11R1.83 CNCc1ccc(cc1)SC 2230a_106832991635_100000181263 [0,1,0,0,0,0|2,1,0]=4 3425 B11R1.83 CNCc1ccc(cc1)SC 26a_100102657272_100000211864 [0,1,0,0,0,0|2,1,0]=4 3426 B11R1.83 CNCc1ccc(cc1)SC 270004a_106832991635_100000211154 [0,1,0,0,0,0|2,1,0]=4 3427 B11R1.83 CNCc1ccc(cc1)SC 34a_100000174980_200000210301 [0,1,0,0,0,0|2,1,0]=4 3428 B11R1.83 CNCc1ccc(cc1)SC 34a_100102657272_100000181263 [0,1,0,0,0,0|2,1,0]=4 3429 B11R1.83 CNCc1ccc(cc1)SC 62a_100000180866_200000210301 [0,1,0,0,0,0|2,1,0]=4 3430 B11R1.83 CNCc1ccc(cc1)SC 62a_200000210301_100000180866 [0,1,0,0,0,0|2,1,0]=4 3431 B11R1.83 CNCc1ccc(cc1)SC 7a_106832991635_100000181263 [0,1,0,0,0,0|2,1,0]=4 3432 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_100000180866_200025704644 [0,1,0,0,0,0|2,1,0]=4 3433 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_200025704644_100000180866 [0,1,0,0,0,0|2,1,0]=4 3434 B11R1.83 CNCc1ccc(cn1)OC 207a_100102657272_100000701244 [0,1,0,0,0,0|3,0,0]=4 3435 B11R1.83 CNCc1ccc(cn1)OC 2230a_106832991635_200000757186 [0,1,0,0,0,0|3,0,0]=4 3436 B11R1.83 CNCc1ccc(cn1)OC 270004a_106832991635_100000701244 [0,1,0,0,0,0|3,0,0]=4 3437 B11R1.83 CNCc1ccc(cn1)OC 34a_100000703904_200000210301 [0,1,0,0,0,0|3,0,0]=4 3438 B11R1.83 CNCc1ccc(cn1)OC 34a_100102657272_200000757186 [0,1,0,0,0,0|3,0,0]=4 3439 B11R1.83 CNCc1ccc(cn1)OC 7a_106832991635_200000757186 [0,1,0,0,0,0|3,0,0]=4 3440 B11R1.83 CNCc1ccc(nc1)OC 207a_100102657272_100000761633 [0,1,0,0,0,0|3,0,0]=4 3441 B11R1.83 CNCc1ccc(nc1)OC 2230a_100000241975_200000210301 [0,1,0,0,0,0|3,0,0]=4 3442 B11R1.83 CNCc1ccc(nc1)OC 2230a_106832991635_100020631284 [0,1,0,0,0,0|3,0,0]=4 3443 B11R1.83 CNCc1ccc(nc1)OC 270004a_106832991635_100000761633 [0,1,0,0,0,0|3,0,0]=4 3444 B11R1.83 CNCc1ccc(nc1)OC 34a_100102657272_100020631284 [0,1,0,0,0,0|3,0,0]=4 3445 B11R1.83 CNCc1ccc(nc1)OC 7a_106832991635_100020631284 [0,1,0,0,0,0|3,0,0]=4 3446 B11R1.83 CNc1ccc(cc1)CCO 2230a_100011204434_200000210301 [0,1,0,0,0,0|3,0,0]=4 3447 B11R1.83 CNc1ccc(cc1)CCO 34a_100011204434_200000210301 [0,1,0,0,0,0|3,0,0]=4 3448 B11R1.83 CNc1ccc(cc1)COC 34a_100000694113_200000210301 [0,1,0,0,0,0|3,0,0]=4 3449 B11R1.83 CNc1ccc(cc1)CSC 2230a_106726388226_200000210301 [0,1,0,0,0,0|3,0,0]=4 3450 B11R1.83 CNc1ccc(cc1)CSC 34a_106726388226_200000210301 [0,1,0,0,0,0|3,0,0]=4 3451 B11R1.83 CNc1ccc(cc1)CSC 7a_106726388226_200000210301 [0,1,0,0,0,0|3,0,0]=4 3452 B11R1.83 CNc1ccc(cc1)OCF 34a_100000182112_100015361967 [0,1,0,0,0,0|2,0,0]=3 3453 B11R1.83 CNc1ccc(cc1)SCF 62a_100000743151_100015361967 [0,1,0,0,0,0|2,1,0]=4 3454 B11R1.83 CNc1ccc(cc1)SCF 62a_100015361967_100000743151 [0,1,0,0,0,0|2,1,0]=4 3455 B11R1.83 COCc1ccc(cc1)C#N 34a_100000238739_200000210301 [0,1,0,0,0,0|3,0,0]=4 3456 B11R1.83 COCc1ccc(cc1)C#N 34a_100138415774_100000184898 [0,1,0,0,0,0|3,0,0]=4 3457 B11R1.83 COCc1ccc(cc1)C#N 7a_100000238739_200000210301 [0,1,0,0,0,0|3,0,0]=4 3458 B11R1.83 COCc1ccc(cc1)C=O 34a_100138415774_100009816848 [0,1,0,0,0,0|2,0,1]=4 3459 B11R1.83 COCc1ccc(cc1)CBr 34a_100012353999_200000210301 [0,1,0,0,0,0|3,0,0]=4 3460 B11R1.83 COCc1ccc(cc1)CBr 7a_100012353999_200000210301 [0,1,0,0,0,0|3,0,0]=4 3461 B11R1.83 COCc1ccc(cc1)CCl 34a_100000067286_200000210301 [0,1,0,0,0,0|3,0,0]=4 3462 B11R1.83 COCc1ccc(cc1)CCl 7a_100000067286_200000210301 [0,1,0,0,0,0|3,0,0]=4 3463 B11R1.83 COCc1ccc(cc1)CN 34a_100015189231_200000210301 [0,1,0,0,0,0|3,0,0]=4 3464 B11R1.83 COCc1ccc(cc1)CO 34a_100138415774_100000067286 [0,1,0,0,0,0|2,0,0]=3 3465 B11R1.83 COCc1ccc(cc1)N[13CH3] 34a_100000694113_200025704644 [0,1,0,0,0,0|3,0,0]=4 3466 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [0,1,0,0,0,0|2,0,0]=3 3467 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [0,1,0,0,0,0|2,0,0]=3 3468 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [0,1,0,0,0,0|2,0,0]=3 3469 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [0,1,0,0,0,0|2,0,0]=3 3470 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [0,1,0,0,0,0|2,0,0]=3 3471 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [0,1,0,0,0,0|2,0,0]=3 3472 B11R1.83 COCc1ccc(cc1)SC 34a_100011215404_200000210301 [0,1,0,0,0,0|2,1,0]=4 3473 B11R1.83 COCc1ccc(cc1)SC 34a_100138415774_100000181263 [0,1,0,0,0,0|2,1,0]=4 3474 B11R1.83 COCc1ccc(cc1)SC 62a_100011493685_200000210301 [0,1,0,0,0,0|2,1,0]=4 3475 B11R1.83 COCc1ccc(cc1)SC 62a_200000210301_100011493685 [0,1,0,0,0,0|2,1,0]=4 3476 B11R1.83 COCc1ccc(cc1)SC 7a_100011215404_200000210301 [0,1,0,0,0,0|2,1,0]=4 3477 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_100011493685_200025704644 [0,1,0,0,0,0|2,1,0]=4 3478 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_200025704644_100011493685 [0,1,0,0,0,0|2,1,0]=4 3479 B11R1.83 COCc1ccc(cn1)OC 34a_100011998694_200000210301 [0,1,0,0,0,0|3,0,0]=4 3480 B11R1.83 COCc1ccc(cn1)OC 34a_100138415774_200000757186 [0,1,0,0,0,0|3,0,0]=4 3481 B11R1.83 COCc1ccc(nc1)OC 34a_100000763316_200000210301 [0,1,0,0,0,0|3,0,0]=4 3482 B11R1.83 COCc1ccc(nc1)OC 34a_100138415774_100020631284 [0,1,0,0,0,0|3,0,0]=4 3483 B11R1.83 COc1ccc(cc1)CC#N 34a_100000198970_200000210301 [0,1,0,0,0,0|2,0,1]=4 3484 B11R1.83 COc1ccc(cc1)CC#N 7a_100000198970_200000210301 [0,1,0,0,0,0|2,0,1]=4 3485 B11R1.83 COc1ccc(cc1)CCBr 34a_100009816426_200000210301 [0,1,0,0,0,0|2,0,0]=3 3486 B11R1.83 COc1ccc(cc1)CCBr 7a_100009816426_200000210301 [0,1,0,0,0,0|2,0,0]=3 3487 B11R1.83 COc1ccc(cc1)CCN 34a_100000743037_200000210301 [0,1,0,0,0,0|2,0,0]=3 3488 B11R1.83 COc1ccc(cc1)CCO 34a_100011215338_200000210301 [0,1,0,0,0,0|2,0,0]=3 3489 B11R1.83 COc1ccc(cc1)CCO 7a_100011215338_200000210301 [0,1,0,0,0,0|2,0,0]=3 3490 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [0,1,0,0,0,0|2,0,0]=3 3491 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [0,1,0,0,0,0|2,0,0]=3 3492 B11R1.83 COc1ccc(cc1)CSC 62a_200000210301_100000742318 [0,1,0,0,0,0|2,0,0]=3 3493 B11R1.83 COc1ccc(cc1)CS[13CH3] 62a_200025704644_100000742318 [0,1,0,0,0,0|2,0,0]=3 3494 B11R1.83 COc1ccc(cc1)NCF 34a_100000184247_100015361967 [0,1,0,0,0,0|2,0,0]=3 3495 B11R1.83 COc1ccc(cc1)OCF 34a_100000210503_100015361967 [0,1,0,0,0,0|1,0,0]=2 3496 B11R1.83 COc1ccc(cc1)SCF 62a_100015361967_100000171711 [0,1,0,0,0,0|1,1,0]=3 3497 B11R1.83 COc1ccc(cn1)CN[13CH3] 2230a_100000241975_200025704644 [0,1,0,0,0,0|3,0,0]=4 3498 B11R1.83 COc1ccc(cn1)CO[13CH3] 34a_100000763316_200025704644 [0,1,0,0,0,0|3,0,0]=4 3499 B11R1.83 COc1ccc(cn1)CSC 62a_100020631284_200000210301 [0,1,0,0,0,0|3,0,0]=4 3500 B11R1.83 COc1ccc(cn1)CSC 62a_200000210301_100020631284 [0,1,0,0,0,0|3,0,0]=4 3501 B11R1.83 COc1ccc(cn1)CS[13CH3] 62a_100020631284_200025704644 [0,1,0,0,0,0|3,0,0]=4 3502 B11R1.83 COc1ccc(cn1)CS[13CH3] 62a_200025704644_100020631284 [0,1,0,0,0,0|3,0,0]=4 3503 B11R1.83 COc1ccc(cn1)OCF 34a_100011934560_100015361967 [0,1,0,0,0,0|2,0,0]=3 3504 B11R1.83 COc1ccc(cn1)SCF 62a_100000047065_100015361967 [0,1,0,0,0,0|2,1,0]=4 3505 B11R1.83 COc1ccc(cn1)SCF 62a_100015361967_100000047065 [0,1,0,0,0,0|2,1,0]=4 3506 B11R1.83 COc1ccc(nc1)CN[13CH3] 34a_100000703904_200025704644 [0,1,0,0,0,0|3,0,0]=4 3507 B11R1.83 COc1ccc(nc1)CO[13CH3] 34a_100011998694_200025704644 [0,1,0,0,0,0|3,0,0]=4 3508 B11R1.83 COc1ccc(nc1)CSC 62a_200000210301_200000757186 [0,1,0,0,0,0|3,0,0]=4 3509 B11R1.83 COc1ccc(nc1)CSC 62a_200000757186_200000210301 [0,1,0,0,0,0|3,0,0]=4 3510 B11R1.83 COc1ccc(nc1)CS[13CH3] 62a_200000757186_200025704644 [0,1,0,0,0,0|3,0,0]=4 3511 B11R1.83 COc1ccc(nc1)CS[13CH3] 62a_200025704644_200000757186 [0,1,0,0,0,0|3,0,0]=4 3512 B11R1.83 COc1ccc(nc1)OCF 34a_100012002028_100015361967 [0,1,0,0,0,0|2,0,0]=3 3513 B11R1.83 COc1ccc(nc1)SCF 62a_100000755202_100015361967 [0,1,0,0,0,0|2,1,0]=4 3514 B11R1.83 COc1ccc(nc1)SCF 62a_100015361967_100000744180 [0,1,0,0,0,0|2,1,0]=4 3515 B11R1.83 COc1ncc(cn1)OCF 34a_100000099601_100015361967 [0,1,0,0,0,0|3,0,0]=4 3516 B11R1.83 COc1ncc(cn1)OCF 7a_100000099601_100015361967 [0,1,0,0,0,0|3,0,0]=4 3517 B11R1.83 CSCc1ccc(cc1)C#N 62a_200000210301_100000184898 [0,1,0,0,0,0|3,0,0]=4 3518 B11R1.83 CSCc1ccc(cc1)C=O 62a_100009816848_200000210301 [0,1,0,0,0,0|2,0,1]=4 3519 B11R1.83 CSCc1ccc(cc1)C=O 62a_200000210301_100009816848 [0,1,0,0,0,0|2,0,1]=4 3520 B11R1.83 CSCc1ccc(cc1)CO 62a_100000067286_200000210301 [0,1,0,0,0,0|2,0,0]=3 3521 B11R1.83 CSCc1ccc(cc1)CO 62a_200000210301_100000067286 [0,1,0,0,0,0|2,0,0]=3 3522 B11R1.83 CSCc1ccc(cc1)N[13CH3] 2230a_106726388226_200025704644 [0,1,0,0,0,0|3,0,0]=4 3523 B11R1.83 CSCc1ccc(cc1)N[13CH3] 34a_106726388226_200025704644 [0,1,0,0,0,0|3,0,0]=4 3524 B11R1.83 CSCc1ccc(cc1)N[13CH3] 7a_106726388226_200025704644 [0,1,0,0,0,0|3,0,0]=4 3525 B11R1.83 CSCc1ccc(cc1)SC 62a_100000181263_200000210301 [0,1,0,0,0,0|2,1,0]=4 3526 B11R1.83 CSCc1ccc(cc1)SC 62a_200000210301_100000181263 [0,1,0,0,0,0|2,1,0]=4 3527 B11R1.83 CSc1ccc(cc1)CCN 62a_100000755846_200000210301 [0,1,0,0,0,0|2,1,0]=4 3528 B11R1.83 CSc1ccc(cc1)CCN 62a_200000210301_100000755846 [0,1,0,0,0,0|2,1,0]=4 3529 B11R1.83 CSc1ccc(cc1)CCO 62a_100000766406_200000210301 [0,1,0,0,0,0|2,1,0]=4 3530 B11R1.83 CSc1ccc(cc1)CCO 62a_200000210301_100000766406 [0,1,0,0,0,0|2,1,0]=4 3531 B11R1.83 CSc1ccc(cc1)CN[13CH3] 2230a_100000174980_200025704644 [0,1,0,0,0,0|2,1,0]=4 3532 B11R1.83 CSc1ccc(cc1)CN[13CH3] 34a_100000174980_200025704644 [0,1,0,0,0,0|2,1,0]=4 3533 B11R1.83 CSc1ccc(cc1)CO[13CH3] 34a_100011215404_200025704644 [0,1,0,0,0,0|2,1,0]=4 3534 B11R1.83 CSc1ccc(cc1)CO[13CH3] 7a_100011215404_200025704644 [0,1,0,0,0,0|2,1,0]=4 3535 B11R1.83 CSc1ccc(cc1)CS[13CH3] 62a_100000181263_200025704644 [0,1,0,0,0,0|2,1,0]=4 3536 B11R1.83 CSc1ccc(cc1)CS[13CH3] 62a_200025704644_100000181263 [0,1,0,0,0,0|2,1,0]=4 3537 B11R1.83 CSc1ccc(cc1)NCF 34a_100000212337_100015361967 [0,1,0,0,0,0|2,1,0]=4 3538 B11R1.83 CSc1ccc(cc1)OCF 34a_100000211864_100015361967 [0,1,0,0,0,0|1,1,0]=3 3539 B11R1.83 CSc1ccc(cc1)SCF 62a_100011263217_100015361967 [0,1,0,0,0,0|1,2,0]=4 3540 B11R1.83 CSc1ccc(cc1)SCF 62a_100015361967_100011263217 [0,1,0,0,0,0|1,2,0]=4 3541 B11R1.83 FCSc1ccc(cc1)CF 62a_100010268989_100015361967 [0,1,0,0,0,0|2,1,0]=4 3542 B11R1.83 FCSc1ccc(cc1)CF 62a_100015361967_100010268989 [0,1,0,0,0,0|2,1,0]=4 3543 B11R1.83 N#Cc1ccc(cc1)NCF 34a_100000185469_100015361967 [0,1,0,0,0,0|3,0,0]=4 3544 B11R1.83 N#Cc1ccc(cc1)OCF 34a_100000210344_100015361967 [0,1,0,0,0,0|2,0,0]=3 3545 B11R1.83 N#Cc1ccc(cc1)OCF 7a_100000210344_100015361967 [0,1,0,0,0,0|2,0,0]=3 3546 B11R1.83 N#Cc1ccc(cc1)SCF 62a_100015361967_100000184291 [0,1,0,0,0,0|2,1,0]=4 3547 B11R1.83 N#Cc1ccc(cn1)OCF 34a_100011934750_100015361967 [0,1,0,0,0,0|3,0,0]=4 3548 B11R1.83 N#Cc1ccc(cn1)OCF 7a_100011934750_100015361967 [0,1,0,0,0,0|3,0,0]=4 3549 B11R1.83 NCc1ccc(cc1)OCF 34a_100000185549_100015361967 [0,1,0,0,0,0|2,0,0]=3 3550 B11R1.83 NCc1ccc(cc1)SCF 62a_100015361967_100016989417 [0,1,0,0,0,0|2,1,0]=4 3551 B11R1.83 NCc1ccc(cc1)SCF 62a_100016989417_100015361967 [0,1,0,0,0,0|2,1,0]=4 3552 B11R1.83 NCc1ccc(cn1)OCF 34a_100020605196_100015361967 [0,1,0,0,0,0|3,0,0]=4 3553 B11R1.83 NCc1ccc(nc1)OCF 34a_100000757128_100015361967 [0,1,0,0,0,0|3,0,0]=4 3554 B11R1.83 NNc1ccc(cc1)SCF 62a_100015361967_100016988836 [0,1,0,0,0,0|2,1,0]=4 3555 B11R1.83 NNc1ccc(cc1)SCF 62a_100016988836_100015361967 [0,1,0,0,0,0|2,1,0]=4 3556 B11R1.83 O=Cc1ccc(cc1)SCF 62a_100000188517_100015361967 [0,1,0,0,0,0|1,1,1]=4 3557 B11R1.83 O=Cc1ccc(cc1)SCF 62a_100015361967_100000188517 [0,1,0,0,0,0|1,1,1]=4 3558 B11R1.83 OCc1ccc(cc1)NCF 34a_100011215238_100015361967 [0,1,0,0,0,0|2,0,0]=3 3559 B11R1.83 OCc1ccc(cc1)OCF 34a_100000211755_100015361967 [0,1,0,0,0,0|1,0,0]=2 3560 B11R1.83 OCc1ccc(cc1)SCF 62a_100000690907_100015361967 [0,1,0,0,0,0|1,1,0]=3 3561 B11R1.83 OCc1ccc(cc1)SCF 62a_100015361967_100000690907 [0,1,0,0,0,0|1,1,0]=3 3562 B11R1.83 OCc1ccc(cn1)OCF 34a_103436540053_100015361967 [0,1,0,0,0,0|2,0,0]=3 3563 B11R1.83 OCc1ccc(cn1)SCF 62a_100000754261_100015361967 [0,1,0,0,0,0|2,1,0]=4 3564 B11R1.83 OCc1ccc(cn1)SCF 62a_100015361967_100000754261 [0,1,0,0,0,0|2,1,0]=4 3565 B11R1.83 OCc1ccc(nc1)SCF 62a_100009816760_100015361967 [0,1,0,0,0,0|2,1,0]=4 3566 B11R1.83 OCc1ccc(nc1)SCF 62a_100015361967_100009816760 [0,1,0,0,0,0|2,1,0]=4 3567 B11R1.83 [13CH3]NCc1ccc(cc1)C#N 34a_100015207190_200025704644 [0,1,0,0,0,0|3,0,0]=4 3568 B11R1.83 [13CH3]NCc1ccc(cc1)CO 2230a_100015189231_200025704644 [0,1,0,0,0,0|2,0,0]=3 3569 B11R1.83 [13CH3]NCc1ccc(cc1)CO 34a_100015189231_200025704644 [0,1,0,0,0,0|2,0,0]=3 3570 B11R1.83 [13CH3]Nc1ccc(cc1)CCO 2230a_100011204434_200025704644 [0,1,0,0,0,0|3,0,0]=4 3571 B11R1.83 [13CH3]Nc1ccc(cc1)CCO 34a_100011204434_200025704644 [0,1,0,0,0,0|3,0,0]=4 3572 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 34a_100000238739_200025704644 [0,1,0,0,0,0|3,0,0]=4 3573 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 7a_100000238739_200025704644 [0,1,0,0,0,0|3,0,0]=4 3574 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 34a_100012353999_200025704644 [0,1,0,0,0,0|3,0,0]=4 3575 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 7a_100012353999_200025704644 [0,1,0,0,0,0|3,0,0]=4 3576 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 34a_100000067286_200025704644 [0,1,0,0,0,0|3,0,0]=4 3577 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 7a_100000067286_200025704644 [0,1,0,0,0,0|3,0,0]=4 3578 B11R1.83 [13CH3]OCc1ccc(cc1)CN 34a_100015189231_200025704644 [0,1,0,0,0,0|3,0,0]=4 3579 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 34a_100000198970_200025704644 [0,1,0,0,0,0|2,0,1]=4 3580 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 7a_100000198970_200025704644 [0,1,0,0,0,0|2,0,1]=4 3581 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 34a_100009816426_200025704644 [0,1,0,0,0,0|2,0,0]=3 3582 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 7a_100009816426_200025704644 [0,1,0,0,0,0|2,0,0]=3 3583 B11R1.83 [13CH3]Oc1ccc(cc1)CCN 34a_100000743037_200025704644 [0,1,0,0,0,0|2,0,0]=3 3584 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 34a_100011215338_200025704644 [0,1,0,0,0,0|2,0,0]=3 3585 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 7a_100011215338_200025704644 [0,1,0,0,0,0|2,0,0]=3 3586 B11R1.83 [13CH3]SCc1ccc(cc1)C#N 62a_200025704644_100000184898 [0,1,0,0,0,0|3,0,0]=4 3587 B11R1.83 [13CH3]SCc1ccc(cc1)C=O 62a_100009816848_200025704644 [0,1,0,0,0,0|2,0,1]=4 3588 B11R1.83 [13CH3]SCc1ccc(cc1)C=O 62a_200025704644_100009816848 [0,1,0,0,0,0|2,0,1]=4 3589 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_100000067286_200025704644 [0,1,0,0,0,0|2,0,0]=3 3590 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_200025704644_100000067286 [0,1,0,0,0,0|2,0,0]=3 3591 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_100000755846_200025704644 [0,1,0,0,0,0|2,1,0]=4 3592 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_200025704644_100000755846 [0,1,0,0,0,0|2,1,0]=4 3593 B11R1.83 [13CH3]Sc1ccc(cc1)CCO 62a_100000766406_200025704644 [0,1,0,0,0,0|2,1,0]=4 3594 B11R1.83 [13CH3]Sc1ccc(cc1)CCO 62a_200025704644_100000766406 [0,1,0,0,0,0|2,1,0]=4 3595 B11R1.192 C=C=Cc1ccc(c(c1)Br)O 271570a_100015277604_100012361655 [0,1,0,0,0,0|1,0,2]=4 3596 B11R1.192 C=C=Cc1ccc(c(c1)C)O 271570a_100015277604_100000186361 [0,1,0,0,0,0|1,0,2]=4 3597 B11R1.192 C=C=Cc1ccc(c(c1)Cl)O 271570a_100015277604_100012360047 [0,1,0,0,0,0|1,0,2]=4 3598 B11R1.192 C=C=Cc1ccc(c(c1)F)O 271570a_100015277604_100000185481 [0,1,0,0,0,0|1,0,2]=4 3599 B11R1.192 C=C=Cc1ccc(c(c1)N)O 271570a_100015277604_100000752626 [0,1,0,0,0,0|1,0,2]=4 3600 B11R1.192 C=C=Cc1ccc(c(c1)O)O 271570a_100015277604_100009813601 [0,1,0,0,0,0|1,0,2]=4 3601 B11R1.192 CC=Cc1cc(c(cn1)O)C 271570a_100016259895_100000692680 [0,1,0,0,0,0|2,0,1]=4 3602 B11R1.192 CC=Cc1cc(c(cn1)O)N 271570a_100016259895_100009819941 [0,1,0,0,0,0|2,0,1]=4 3603 B11R1.192 CC=Cc1ccc(c(c1)Br)Br 271570a_100016259895_100012356285 [0,1,0,0,0,0|2,0,1]=4 3604 B11R1.192 CC=Cc1ccc(c(c1)Br)C 271570a_100016259895_100011847877 [0,1,0,0,0,0|2,0,1]=4 3605 B11R1.192 CC=Cc1ccc(c(c1)Br)Cl 271570a_100016259895_100012353702 [0,1,0,0,0,0|2,0,1]=4 3606 B11R1.192 CC=Cc1ccc(c(c1)Br)F 271570a_100016259895_100012047266 [0,1,0,0,0,0|2,0,1]=4 3607 B11R1.192 CC=Cc1ccc(c(c1)Br)N 271570a_100016259895_100000750455 [0,1,0,0,0,0|2,0,1]=4 3608 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [0,1,0,0,0,0|1,0,1]=3 3609 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [0,1,0,0,0,0|2,0,1]=4 3610 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [0,1,0,0,0,0|2,0,1]=4 3611 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [0,1,0,0,0,0|2,0,1]=4 3612 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [0,1,0,0,0,0|2,0,1]=4 3613 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [0,1,0,0,0,0|2,0,1]=4 3614 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [0,1,0,0,0,0|1,0,1]=3 3615 B11R1.192 CC=Cc1ccc(c(c1)Cl)Br 271570a_100016259895_100012047281 [0,1,0,0,0,0|2,0,1]=4 3616 B11R1.192 CC=Cc1ccc(c(c1)Cl)C 271570a_100016259895_100011216363 [0,1,0,0,0,0|2,0,1]=4 3617 B11R1.192 CC=Cc1ccc(c(c1)Cl)Cl 271570a_100016259895_100011214914 [0,1,0,0,0,0|2,0,1]=4 3618 B11R1.192 CC=Cc1ccc(c(c1)Cl)F 271570a_100016259895_100011215976 [0,1,0,0,0,0|2,0,1]=4 3619 B11R1.192 CC=Cc1ccc(c(c1)Cl)N 271570a_100016259895_100011218065 [0,1,0,0,0,0|2,0,1]=4 3620 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [0,1,0,0,0,0|1,0,1]=3 3621 B11R1.192 CC=Cc1ccc(c(c1)F)Br 271570a_100016259895_100000685389 [0,1,0,0,0,0|2,0,1]=4 3622 B11R1.192 CC=Cc1ccc(c(c1)F)C 271570a_100016259895_100000720648 [0,1,0,0,0,0|2,0,1]=4 3623 B11R1.192 CC=Cc1ccc(c(c1)F)Cl 271570a_100016259895_100011216805 [0,1,0,0,0,0|2,0,1]=4 3624 B11R1.192 CC=Cc1ccc(c(c1)F)F 271570a_100016259895_100000750028 [0,1,0,0,0,0|2,0,1]=4 3625 B11R1.192 CC=Cc1ccc(c(c1)F)N 271570a_100016259895_100011215594 [0,1,0,0,0,0|2,0,1]=4 3626 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [0,1,0,0,0,0|1,0,1]=3 3627 B11R1.192 CC=Cc1ccc(c(c1)N)Br 271570a_100016259895_100000750456 [0,1,0,0,0,0|2,0,1]=4 3628 B11R1.192 CC=Cc1ccc(c(c1)N)C 271570a_100016259895_100000761890 [0,1,0,0,0,0|2,0,1]=4 3629 B11R1.192 CC=Cc1ccc(c(c1)N)Cl 271570a_100016259895_200000761891 [0,1,0,0,0,0|2,0,1]=4 3630 B11R1.192 CC=Cc1ccc(c(c1)N)F 271570a_100016259895_100000740924 [0,1,0,0,0,0|2,0,1]=4 3631 B11R1.192 CC=Cc1ccc(c(c1)N)N 271570a_100016259895_100000741789 [0,1,0,0,0,0|2,0,1]=4 3632 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [0,1,0,0,0,0|1,0,1]=3 3633 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [0,1,0,0,0,0|2,0,1]=4 3634 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [0,1,0,0,0,0|2,0,1]=4 3635 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [0,1,0,0,0,0|2,0,1]=4 3636 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [0,1,0,0,0,0|2,0,1]=4 3637 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [0,1,0,0,0,0|2,0,1]=4 3638 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [0,1,0,0,0,0|1,0,1]=3 3639 B11R1.192 CC=Cc1ccc(c(n1)Br)O 271570a_100016259895_100000725334 [0,1,0,0,0,0|2,0,1]=4 3640 B11R1.192 CC=Cc1ccc(c(n1)C)O 271570a_100016259895_100010233687 [0,1,0,0,0,0|2,0,1]=4 3641 B11R1.192 CC=Cc1ccc(c(n1)Cl)O 271570a_100016259895_100000721234 [0,1,0,0,0,0|2,0,1]=4 3642 B11R1.192 CC=Cc1ccc(c(n1)F)O 271570a_100016259895_100009819667 [0,1,0,0,0,0|2,0,1]=4 3643 B11R1.192 CC=Cc1ccc(c(n1)N)O 271570a_100016259895_100000685527 [0,1,0,0,0,0|2,0,1]=4 3644 B11R1.192 CC=Cc1cnc(c(c1)C)O 271570a_100016259895_100000685391 [0,1,0,0,0,0|2,0,1]=4 3645 B11R1.192 CC=Cc1cnc(c(c1)Cl)O 271570a_100016259895_100010238531 [0,1,0,0,0,0|2,0,1]=4 3646 B11R1.192 CC=Cc1cnc(c(c1)N)O 271570a_100016259895_100000743729 [0,1,0,0,0,0|2,0,1]=4 3647 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [0,1,0,0,0,0|1,0,0]=2 3648 B11R1.192 CCNc1cc(c(cn1)C)F 27a_100015525214_100009841206 [0,1,0,0,0,0|3,0,0]=4 3649 B11R1.192 CCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210202 [0,1,0,0,0,0|2,0,0]=3 3650 B11R1.192 CCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210202 [0,1,0,0,0,0|2,0,0]=3 3651 B11R1.192 CCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210202 [0,1,0,0,0,0|2,0,0]=3 3652 B11R1.192 CCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210202 [0,1,0,0,0,0|2,0,0]=3 3653 B11R1.192 CCNc1ccc(c(c1)Br)C 34a_100000736455_100000210202 [0,1,0,0,0,0|2,0,0]=3 3654 B11R1.192 CCNc1ccc(c(c1)Br)C 7a_100000736455_100000210202 [0,1,0,0,0,0|2,0,0]=3 3655 B11R1.192 CCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210202 [0,1,0,0,0,0|2,0,0]=3 3656 B11R1.192 CCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210202 [0,1,0,0,0,0|2,0,0]=3 3657 B11R1.192 CCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210202 [0,1,0,0,0,0|2,0,0]=3 3658 B11R1.192 CCNc1ccc(c(c1)Br)F 34a_100000760356_100000210202 [0,1,0,0,0,0|2,0,0]=3 3659 B11R1.192 CCNc1ccc(c(c1)Br)F 7a_100000760356_100000210202 [0,1,0,0,0,0|2,0,0]=3 3660 B11R1.192 CCNc1ccc(c(c1)Br)I 34a_100000750458_100000210202 [0,1,0,0,0,0|2,0,0]=3 3661 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [0,1,0,0,0,0|1,0,0]=2 3662 B11R1.192 CCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210202 [0,1,0,0,0,0|2,0,0]=3 3663 B11R1.192 CCNc1ccc(c(c1)C)Br 34a_100000210723_100000210202 [0,1,0,0,0,0|2,0,0]=3 3664 B11R1.192 CCNc1ccc(c(c1)C)Br 7a_100000210723_100000210202 [0,1,0,0,0,0|2,0,0]=3 3665 B11R1.192 CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210202 [0,1,0,0,0,0|2,0,0]=3 3666 B11R1.192 CCNc1ccc(c(c1)C)C 34a_100000724040_100000210202 [0,1,0,0,0,0|2,0,0]=3 3667 B11R1.192 CCNc1ccc(c(c1)C)C 7a_100000724040_100000210202 [0,1,0,0,0,0|2,0,0]=3 3668 B11R1.192 CCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210202 [0,1,0,0,0,0|2,0,0]=3 3669 B11R1.192 CCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210202 [0,1,0,0,0,0|2,0,0]=3 3670 B11R1.192 CCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210202 [0,1,0,0,0,0|2,0,0]=3 3671 B11R1.192 CCNc1ccc(c(c1)C)F 2230a_100000750164_100000210202 [0,1,0,0,0,0|2,0,0]=3 3672 B11R1.192 CCNc1ccc(c(c1)C)F 34a_100000750164_100000210202 [0,1,0,0,0,0|2,0,0]=3 3673 B11R1.192 CCNc1ccc(c(c1)C)F 7a_100000750164_100000210202 [0,1,0,0,0,0|2,0,0]=3 3674 B11R1.192 CCNc1ccc(c(c1)C)I 34a_100000198070_100000210202 [0,1,0,0,0,0|2,0,0]=3 3675 B11R1.192 CCNc1ccc(c(c1)C)I 7a_100000198070_100000210202 [0,1,0,0,0,0|2,0,0]=3 3676 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [0,1,0,0,0,0|1,0,0]=2 3677 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [0,1,0,0,0,0|1,0,0]=2 3678 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [0,1,0,0,0,0|1,0,0]=2 3679 B11R1.192 CCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210202 [0,1,0,0,0,0|2,0,0]=3 3680 B11R1.192 CCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210202 [0,1,0,0,0,0|2,0,0]=3 3681 B11R1.192 CCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210202 [0,1,0,0,0,0|2,0,0]=3 3682 B11R1.192 CCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210202 [0,1,0,0,0,0|2,0,0]=3 3683 B11R1.192 CCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210202 [0,1,0,0,0,0|2,0,0]=3 3684 B11R1.192 CCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210202 [0,1,0,0,0,0|2,0,0]=3 3685 B11R1.192 CCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210202 [0,1,0,0,0,0|2,0,0]=3 3686 B11R1.192 CCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210202 [0,1,0,0,0,0|2,0,0]=3 3687 B11R1.192 CCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210202 [0,1,0,0,0,0|2,0,0]=3 3688 B11R1.192 CCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210202 [0,1,0,0,0,0|2,0,0]=3 3689 B11R1.192 CCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210202 [0,1,0,0,0,0|2,0,0]=3 3690 B11R1.192 CCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210202 [0,1,0,0,0,0|2,0,0]=3 3691 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [0,1,0,0,0,0|1,0,0]=2 3692 B11R1.192 CCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210202 [0,1,0,0,0,0|2,0,0]=3 3693 B11R1.192 CCNc1ccc(c(c1)F)Br 34a_100000759894_100000210202 [0,1,0,0,0,0|2,0,0]=3 3694 B11R1.192 CCNc1ccc(c(c1)F)Br 7a_100000759894_100000210202 [0,1,0,0,0,0|2,0,0]=3 3695 B11R1.192 CCNc1ccc(c(c1)F)C 2230a_100000210958_100000210202 [0,1,0,0,0,0|2,0,0]=3 3696 B11R1.192 CCNc1ccc(c(c1)F)C 34a_100000210958_100000210202 [0,1,0,0,0,0|2,0,0]=3 3697 B11R1.192 CCNc1ccc(c(c1)F)C 7a_100000210958_100000210202 [0,1,0,0,0,0|2,0,0]=3 3698 B11R1.192 CCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210202 [0,1,0,0,0,0|2,0,0]=3 3699 B11R1.192 CCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210202 [0,1,0,0,0,0|2,0,0]=3 3700 B11R1.192 CCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210202 [0,1,0,0,0,0|2,0,0]=3 3701 B11R1.192 CCNc1ccc(c(c1)F)F 2230a_100000210724_100000210202 [0,1,0,0,0,0|2,0,0]=3 3702 B11R1.192 CCNc1ccc(c(c1)F)F 34a_100000210724_100000210202 [0,1,0,0,0,0|2,0,0]=3 3703 B11R1.192 CCNc1ccc(c(c1)F)F 7a_100000210724_100000210202 [0,1,0,0,0,0|2,0,0]=3 3704 B11R1.192 CCNc1ccc(c(c1)F)I 34a_100011356925_100000210202 [0,1,0,0,0,0|2,0,0]=3 3705 B11R1.192 CCNc1ccc(c(c1)F)I 7a_100011356925_100000210202 [0,1,0,0,0,0|2,0,0]=3 3706 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [0,1,0,0,0,0|1,0,0]=2 3707 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [0,1,0,0,0,0|1,0,0]=2 3708 B11R1.192 CCNc1ccc(c(c1)I)Br 34a_100000750459_100000210202 [0,1,0,0,0,0|2,0,0]=3 3709 B11R1.192 CCNc1ccc(c(c1)I)C 34a_100000184131_100000210202 [0,1,0,0,0,0|2,0,0]=3 3710 B11R1.192 CCNc1ccc(c(c1)I)C 7a_100000184131_100000210202 [0,1,0,0,0,0|2,0,0]=3 3711 B11R1.192 CCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210202 [0,1,0,0,0,0|2,0,0]=3 3712 B11R1.192 CCNc1ccc(c(c1)I)F 34a_114828291077_100000210202 [0,1,0,0,0,0|2,0,0]=3 3713 B11R1.192 CCNc1ccc(c(c1)I)F 7a_114828291077_100000210202 [0,1,0,0,0,0|2,0,0]=3 3714 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [0,1,0,0,0,0|2,0,0]=3 3715 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [0,1,0,0,0,0|2,0,0]=3 3716 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [0,1,0,0,0,0|2,0,0]=3 3717 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [0,1,0,0,0,0|2,0,0]=3 3718 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [0,1,0,0,0,0|2,0,0]=3 3719 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [0,1,0,0,0,0|1,0,0]=2 3720 B11R1.192 CCNc1ccc(c(n1)F)Br 27a_100015525214_100010134343 [0,1,0,0,0,0|3,0,0]=4 3721 B11R1.192 CCNc1ccn(c(=O)c1)C 27a_100015525214_100009820031 [0,1,0,0,0,0|3,0,0]=4 3722 B11R1.192 CCOc1cc(c(cn1)Br)C 34a_100000766222_100000210202 [0,1,0,0,0,0|2,0,0]=3 3723 B11R1.192 CCOc1cc(c(cn1)Br)Cl 34a_100010369989_100000210202 [0,1,0,0,0,0|2,0,0]=3 3724 B11R1.192 CCOc1cc(c(cn1)C)Br 34a_100009831917_100000210202 [0,1,0,0,0,0|2,0,0]=3 3725 B11R1.192 CCOc1cc(c(cn1)Cl)C 34a_200000085746_100000210202 [0,1,0,0,0,0|2,0,0]=3 3726 B11R1.192 CCOc1cc(c(cn1)Cl)Cl 34a_200000099200_100000210202 [0,1,0,0,0,0|2,0,0]=3 3727 B11R1.192 CCOc1cc(c(cn1)O)C 271570a_203496583355_200012351029 [0,1,0,0,0,0|1,0,0]=2 3728 B11R1.192 CCOc1ccc(c(c1)Br)C 34a_100011380479_100000210202 [0,1,0,0,0,0|1,0,0]=2 3729 B11R1.192 CCOc1ccc(c(c1)Br)C 7a_100011380479_100000210202 [0,1,0,0,0,0|1,0,0]=2 3730 B11R1.192 CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210202 [0,1,0,0,0,0|1,0,0]=2 3731 B11R1.192 CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210202 [0,1,0,0,0,0|1,0,0]=2 3732 B11R1.192 CCOc1ccc(c(c1)Br)F 34a_100000693481_100000210202 [0,1,0,0,0,0|1,0,0]=2 3733 B11R1.192 CCOc1ccc(c(c1)Br)F 7a_100000693481_100000210202 [0,1,0,0,0,0|1,0,0]=2 3734 B11R1.192 CCOc1ccc(c(c1)Br)I 34a_100000701344_100000210202 [0,1,0,0,0,0|1,0,0]=2 3735 B11R1.192 CCOc1ccc(c(c1)Br)I 7a_100000701344_100000210202 [0,1,0,0,0,0|1,0,0]=2 3736 B11R1.192 CCOc1ccc(c(c1)Br)N 34a_100012001276_100000210202 [0,1,0,0,0,0|1,0,0]=2 3737 B11R1.192 CCOc1ccc(c(c1)Br)N 7a_100012001276_100000210202 [0,1,0,0,0,0|1,0,0]=2 3738 B11R1.192 CCOc1ccc(c(c1)C)Br 34a_100000690111_100000210202 [0,1,0,0,0,0|1,0,0]=2 3739 B11R1.192 CCOc1ccc(c(c1)C)Br 7a_100000690111_100000210202 [0,1,0,0,0,0|1,0,0]=2 3740 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [0,1,0,0,0,0|1,0,0]=2 3741 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [0,1,0,0,0,0|1,0,0]=2 3742 B11R1.192 CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210202 [0,1,0,0,0,0|1,0,0]=2 3743 B11R1.192 CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210202 [0,1,0,0,0,0|1,0,0]=2 3744 B11R1.192 CCOc1ccc(c(c1)C)F 34a_100000751312_100000210202 [0,1,0,0,0,0|1,0,0]=2 3745 B11R1.192 CCOc1ccc(c(c1)C)F 7a_100000751312_100000210202 [0,1,0,0,0,0|1,0,0]=2 3746 B11R1.192 CCOc1ccc(c(c1)C)I 34a_100000729255_100000210202 [0,1,0,0,0,0|1,0,0]=2 3747 B11R1.192 CCOc1ccc(c(c1)C)I 7a_100000729255_100000210202 [0,1,0,0,0,0|1,0,0]=2 3748 B11R1.192 CCOc1ccc(c(c1)C)N 34a_100000756630_100000210202 [0,1,0,0,0,0|1,0,0]=2 3749 B11R1.192 CCOc1ccc(c(c1)C)N 7a_100000756630_100000210202 [0,1,0,0,0,0|1,0,0]=2 3750 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [0,1,0,0,0,0|0,0,0]=1 3751 B11R1.192 CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210202 [0,1,0,0,0,0|1,0,0]=2 3752 B11R1.192 CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210202 [0,1,0,0,0,0|1,0,0]=2 3753 B11R1.192 CCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210202 [0,1,0,0,0,0|1,0,0]=2 3754 B11R1.192 CCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210202 [0,1,0,0,0,0|1,0,0]=2 3755 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210202 [0,1,0,0,0,0|1,0,0]=2 3756 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210202 [0,1,0,0,0,0|1,0,0]=2 3757 B11R1.192 CCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210202 [0,1,0,0,0,0|1,0,0]=2 3758 B11R1.192 CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210202 [0,1,0,0,0,0|1,0,0]=2 3759 B11R1.192 CCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210202 [0,1,0,0,0,0|1,0,0]=2 3760 B11R1.192 CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210202 [0,1,0,0,0,0|1,0,0]=2 3761 B11R1.192 CCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210202 [0,1,0,0,0,0|1,0,0]=2 3762 B11R1.192 CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210202 [0,1,0,0,0,0|1,0,0]=2 3763 B11R1.192 CCOc1ccc(c(c1)F)Br 34a_100000755031_100000210202 [0,1,0,0,0,0|1,0,0]=2 3764 B11R1.192 CCOc1ccc(c(c1)F)Br 7a_100000755031_100000210202 [0,1,0,0,0,0|1,0,0]=2 3765 B11R1.192 CCOc1ccc(c(c1)F)C 34a_100000722560_100000210202 [0,1,0,0,0,0|1,0,0]=2 3766 B11R1.192 CCOc1ccc(c(c1)F)C 7a_100000722560_100000210202 [0,1,0,0,0,0|1,0,0]=2 3767 B11R1.192 CCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210202 [0,1,0,0,0,0|1,0,0]=2 3768 B11R1.192 CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210202 [0,1,0,0,0,0|1,0,0]=2 3769 B11R1.192 CCOc1ccc(c(c1)F)F 34a_100000181275_100000210202 [0,1,0,0,0,0|1,0,0]=2 3770 B11R1.192 CCOc1ccc(c(c1)F)F 7a_100000181275_100000210202 [0,1,0,0,0,0|1,0,0]=2 3771 B11R1.192 CCOc1ccc(c(c1)F)I 34a_100009990212_100000210202 [0,1,0,0,0,0|1,0,0]=2 3772 B11R1.192 CCOc1ccc(c(c1)F)I 7a_100009990212_100000210202 [0,1,0,0,0,0|1,0,0]=2 3773 B11R1.192 CCOc1ccc(c(c1)F)N 34a_100000759473_100000210202 [0,1,0,0,0,0|1,0,0]=2 3774 B11R1.192 CCOc1ccc(c(c1)F)N 7a_100000759473_100000210202 [0,1,0,0,0,0|1,0,0]=2 3775 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [0,1,0,0,0,0|0,0,0]=1 3776 B11R1.192 CCOc1ccc(c(c1)I)Br 34a_100012339312_100000210202 [0,1,0,0,0,0|1,0,0]=2 3777 B11R1.192 CCOc1ccc(c(c1)I)Br 7a_100012339312_100000210202 [0,1,0,0,0,0|1,0,0]=2 3778 B11R1.192 CCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210202 [0,1,0,0,0,0|1,0,0]=2 3779 B11R1.192 CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210202 [0,1,0,0,0,0|1,0,0]=2 3780 B11R1.192 CCOc1ccc(c(c1)I)N 34a_100010084370_100000210202 [0,1,0,0,0,0|1,0,0]=2 3781 B11R1.192 CCOc1ccc(c(c1)I)N 7a_100010084370_100000210202 [0,1,0,0,0,0|1,0,0]=2 3782 B11R1.192 CCOc1ccc(c(c1)N)Br 34a_100011999798_100000210202 [0,1,0,0,0,0|1,0,0]=2 3783 B11R1.192 CCOc1ccc(c(c1)N)Br 7a_100011999798_100000210202 [0,1,0,0,0,0|1,0,0]=2 3784 B11R1.192 CCOc1ccc(c(c1)N)C 34a_100011216113_100000210202 [0,1,0,0,0,0|1,0,0]=2 3785 B11R1.192 CCOc1ccc(c(c1)N)C 7a_100011216113_100000210202 [0,1,0,0,0,0|1,0,0]=2 3786 B11R1.192 CCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210202 [0,1,0,0,0,0|1,0,0]=2 3787 B11R1.192 CCOc1ccc(c(c1)N)F 34a_100012017239_100000210202 [0,1,0,0,0,0|1,0,0]=2 3788 B11R1.192 CCOc1ccc(c(c1)N)F 7a_100012017239_100000210202 [0,1,0,0,0,0|1,0,0]=2 3789 B11R1.192 CCOc1ccc(c(c1)N)N 34a_100025771000_100000210202 [0,1,0,0,0,0|1,0,0]=2 3790 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [0,1,0,0,0,0|1,0,0]=2 3791 B11R1.192 CCOc1ccc(c(n1)C)Br 34a_100000691680_100000210202 [0,1,0,0,0,0|2,0,0]=3 3792 B11R1.192 CCOc1ccc(c(n1)C)Cl 34a_200009863735_100000210202 [0,1,0,0,0,0|2,0,0]=3 3793 B11R1.192 CCOc1ccc(c(n1)F)Br 34a_100009879308_100000210202 [0,1,0,0,0,0|2,0,0]=3 3794 B11R1.192 CCOc1cnc(c(c1)Br)C 34a_100009819603_100000210202 [0,1,0,0,0,0|2,0,0]=3 3795 B11R1.192 CCOc1cnc(c(c1)Br)C 7a_100009819603_100000210202 [0,1,0,0,0,0|2,0,0]=3 3796 B11R1.192 CCOc1cnc(c(c1)Br)Cl 34a_100012356455_100000210202 [0,1,0,0,0,0|2,0,0]=3 3797 B11R1.192 CCOc1cnc(c(c1)Br)Cl 7a_100012356455_100000210202 [0,1,0,0,0,0|2,0,0]=3 3798 B11R1.192 CCOc1cnc(c(c1)Br)F 34a_100009817267_100000210202 [0,1,0,0,0,0|2,0,0]=3 3799 B11R1.192 CCOc1cnc(c(c1)Br)F 7a_100009817267_100000210202 [0,1,0,0,0,0|2,0,0]=3 3800 B11R1.192 CCOc1cnc(c(c1)C)Br 34a_100012000486_100000210202 [0,1,0,0,0,0|2,0,0]=3 3801 B11R1.192 CCOc1cnc(c(c1)C)Br 7a_100012000486_100000210202 [0,1,0,0,0,0|2,0,0]=3 3802 B11R1.192 CCOc1cnc(c(c1)C)C 34a_100009854398_100000210202 [0,1,0,0,0,0|2,0,0]=3 3803 B11R1.192 CCOc1cnc(c(c1)C)C 7a_100009854398_100000210202 [0,1,0,0,0,0|2,0,0]=3 3804 B11R1.192 CCOc1cnc(c(c1)C)Cl 34a_100012002680_100000210202 [0,1,0,0,0,0|2,0,0]=3 3805 B11R1.192 CCOc1cnc(c(c1)C)Cl 7a_100012002680_100000210202 [0,1,0,0,0,0|2,0,0]=3 3806 B11R1.192 CCOc1cnc(c(c1)C)F 34a_100000094615_100000210202 [0,1,0,0,0,0|2,0,0]=3 3807 B11R1.192 CCOc1cnc(c(c1)C)F 7a_100000094615_100000210202 [0,1,0,0,0,0|2,0,0]=3 3808 B11R1.192 CCOc1cnc(c(c1)Cl)Br 34a_100010209684_100000210202 [0,1,0,0,0,0|2,0,0]=3 3809 B11R1.192 CCOc1cnc(c(c1)Cl)Br 7a_100010209684_100000210202 [0,1,0,0,0,0|2,0,0]=3 3810 B11R1.192 CCOc1cnc(c(c1)Cl)Cl 34a_100000094354_100000210202 [0,1,0,0,0,0|2,0,0]=3 3811 B11R1.192 CCOc1cnc(c(c1)Cl)Cl 7a_100000094354_100000210202 [0,1,0,0,0,0|2,0,0]=3 3812 B11R1.192 CCOc1cnc(c(c1)Cl)F 34a_100000087088_100000210202 [0,1,0,0,0,0|2,0,0]=3 3813 B11R1.192 CCOc1cnc(c(c1)Cl)F 7a_100000087088_100000210202 [0,1,0,0,0,0|2,0,0]=3 3814 B11R1.192 CCOc1cnc(c(c1)F)Cl 34a_100000063512_100000210202 [0,1,0,0,0,0|2,0,0]=3 3815 B11R1.192 CCOc1cnc(c(c1)F)Cl 7a_100000063512_100000210202 [0,1,0,0,0,0|2,0,0]=3 3816 B11R1.192 CCOc1cnc(c(n1)C)C 34a_200000700380_100000210202 [0,1,0,0,0,0|3,0,0]=4 3817 B11R1.192 CCOc1cnc(c(n1)Cl)Br 34a_100010080449_100000210202 [0,1,0,0,0,0|3,0,0]=4 3818 B11R1.192 CCOc1ncc(c(n1)O)F 271570a_203496583355_200000083733 [0,1,0,0,0,0|3,0,0]=4 3819 B11R1.192 CCSc1c[nH]c(=O)c(c1)Br 62a_100000210202_100010125443 [0,1,0,0,0,0|1,1,1]=4 3820 B11R1.192 CCSc1c[nH]c(=O)c(c1)Br 62a_100010125443_100000210202 [0,1,0,0,0,0|1,1,1]=4 3821 B11R1.192 CCSc1c[nH]c(=O)c(c1)F 62a_100000210202_100000723523 [0,1,0,0,0,0|1,1,1]=4 3822 B11R1.192 CCSc1c[nH]c(=O)c(c1)F 62a_100000723523_100000210202 [0,1,0,0,0,0|1,1,1]=4 3823 B11R1.192 CCSc1c[nH]c(=O)c(c1)O 62a_100000210202_100009814561 [0,1,0,0,0,0|1,1,1]=4 3824 B11R1.192 CCSc1cc(c(cn1)Br)C 62a_100000210202_100012356354 [0,1,0,0,0,0|2,1,0]=4 3825 B11R1.192 CCSc1cc(c(cn1)Br)C 62a_100012356354_100000210202 [0,1,0,0,0,0|2,1,0]=4 3826 B11R1.192 CCSc1cc(c(cn1)C)C 62a_100000210202_100009850809 [0,1,0,0,0,0|2,1,0]=4 3827 B11R1.192 CCSc1cc(c(cn1)C)C 62a_100009850809_100000210202 [0,1,0,0,0,0|2,1,0]=4 3828 B11R1.192 CCSc1cc(c(cn1)C)F 62a_100000210202_100009841206 [0,1,0,0,0,0|2,1,0]=4 3829 B11R1.192 CCSc1cc(c(cn1)C)F 62a_100009841206_100000210202 [0,1,0,0,0,0|2,1,0]=4 3830 B11R1.192 CCSc1cc(c(cn1)C)N 62a_100000126663_100000210202 [0,1,0,0,0,0|2,1,0]=4 3831 B11R1.192 CCSc1cc(c(cn1)C)N 62a_100000210202_100000126663 [0,1,0,0,0,0|2,1,0]=4 3832 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000210202_100000704368 [0,1,0,0,0,0|2,1,0]=4 3833 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000704368_100000210202 [0,1,0,0,0,0|2,1,0]=4 3834 B11R1.192 CCSc1cc(c(cn1)F)C 62a_100000210202_100009818257 [0,1,0,0,0,0|2,1,0]=4 3835 B11R1.192 CCSc1cc(c(cn1)F)C 62a_100009818257_100000210202 [0,1,0,0,0,0|2,1,0]=4 3836 B11R1.192 CCSc1cc(c(cn1)F)N 62a_100000126464_100000210202 [0,1,0,0,0,0|2,1,0]=4 3837 B11R1.192 CCSc1cc(c(cn1)F)N 62a_100000210202_100000126464 [0,1,0,0,0,0|2,1,0]=4 3838 B11R1.192 CCSc1cc(c(cn1)F)O 62a_100000210202_100009854642 [0,1,0,0,0,0|2,1,0]=4 3839 B11R1.192 CCSc1cc(c(cn1)F)O 62a_100009854642_100000210202 [0,1,0,0,0,0|2,1,0]=4 3840 B11R1.192 CCSc1cc(c(cn1)N)C 62a_100000067204_100000210202 [0,1,0,0,0,0|2,1,0]=4 3841 B11R1.192 CCSc1cc(c(cn1)N)C 62a_100000210202_100000067204 [0,1,0,0,0,0|2,1,0]=4 3842 B11R1.192 CCSc1cc(c(cn1)N)N 62a_100000067514_100000210202 [0,1,0,0,0,0|2,1,0]=4 3843 B11R1.192 CCSc1cc(c(cn1)N)N 62a_100000210202_100000067514 [0,1,0,0,0,0|2,1,0]=4 3844 B11R1.192 CCSc1cc(c(cn1)O)C 62a_100000210202_100000692680 [0,1,0,0,0,0|1,1,0]=3 3845 B11R1.192 CCSc1cc(c(cn1)O)N 62a_100000210202_100009819941 [0,1,0,0,0,0|1,1,0]=3 3846 B11R1.192 CCSc1cc(c(cn1)O)N 62a_100009819941_100000210202 [0,1,0,0,0,0|1,1,0]=3 3847 B11R1.192 CCSc1ccc(=O)n(c1)C 62a_100000210202_100011245003 [0,1,0,0,0,0|1,1,1]=4 3848 B11R1.192 CCSc1ccc(=O)n(c1)C 62a_100011245003_100000210202 [0,1,0,0,0,0|1,1,1]=4 3849 B11R1.192 CCSc1ccc([n+](c1)[O-])C 62a_100000210202_100000703231 [0,1,0,0,0,0|2,1,0]=4 3850 B11R1.192 CCSc1ccc(c(c1)Br)Br 62a_100000210202_100012356285 [0,1,0,0,0,0|1,1,0]=3 3851 B11R1.192 CCSc1ccc(c(c1)Br)Br 62a_100012356285_100000210202 [0,1,0,0,0,0|1,1,0]=3 3852 B11R1.192 CCSc1ccc(c(c1)Br)C 62a_100000210202_100011847877 [0,1,0,0,0,0|1,1,0]=3 3853 B11R1.192 CCSc1ccc(c(c1)Br)C 62a_100011847877_100000210202 [0,1,0,0,0,0|1,1,0]=3 3854 B11R1.192 CCSc1ccc(c(c1)Br)Cl 62a_100000210202_100012353702 [0,1,0,0,0,0|1,1,0]=3 3855 B11R1.192 CCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210202 [0,1,0,0,0,0|1,1,0]=3 3856 B11R1.192 CCSc1ccc(c(c1)Br)F 62a_100000210202_100012047266 [0,1,0,0,0,0|1,1,0]=3 3857 B11R1.192 CCSc1ccc(c(c1)Br)F 62a_100012047266_100000210202 [0,1,0,0,0,0|1,1,0]=3 3858 B11R1.192 CCSc1ccc(c(c1)Br)N 62a_100000210202_100000750455 [0,1,0,0,0,0|1,1,0]=3 3859 B11R1.192 CCSc1ccc(c(c1)Br)N 62a_100000750455_100000210202 [0,1,0,0,0,0|1,1,0]=3 3860 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [0,1,0,0,0,0|0,1,0]=2 3861 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [0,1,0,0,0,0|0,1,0]=2 3862 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100000210202_100009813585 [0,1,0,0,0,0|1,1,0]=3 3863 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100009813585_100000210202 [0,1,0,0,0,0|1,1,0]=3 3864 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100000210202_100011215607 [0,1,0,0,0,0|1,1,0]=3 3865 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100011215607_100000210202 [0,1,0,0,0,0|1,1,0]=3 3866 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210202 [0,1,0,0,0,0|1,1,0]=3 3867 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000210202_100000049509 [0,1,0,0,0,0|1,1,0]=3 3868 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100000210202_100011218330 [0,1,0,0,0,0|1,1,0]=3 3869 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100011218330_100000210202 [0,1,0,0,0,0|1,1,0]=3 3870 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000210202_100000211769 [0,1,0,0,0,0|1,1,0]=3 3871 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000211769_100000210202 [0,1,0,0,0,0|1,1,0]=3 3872 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [0,1,0,0,0,0|0,1,0]=2 3873 B11R1.192 CCSc1ccc(c(c1)Cl)Br 62a_100000210202_100012047281 [0,1,0,0,0,0|1,1,0]=3 3874 B11R1.192 CCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210202 [0,1,0,0,0,0|1,1,0]=3 3875 B11R1.192 CCSc1ccc(c(c1)Cl)C 62a_100000210202_100011216363 [0,1,0,0,0,0|1,1,0]=3 3876 B11R1.192 CCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210202 [0,1,0,0,0,0|1,1,0]=3 3877 B11R1.192 CCSc1ccc(c(c1)Cl)Cl 62a_100000210202_100011214914 [0,1,0,0,0,0|1,1,0]=3 3878 B11R1.192 CCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210202 [0,1,0,0,0,0|1,1,0]=3 3879 B11R1.192 CCSc1ccc(c(c1)Cl)F 62a_100000210202_100011215976 [0,1,0,0,0,0|1,1,0]=3 3880 B11R1.192 CCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210202 [0,1,0,0,0,0|1,1,0]=3 3881 B11R1.192 CCSc1ccc(c(c1)Cl)N 62a_100000210202_100011218065 [0,1,0,0,0,0|1,1,0]=3 3882 B11R1.192 CCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210202 [0,1,0,0,0,0|1,1,0]=3 3883 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [0,1,0,0,0,0|0,1,0]=2 3884 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [0,1,0,0,0,0|0,1,0]=2 3885 B11R1.192 CCSc1ccc(c(c1)F)Br 62a_100000210202_100000685389 [0,1,0,0,0,0|1,1,0]=3 3886 B11R1.192 CCSc1ccc(c(c1)F)Br 62a_100000685389_100000210202 [0,1,0,0,0,0|1,1,0]=3 3887 B11R1.192 CCSc1ccc(c(c1)F)C 62a_100000210202_100000720648 [0,1,0,0,0,0|1,1,0]=3 3888 B11R1.192 CCSc1ccc(c(c1)F)C 62a_100000720648_100000210202 [0,1,0,0,0,0|1,1,0]=3 3889 B11R1.192 CCSc1ccc(c(c1)F)Cl 62a_100000210202_100011216805 [0,1,0,0,0,0|1,1,0]=3 3890 B11R1.192 CCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210202 [0,1,0,0,0,0|1,1,0]=3 3891 B11R1.192 CCSc1ccc(c(c1)F)F 62a_100000210202_100000703953 [0,1,0,0,0,0|1,1,0]=3 3892 B11R1.192 CCSc1ccc(c(c1)F)F 62a_100000703953_100000210202 [0,1,0,0,0,0|1,1,0]=3 3893 B11R1.192 CCSc1ccc(c(c1)F)N 62a_100000210202_100011215594 [0,1,0,0,0,0|1,1,0]=3 3894 B11R1.192 CCSc1ccc(c(c1)F)N 62a_100011215594_100000210202 [0,1,0,0,0,0|1,1,0]=3 3895 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [0,1,0,0,0,0|0,1,0]=2 3896 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [0,1,0,0,0,0|0,1,0]=2 3897 B11R1.192 CCSc1ccc(c(c1)N)Br 62a_100000210202_100000750456 [0,1,0,0,0,0|1,1,0]=3 3898 B11R1.192 CCSc1ccc(c(c1)N)Br 62a_100000750456_100000210202 [0,1,0,0,0,0|1,1,0]=3 3899 B11R1.192 CCSc1ccc(c(c1)N)C 62a_100000210202_100000761890 [0,1,0,0,0,0|1,1,0]=3 3900 B11R1.192 CCSc1ccc(c(c1)N)C 62a_100000761890_100000210202 [0,1,0,0,0,0|1,1,0]=3 3901 B11R1.192 CCSc1ccc(c(c1)N)Cl 62a_100000210202_200000761891 [0,1,0,0,0,0|1,1,0]=3 3902 B11R1.192 CCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210202 [0,1,0,0,0,0|1,1,0]=3 3903 B11R1.192 CCSc1ccc(c(c1)N)F 62a_100000210202_100000740924 [0,1,0,0,0,0|1,1,0]=3 3904 B11R1.192 CCSc1ccc(c(c1)N)F 62a_100000740924_100000210202 [0,1,0,0,0,0|1,1,0]=3 3905 B11R1.192 CCSc1ccc(c(c1)N)N 62a_100000210202_100011534411 [0,1,0,0,0,0|1,1,0]=3 3906 B11R1.192 CCSc1ccc(c(c1)N)N 62a_100000741789_100000210202 [0,1,0,0,0,0|1,1,0]=3 3907 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [0,1,0,0,0,0|0,1,0]=2 3908 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [0,1,0,0,0,0|0,1,0]=2 3909 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [0,1,0,0,0,0|1,1,0]=3 3910 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [0,1,0,0,0,0|1,1,0]=3 3911 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [0,1,0,0,0,0|1,1,0]=3 3912 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [0,1,0,0,0,0|1,1,0]=3 3913 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [0,1,0,0,0,0|1,1,0]=3 3914 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [0,1,0,0,0,0|1,1,0]=3 3915 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [0,1,0,0,0,0|1,1,0]=3 3916 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [0,1,0,0,0,0|1,1,0]=3 3917 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [0,1,0,0,0,0|1,1,0]=3 3918 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [0,1,0,0,0,0|1,1,0]=3 3919 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [0,1,0,0,0,0|0,1,0]=2 3920 B11R1.192 CCSc1ccc(c(n1)Br)O 62a_100000210202_100000725334 [0,1,0,0,0,0|1,1,0]=3 3921 B11R1.192 CCSc1ccc(c(n1)Br)O 62a_100000725334_100000210202 [0,1,0,0,0,0|1,1,0]=3 3922 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100000210202_100012360386 [0,1,0,0,0,0|2,1,0]=4 3923 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100012360386_100000210202 [0,1,0,0,0,0|2,1,0]=4 3924 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000103781_100000210202 [0,1,0,0,0,0|2,1,0]=4 3925 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000210202_100000103781 [0,1,0,0,0,0|2,1,0]=4 3926 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100000210202_100009814307 [0,1,0,0,0,0|2,1,0]=4 3927 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100009814307_100000210202 [0,1,0,0,0,0|2,1,0]=4 3928 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000210202_100000720120 [0,1,0,0,0,0|2,1,0]=4 3929 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000720120_100000210202 [0,1,0,0,0,0|2,1,0]=4 3930 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100000210202_100010233687 [0,1,0,0,0,0|1,1,0]=3 3931 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100010233687_100000210202 [0,1,0,0,0,0|1,1,0]=3 3932 B11R1.192 CCSc1ccc(c(n1)Cl)N 62a_100000210202_200010233646 [0,1,0,0,0,0|2,1,0]=4 3933 B11R1.192 CCSc1ccc(c(n1)Cl)N 62a_200010233646_100000210202 [0,1,0,0,0,0|2,1,0]=4 3934 B11R1.192 CCSc1ccc(c(n1)Cl)O 62a_100000210202_100000721234 [0,1,0,0,0,0|1,1,0]=3 3935 B11R1.192 CCSc1ccc(c(n1)F)Br 62a_100000210202_100010134343 [0,1,0,0,0,0|2,1,0]=4 3936 B11R1.192 CCSc1ccc(c(n1)F)Br 62a_100010134343_100000210202 [0,1,0,0,0,0|2,1,0]=4 3937 B11R1.192 CCSc1ccc(c(n1)F)N 62a_100000210202_100009856439 [0,1,0,0,0,0|2,1,0]=4 3938 B11R1.192 CCSc1ccc(c(n1)F)N 62a_100009856439_100000210202 [0,1,0,0,0,0|2,1,0]=4 3939 B11R1.192 CCSc1ccc(c(n1)F)O 62a_100000210202_100009819667 [0,1,0,0,0,0|1,1,0]=3 3940 B11R1.192 CCSc1ccc(c(n1)F)O 62a_100009819667_100000210202 [0,1,0,0,0,0|1,1,0]=3 3941 B11R1.192 CCSc1ccc(c(n1)N)C 62a_100000210202_100009857032 [0,1,0,0,0,0|2,1,0]=4 3942 B11R1.192 CCSc1ccc(c(n1)N)C 62a_100009857032_100000210202 [0,1,0,0,0,0|2,1,0]=4 3943 B11R1.192 CCSc1ccc(c(n1)N)F 62a_100000210202_100016091773 [0,1,0,0,0,0|2,1,0]=4 3944 B11R1.192 CCSc1ccc(c(n1)N)F 62a_100016091773_100000210202 [0,1,0,0,0,0|2,1,0]=4 3945 B11R1.192 CCSc1ccc(c(n1)N)N 62a_100000747239_100000210202 [0,1,0,0,0,0|2,1,0]=4 3946 B11R1.192 CCSc1ccc(c(n1)N)O 62a_100000210202_100000685527 [0,1,0,0,0,0|1,1,0]=3 3947 B11R1.192 CCSc1ccc(c(n1)N)O 62a_100000685527_100000210202 [0,1,0,0,0,0|1,1,0]=3 3948 B11R1.192 CCSc1ccc(c(n1)O)F 62a_100000210202_100010729010 [0,1,0,0,0,0|2,1,0]=4 3949 B11R1.192 CCSc1ccc(c(n1)O)N 62a_100000718904_100000210202 [0,1,0,0,0,0|2,1,0]=4 3950 B11R1.192 CCSc1ccn(c(=O)c1)C 62a_100000210202_100009820031 [0,1,0,0,0,0|2,1,0]=4 3951 B11R1.192 CCSc1ccn(c(=O)c1)C 62a_100009820031_100000210202 [0,1,0,0,0,0|2,1,0]=4 3952 B11R1.192 CCSc1cnc(c(c1)Br)Cl 62a_100000210202_100010172733 [0,1,0,0,0,0|2,1,0]=4 3953 B11R1.192 CCSc1cnc(c(c1)Br)Cl 62a_100010172733_100000210202 [0,1,0,0,0,0|2,1,0]=4 3954 B11R1.192 CCSc1cnc(c(c1)Br)N 62a_100000210202_100012353989 [0,1,0,0,0,0|2,1,0]=4 3955 B11R1.192 CCSc1cnc(c(c1)Br)N 62a_100012353989_100000210202 [0,1,0,0,0,0|2,1,0]=4 3956 B11R1.192 CCSc1cnc(c(c1)C)Br 62a_100000210202_100009816107 [0,1,0,0,0,0|2,1,0]=4 3957 B11R1.192 CCSc1cnc(c(c1)C)Br 62a_100009816107_100000210202 [0,1,0,0,0,0|2,1,0]=4 3958 B11R1.192 CCSc1cnc(c(c1)C)C 62a_100000210202_100000697892 [0,1,0,0,0,0|2,1,0]=4 3959 B11R1.192 CCSc1cnc(c(c1)C)C 62a_100000697892_100000210202 [0,1,0,0,0,0|2,1,0]=4 3960 B11R1.192 CCSc1cnc(c(c1)C)Cl 62a_100000210202_100009922867 [0,1,0,0,0,0|2,1,0]=4 3961 B11R1.192 CCSc1cnc(c(c1)C)Cl 62a_100009922867_100000210202 [0,1,0,0,0,0|2,1,0]=4 3962 B11R1.192 CCSc1cnc(c(c1)C)F 62a_100000210202_100000709442 [0,1,0,0,0,0|2,1,0]=4 3963 B11R1.192 CCSc1cnc(c(c1)C)F 62a_100000709442_100000210202 [0,1,0,0,0,0|2,1,0]=4 3964 B11R1.192 CCSc1cnc(c(c1)C)N 62a_100000210202_100000684428 [0,1,0,0,0,0|2,1,0]=4 3965 B11R1.192 CCSc1cnc(c(c1)C)N 62a_100000684428_100000210202 [0,1,0,0,0,0|2,1,0]=4 3966 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000210202_100000685391 [0,1,0,0,0,0|1,1,0]=3 3967 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000685391_100000210202 [0,1,0,0,0,0|1,1,0]=3 3968 B11R1.192 CCSc1cnc(c(c1)Cl)N 62a_100000210202_100012356299 [0,1,0,0,0,0|2,1,0]=4 3969 B11R1.192 CCSc1cnc(c(c1)Cl)N 62a_100012356299_100000210202 [0,1,0,0,0,0|2,1,0]=4 3970 B11R1.192 CCSc1cnc(c(c1)Cl)O 62a_100000210202_100010238531 [0,1,0,0,0,0|1,1,0]=3 3971 B11R1.192 CCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210202 [0,1,0,0,0,0|1,1,0]=3 3972 B11R1.192 CCSc1cnc(c(c1)F)C 62a_100000210202_100009845756 [0,1,0,0,0,0|2,1,0]=4 3973 B11R1.192 CCSc1cnc(c(c1)F)C 62a_100009845756_100000210202 [0,1,0,0,0,0|2,1,0]=4 3974 B11R1.192 CCSc1cnc(c(c1)F)F 62a_100000210202_100009817721 [0,1,0,0,0,0|2,1,0]=4 3975 B11R1.192 CCSc1cnc(c(c1)F)F 62a_100009817721_100000210202 [0,1,0,0,0,0|2,1,0]=4 3976 B11R1.192 CCSc1cnc(c(c1)F)N 62a_100000210202_100000693161 [0,1,0,0,0,0|2,1,0]=4 3977 B11R1.192 CCSc1cnc(c(c1)F)N 62a_100000693161_100000210202 [0,1,0,0,0,0|2,1,0]=4 3978 B11R1.192 CCSc1cnc(c(c1)N)C 62a_100000210202_100011999542 [0,1,0,0,0,0|2,1,0]=4 3979 B11R1.192 CCSc1cnc(c(c1)N)C 62a_100011999542_100000210202 [0,1,0,0,0,0|2,1,0]=4 3980 B11R1.192 CCSc1cnc(c(c1)N)Cl 62a_100000210202_100009828400 [0,1,0,0,0,0|2,1,0]=4 3981 B11R1.192 CCSc1cnc(c(c1)N)Cl 62a_100009828400_100000210202 [0,1,0,0,0,0|2,1,0]=4 3982 B11R1.192 CCSc1cnc(c(c1)N)F 62a_100000210202_100009816798 [0,1,0,0,0,0|2,1,0]=4 3983 B11R1.192 CCSc1cnc(c(c1)N)F 62a_100009816798_100000210202 [0,1,0,0,0,0|2,1,0]=4 3984 B11R1.192 CCSc1cnc(c(c1)N)N 62a_100000184470_100000210202 [0,1,0,0,0,0|2,1,0]=4 3985 B11R1.192 CCSc1cnc(c(c1)N)N 62a_100000210202_100000184470 [0,1,0,0,0,0|2,1,0]=4 3986 B11R1.192 CCSc1cnc(c(c1)N)O 62a_100000210202_100000743729 [0,1,0,0,0,0|1,1,0]=3 3987 B11R1.192 CCSc1cnc(c(c1)N)O 62a_100000743729_100000210202 [0,1,0,0,0,0|1,1,0]=3 3988 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100000210202_100009864810 [0,1,0,0,0,0|2,1,0]=4 3989 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100009864810_100000210202 [0,1,0,0,0,0|2,1,0]=4 3990 B11R1.192 CCSc1cnc(c(c1)O)F 62a_100000210202_100009819871 [0,1,0,0,0,0|2,1,0]=4 3991 B11R1.192 CCSc1cnc(c(c1)O)F 62a_100009819871_100000210202 [0,1,0,0,0,0|2,1,0]=4 3992 B11R1.192 CCSc1cnc(c(c1)O)N 62a_100000210202_100009819042 [0,1,0,0,0,0|2,1,0]=4 3993 B11R1.192 CCSc1cnc(c(c1)O)N 62a_100009819042_100000210202 [0,1,0,0,0,0|2,1,0]=4 3994 B11R1.192 CNCc1cc(=O)c(co1)O 2230a_106832991635_100000010605 [0,1,0,0,0,0|3,0,0]=4 3995 B11R1.192 CNCc1cc(=O)c(co1)O 7a_106832991635_100000010605 [0,1,0,0,0,0|3,0,0]=4 3996 B11R1.192 CNCc1ccc(c(c1)Br)Br 207a_100102657272_100011215943 [0,1,0,0,0,0|3,0,0]=4 3997 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_100012351559_200000210301 [0,1,0,0,0,0|3,0,0]=4 3998 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_106832991635_100012353900 [0,1,0,0,0,0|3,0,0]=4 3999 B11R1.192 CNCc1ccc(c(c1)Br)Br 270004a_106832991635_100011215943 [0,1,0,0,0,0|3,0,0]=4 4000 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100012351559_200000210301 [0,1,0,0,0,0|3,0,0]=4 4001 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100102657272_100012353900 [0,1,0,0,0,0|3,0,0]=4 4002 B11R1.192 CNCc1ccc(c(c1)Br)Br 7a_106832991635_100012353900 [0,1,0,0,0,0|3,0,0]=4 4003 B11R1.192 CNCc1ccc(c(c1)Br)C 207a_100102657272_100000695567 [0,1,0,0,0,0|3,0,0]=4 4004 B11R1.192 CNCc1ccc(c(c1)Br)C 2230a_106832991635_100012232412 [0,1,0,0,0,0|3,0,0]=4 4005 B11R1.192 CNCc1ccc(c(c1)Br)C 26a_100102657272_100011380479 [0,1,0,0,0,0|3,0,0]=4 4006 B11R1.192 CNCc1ccc(c(c1)Br)C 270004a_106832991635_100000695567 [0,1,0,0,0,0|3,0,0]=4 4007 B11R1.192 CNCc1ccc(c(c1)Br)C 34a_100102657272_100012232412 [0,1,0,0,0,0|3,0,0]=4 4008 B11R1.192 CNCc1ccc(c(c1)Br)C 7a_106832991635_100012232412 [0,1,0,0,0,0|3,0,0]=4 4009 B11R1.192 CNCc1ccc(c(c1)Br)Cl 207a_100102657272_100000693810 [0,1,0,0,0,0|3,0,0]=4 4010 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_100012349490_200000210301 [0,1,0,0,0,0|3,0,0]=4 4011 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_106832991635_100012353894 [0,1,0,0,0,0|3,0,0]=4 4012 B11R1.192 CNCc1ccc(c(c1)Br)Cl 26a_100102657272_100011933957 [0,1,0,0,0,0|3,0,0]=4 4013 B11R1.192 CNCc1ccc(c(c1)Br)Cl 270004a_106832991635_100000693810 [0,1,0,0,0,0|3,0,0]=4 4014 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100012349490_200000210301 [0,1,0,0,0,0|3,0,0]=4 4015 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100102657272_100012353894 [0,1,0,0,0,0|3,0,0]=4 4016 B11R1.192 CNCc1ccc(c(c1)Br)Cl 7a_106832991635_100012353894 [0,1,0,0,0,0|3,0,0]=4 4017 B11R1.192 CNCc1ccc(c(c1)Br)F 207a_100102657272_100000211747 [0,1,0,0,0,0|3,0,0]=4 4018 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_100015193890_200000210301 [0,1,0,0,0,0|3,0,0]=4 4019 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_106832991635_100011206884 [0,1,0,0,0,0|3,0,0]=4 4020 B11R1.192 CNCc1ccc(c(c1)Br)F 26a_100102657272_100000693481 [0,1,0,0,0,0|3,0,0]=4 4021 B11R1.192 CNCc1ccc(c(c1)Br)F 270004a_106832991635_100000211747 [0,1,0,0,0,0|3,0,0]=4 4022 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100015193890_200000210301 [0,1,0,0,0,0|3,0,0]=4 4023 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100102657272_100011206884 [0,1,0,0,0,0|3,0,0]=4 4024 B11R1.192 CNCc1ccc(c(c1)Br)F 7a_106832991635_100011206884 [0,1,0,0,0,0|3,0,0]=4 4025 B11R1.192 CNCc1ccc(c(c1)Br)I 26a_100102657272_100000701344 [0,1,0,0,0,0|3,0,0]=4 4026 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [0,1,0,0,0,0|3,0,0]=4 4027 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [0,1,0,0,0,0|3,0,0]=4 4028 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [0,1,0,0,0,0|3,0,0]=4 4029 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [0,1,0,0,0,0|3,0,0]=4 4030 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [0,1,0,0,0,0|3,0,0]=4 4031 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [0,1,0,0,0,0|3,0,0]=4 4032 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [0,1,0,0,0,0|3,0,0]=4 4033 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [0,1,0,0,0,0|3,0,0]=4 4034 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [0,1,0,0,0,0|3,0,0]=4 4035 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [0,1,0,0,0,0|3,0,0]=4 4036 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [0,1,0,0,0,0|3,0,0]=4 4037 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [0,1,0,0,0,0|3,0,0]=4 4038 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [0,1,0,0,0,0|3,0,0]=4 4039 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [0,1,0,0,0,0|3,0,0]=4 4040 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [0,1,0,0,0,0|3,0,0]=4 4041 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [0,1,0,0,0,0|3,0,0]=4 4042 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [0,1,0,0,0,0|3,0,0]=4 4043 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [0,1,0,0,0,0|3,0,0]=4 4044 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [0,1,0,0,0,0|3,0,0]=4 4045 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [0,1,0,0,0,0|3,0,0]=4 4046 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [0,1,0,0,0,0|3,0,0]=4 4047 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [0,1,0,0,0,0|3,0,0]=4 4048 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [0,1,0,0,0,0|3,0,0]=4 4049 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [0,1,0,0,0,0|3,0,0]=4 4050 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [0,1,0,0,0,0|3,0,0]=4 4051 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [0,1,0,0,0,0|3,0,0]=4 4052 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [0,1,0,0,0,0|3,0,0]=4 4053 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [0,1,0,0,0,0|3,0,0]=4 4054 B11R1.192 CNCc1ccc(c(c1)Cl)Br 207a_100102657272_100000690054 [0,1,0,0,0,0|3,0,0]=4 4055 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_100012362553_200000210301 [0,1,0,0,0,0|3,0,0]=4 4056 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_106832991635_100012353895 [0,1,0,0,0,0|3,0,0]=4 4057 B11R1.192 CNCc1ccc(c(c1)Cl)Br 26a_100102657272_100011215161 [0,1,0,0,0,0|3,0,0]=4 4058 B11R1.192 CNCc1ccc(c(c1)Cl)Br 270004a_106832991635_100000690054 [0,1,0,0,0,0|3,0,0]=4 4059 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100012362553_200000210301 [0,1,0,0,0,0|3,0,0]=4 4060 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100102657272_100012353895 [0,1,0,0,0,0|3,0,0]=4 4061 B11R1.192 CNCc1ccc(c(c1)Cl)Br 7a_106832991635_100012353895 [0,1,0,0,0,0|3,0,0]=4 4062 B11R1.192 CNCc1ccc(c(c1)Cl)C 207a_100102657272_100000760539 [0,1,0,0,0,0|3,0,0]=4 4063 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_102495364989_200000210301 [0,1,0,0,0,0|3,0,0]=4 4064 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_106832991635_100011823929 [0,1,0,0,0,0|3,0,0]=4 4065 B11R1.192 CNCc1ccc(c(c1)Cl)C 26a_100102657272_100011265682 [0,1,0,0,0,0|3,0,0]=4 4066 B11R1.192 CNCc1ccc(c(c1)Cl)C 270004a_106832991635_100000760539 [0,1,0,0,0,0|3,0,0]=4 4067 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_100102657272_100011823929 [0,1,0,0,0,0|3,0,0]=4 4068 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_102495364989_200000210301 [0,1,0,0,0,0|3,0,0]=4 4069 B11R1.192 CNCc1ccc(c(c1)Cl)C 7a_106832991635_100011823929 [0,1,0,0,0,0|3,0,0]=4 4070 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 207a_100102657272_100000188533 [0,1,0,0,0,0|3,0,0]=4 4071 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200000210301 [0,1,0,0,0,0|3,0,0]=4 4072 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100000184707 [0,1,0,0,0,0|3,0,0]=4 4073 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 26a_100102657272_100000211054 [0,1,0,0,0,0|3,0,0]=4 4074 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 270004a_106832991635_100000188533 [0,1,0,0,0,0|3,0,0]=4 4075 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100000174881_200000210301 [0,1,0,0,0,0|3,0,0]=4 4076 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100102657272_100000184707 [0,1,0,0,0,0|3,0,0]=4 4077 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 7a_106832991635_100000184707 [0,1,0,0,0,0|3,0,0]=4 4078 B11R1.192 CNCc1ccc(c(c1)Cl)F 207a_100102657272_100000742290 [0,1,0,0,0,0|3,0,0]=4 4079 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_100000749334_200000210301 [0,1,0,0,0,0|3,0,0]=4 4080 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_106832991635_100000717365 [0,1,0,0,0,0|3,0,0]=4 4081 B11R1.192 CNCc1ccc(c(c1)Cl)F 26a_100102657272_100000211030 [0,1,0,0,0,0|3,0,0]=4 4082 B11R1.192 CNCc1ccc(c(c1)Cl)F 270004a_106832991635_100000742290 [0,1,0,0,0,0|3,0,0]=4 4083 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100000749334_200000210301 [0,1,0,0,0,0|3,0,0]=4 4084 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100102657272_100011934319 [0,1,0,0,0,0|3,0,0]=4 4085 B11R1.192 CNCc1ccc(c(c1)Cl)F 7a_106832991635_100000717365 [0,1,0,0,0,0|3,0,0]=4 4086 B11R1.192 CNCc1ccc(c(c1)Cl)I 2230a_106832991635_100012349665 [0,1,0,0,0,0|3,0,0]=4 4087 B11R1.192 CNCc1ccc(c(c1)Cl)I 26a_100102657272_100000047559 [0,1,0,0,0,0|3,0,0]=4 4088 B11R1.192 CNCc1ccc(c(c1)Cl)I 34a_100102657272_100012349665 [0,1,0,0,0,0|3,0,0]=4 4089 B11R1.192 CNCc1ccc(c(c1)Cl)I 7a_106832991635_100012349665 [0,1,0,0,0,0|3,0,0]=4 4090 B11R1.192 CNCc1ccc(c(c1)F)Br 207a_100102657272_100000686674 [0,1,0,0,0,0|3,0,0]=4 4091 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_100000755036_200000210301 [0,1,0,0,0,0|3,0,0]=4 4092 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_106832991635_100000767054 [0,1,0,0,0,0|3,0,0]=4 4093 B11R1.192 CNCc1ccc(c(c1)F)Br 26a_100102657272_100000755031 [0,1,0,0,0,0|3,0,0]=4 4094 B11R1.192 CNCc1ccc(c(c1)F)Br 270004a_106832991635_100000686674 [0,1,0,0,0,0|3,0,0]=4 4095 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100000755036_200000210301 [0,1,0,0,0,0|3,0,0]=4 4096 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100102657272_100000767054 [0,1,0,0,0,0|3,0,0]=4 4097 B11R1.192 CNCc1ccc(c(c1)F)Br 7a_106832991635_100000767054 [0,1,0,0,0,0|3,0,0]=4 4098 B11R1.192 CNCc1ccc(c(c1)F)C 207a_100102657272_100000753222 [0,1,0,0,0,0|3,0,0]=4 4099 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_100102708794_200000210301 [0,1,0,0,0,0|3,0,0]=4 4100 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_106832991635_100011217369 [0,1,0,0,0,0|3,0,0]=4 4101 B11R1.192 CNCc1ccc(c(c1)F)C 270004a_106832991635_100000753222 [0,1,0,0,0,0|3,0,0]=4 4102 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102657272_100011217369 [0,1,0,0,0,0|3,0,0]=4 4103 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102708794_200000210301 [0,1,0,0,0,0|3,0,0]=4 4104 B11R1.192 CNCc1ccc(c(c1)F)C 7a_106832991635_100011217369 [0,1,0,0,0,0|3,0,0]=4 4105 B11R1.192 CNCc1ccc(c(c1)F)Cl 207a_100102657272_100000745630 [0,1,0,0,0,0|3,0,0]=4 4106 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_100011219866_200000210301 [0,1,0,0,0,0|3,0,0]=4 4107 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_106832991635_100000716492 [0,1,0,0,0,0|3,0,0]=4 4108 B11R1.192 CNCc1ccc(c(c1)F)Cl 26a_100102657272_100000691581 [0,1,0,0,0,0|3,0,0]=4 4109 B11R1.192 CNCc1ccc(c(c1)F)Cl 270004a_106832991635_100000745630 [0,1,0,0,0,0|3,0,0]=4 4110 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100011219866_200000210301 [0,1,0,0,0,0|3,0,0]=4 4111 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100102657272_100011519011 [0,1,0,0,0,0|3,0,0]=4 4112 B11R1.192 CNCc1ccc(c(c1)F)Cl 7a_106832991635_100000716492 [0,1,0,0,0,0|3,0,0]=4 4113 B11R1.192 CNCc1ccc(c(c1)F)F 207a_100102657272_100000211062 [0,1,0,0,0,0|3,0,0]=4 4114 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_100000737897_200000210301 [0,1,0,0,0,0|3,0,0]=4 4115 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_106832991635_100000757363 [0,1,0,0,0,0|3,0,0]=4 4116 B11R1.192 CNCc1ccc(c(c1)F)F 270004a_106832991635_100000211062 [0,1,0,0,0,0|3,0,0]=4 4117 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100000737897_200000210301 [0,1,0,0,0,0|3,0,0]=4 4118 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100102657272_100000757363 [0,1,0,0,0,0|3,0,0]=4 4119 B11R1.192 CNCc1ccc(c(c1)F)F 7a_106832991635_100000757363 [0,1,0,0,0,0|3,0,0]=4 4120 B11R1.192 CNCc1ccc(c(c1)F)I 207a_100102657272_100000050832 [0,1,0,0,0,0|3,0,0]=4 4121 B11R1.192 CNCc1ccc(c(c1)F)I 2230a_106832991635_100010149604 [0,1,0,0,0,0|3,0,0]=4 4122 B11R1.192 CNCc1ccc(c(c1)F)I 270004a_106832991635_100000050832 [0,1,0,0,0,0|3,0,0]=4 4123 B11R1.192 CNCc1ccc(c(c1)F)I 34a_100102657272_100010149604 [0,1,0,0,0,0|3,0,0]=4 4124 B11R1.192 CNCc1ccc(c(c1)F)I 7a_106832991635_100010149604 [0,1,0,0,0,0|3,0,0]=4 4125 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [0,1,0,0,0,0|2,0,0]=3 4126 B11R1.192 CNCc1ccc(c(c1)I)Br 207a_100102657272_100010146563 [0,1,0,0,0,0|3,0,0]=4 4127 B11R1.192 CNCc1ccc(c(c1)I)Br 2230a_106832991635_100010146616 [0,1,0,0,0,0|3,0,0]=4 4128 B11R1.192 CNCc1ccc(c(c1)I)Br 26a_100102657272_100012339312 [0,1,0,0,0,0|3,0,0]=4 4129 B11R1.192 CNCc1ccc(c(c1)I)Br 270004a_106832991635_100010146563 [0,1,0,0,0,0|3,0,0]=4 4130 B11R1.192 CNCc1ccc(c(c1)I)Br 34a_100102657272_100010146616 [0,1,0,0,0,0|3,0,0]=4 4131 B11R1.192 CNCc1ccc(c(c1)I)Br 7a_106832991635_100010146616 [0,1,0,0,0,0|3,0,0]=4 4132 B11R1.192 CNCc1ccc(c(c1)I)C 207a_100102657272_100010197721 [0,1,0,0,0,0|3,0,0]=4 4133 B11R1.192 CNCc1ccc(c(c1)I)C 2230a_106832991635_100010206137 [0,1,0,0,0,0|3,0,0]=4 4134 B11R1.192 CNCc1ccc(c(c1)I)C 270004a_106832991635_100010197721 [0,1,0,0,0,0|3,0,0]=4 4135 B11R1.192 CNCc1ccc(c(c1)I)C 34a_100102657272_100010206137 [0,1,0,0,0,0|3,0,0]=4 4136 B11R1.192 CNCc1ccc(c(c1)I)C 7a_106832991635_100010206137 [0,1,0,0,0,0|3,0,0]=4 4137 B11R1.192 CNCc1ccc(c(c1)I)Cl 207a_100102657272_100010209939 [0,1,0,0,0,0|3,0,0]=4 4138 B11R1.192 CNCc1ccc(c(c1)I)Cl 26a_100102657272_100000049588 [0,1,0,0,0,0|3,0,0]=4 4139 B11R1.192 CNCc1ccc(c(c1)I)Cl 270004a_106832991635_100010209939 [0,1,0,0,0,0|3,0,0]=4 4140 B11R1.192 CNCc1ccc(c(c1)I)F 207a_100102657272_100010188209 [0,1,0,0,0,0|3,0,0]=4 4141 B11R1.192 CNCc1ccc(c(c1)I)F 2230a_106832991635_100010188208 [0,1,0,0,0,0|3,0,0]=4 4142 B11R1.192 CNCc1ccc(c(c1)I)F 270004a_106832991635_100010188209 [0,1,0,0,0,0|3,0,0]=4 4143 B11R1.192 CNCc1ccc(c(c1)I)F 34a_100102657272_100010188208 [0,1,0,0,0,0|3,0,0]=4 4144 B11R1.192 CNCc1ccc(c(c1)I)F 7a_106832991635_100010188208 [0,1,0,0,0,0|3,0,0]=4 4145 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [0,1,0,0,0,0|3,0,0]=4 4146 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [0,1,0,0,0,0|3,0,0]=4 4147 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [0,1,0,0,0,0|2,0,0]=3 4148 B11R1.192 CNCc1cnc(c(c1)Br)O 207a_100102657272_100010064886 [0,1,0,0,0,0|3,0,0]=4 4149 B11R1.192 CNCc1cnc(c(c1)Br)O 270004a_106832991635_100010064886 [0,1,0,0,0,0|3,0,0]=4 4150 B11R1.192 COCc1ccc(c(c1)Br)Br 34a_100138415774_100012353900 [0,1,0,0,0,0|3,0,0]=4 4151 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100000708995_200000210301 [0,1,0,0,0,0|3,0,0]=4 4152 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100138415774_100012232412 [0,1,0,0,0,0|3,0,0]=4 4153 B11R1.192 COCc1ccc(c(c1)Br)C 7a_100000708995_200000210301 [0,1,0,0,0,0|3,0,0]=4 4154 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100012353893_200000210301 [0,1,0,0,0,0|3,0,0]=4 4155 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100138415774_100012353894 [0,1,0,0,0,0|3,0,0]=4 4156 B11R1.192 COCc1ccc(c(c1)Br)Cl 7a_100012353893_200000210301 [0,1,0,0,0,0|3,0,0]=4 4157 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100000246287_200000210301 [0,1,0,0,0,0|3,0,0]=4 4158 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100138415774_100011206884 [0,1,0,0,0,0|3,0,0]=4 4159 B11R1.192 COCc1ccc(c(c1)Br)F 7a_100000246287_200000210301 [0,1,0,0,0,0|3,0,0]=4 4160 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [0,1,0,0,0,0|3,0,0]=4 4161 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [0,1,0,0,0,0|3,0,0]=4 4162 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [0,1,0,0,0,0|3,0,0]=4 4163 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [0,1,0,0,0,0|3,0,0]=4 4164 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [0,1,0,0,0,0|3,0,0]=4 4165 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [0,1,0,0,0,0|3,0,0]=4 4166 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [0,1,0,0,0,0|3,0,0]=4 4167 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [0,1,0,0,0,0|3,0,0]=4 4168 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [0,1,0,0,0,0|3,0,0]=4 4169 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [0,1,0,0,0,0|3,0,0]=4 4170 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [0,1,0,0,0,0|3,0,0]=4 4171 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100000709168_200000210301 [0,1,0,0,0,0|3,0,0]=4 4172 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100138415774_100012353895 [0,1,0,0,0,0|3,0,0]=4 4173 B11R1.192 COCc1ccc(c(c1)Cl)Br 7a_100000709168_200000210301 [0,1,0,0,0,0|3,0,0]=4 4174 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100011290783_200000210301 [0,1,0,0,0,0|3,0,0]=4 4175 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100138415774_100011823929 [0,1,0,0,0,0|3,0,0]=4 4176 B11R1.192 COCc1ccc(c(c1)Cl)C 7a_100011290783_200000210301 [0,1,0,0,0,0|3,0,0]=4 4177 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100000211588_200000210301 [0,1,0,0,0,0|3,0,0]=4 4178 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100138415774_100000184707 [0,1,0,0,0,0|3,0,0]=4 4179 B11R1.192 COCc1ccc(c(c1)Cl)Cl 7a_100000211588_200000210301 [0,1,0,0,0,0|3,0,0]=4 4180 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100011217911_200000210301 [0,1,0,0,0,0|3,0,0]=4 4181 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100138415774_100011934319 [0,1,0,0,0,0|3,0,0]=4 4182 B11R1.192 COCc1ccc(c(c1)Cl)F 7a_100011217911_200000210301 [0,1,0,0,0,0|3,0,0]=4 4183 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100000718186_200000210301 [0,1,0,0,0,0|3,0,0]=4 4184 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100138415774_100012349665 [0,1,0,0,0,0|3,0,0]=4 4185 B11R1.192 COCc1ccc(c(c1)Cl)I 7a_100000718186_200000210301 [0,1,0,0,0,0|3,0,0]=4 4186 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100011533735_200000210301 [0,1,0,0,0,0|3,0,0]=4 4187 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100138415774_100000767054 [0,1,0,0,0,0|3,0,0]=4 4188 B11R1.192 COCc1ccc(c(c1)F)Br 7a_100011533735_200000210301 [0,1,0,0,0,0|3,0,0]=4 4189 B11R1.192 COCc1ccc(c(c1)F)C 34a_100000702247_200000210301 [0,1,0,0,0,0|3,0,0]=4 4190 B11R1.192 COCc1ccc(c(c1)F)C 34a_100138415774_100011217369 [0,1,0,0,0,0|3,0,0]=4 4191 B11R1.192 COCc1ccc(c(c1)F)C 7a_100000702247_200000210301 [0,1,0,0,0,0|3,0,0]=4 4192 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100011218299_200000210301 [0,1,0,0,0,0|3,0,0]=4 4193 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100138415774_100011519011 [0,1,0,0,0,0|3,0,0]=4 4194 B11R1.192 COCc1ccc(c(c1)F)Cl 7a_100011218299_200000210301 [0,1,0,0,0,0|3,0,0]=4 4195 B11R1.192 COCc1ccc(c(c1)F)F 34a_100011215442_200000210301 [0,1,0,0,0,0|3,0,0]=4 4196 B11R1.192 COCc1ccc(c(c1)F)F 34a_100138415774_100000757363 [0,1,0,0,0,0|3,0,0]=4 4197 B11R1.192 COCc1ccc(c(c1)F)F 7a_100011215442_200000210301 [0,1,0,0,0,0|3,0,0]=4 4198 B11R1.192 COCc1ccc(c(c1)F)I 34a_100010149597_200000210301 [0,1,0,0,0,0|3,0,0]=4 4199 B11R1.192 COCc1ccc(c(c1)F)I 34a_100138415774_100010149604 [0,1,0,0,0,0|3,0,0]=4 4200 B11R1.192 COCc1ccc(c(c1)F)I 7a_100010149597_200000210301 [0,1,0,0,0,0|3,0,0]=4 4201 B11R1.192 COCc1ccc(c(c1)F)N 34a_100011217239_200000210301 [0,1,0,0,0,0|3,0,0]=4 4202 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [0,1,0,0,0,0|2,0,0]=3 4203 B11R1.192 COCc1ccc(c(c1)I)Br 34a_100138415774_100010146616 [0,1,0,0,0,0|3,0,0]=4 4204 B11R1.192 COCc1ccc(c(c1)I)C 34a_100000050133_200000210301 [0,1,0,0,0,0|3,0,0]=4 4205 B11R1.192 COCc1ccc(c(c1)I)C 34a_100138415774_100010206137 [0,1,0,0,0,0|3,0,0]=4 4206 B11R1.192 COCc1ccc(c(c1)I)C 7a_100000050133_200000210301 [0,1,0,0,0,0|3,0,0]=4 4207 B11R1.192 COCc1ccc(c(c1)I)F 34a_100000049585_200000210301 [0,1,0,0,0,0|3,0,0]=4 4208 B11R1.192 COCc1ccc(c(c1)I)F 34a_100138415774_100010188208 [0,1,0,0,0,0|3,0,0]=4 4209 B11R1.192 COCc1ccc(c(c1)I)F 7a_100000049585_200000210301 [0,1,0,0,0,0|3,0,0]=4 4210 B11R1.192 COCc1ccc(c(c1)N)Br 34a_100012347568_200000210301 [0,1,0,0,0,0|3,0,0]=4 4211 B11R1.192 COCc1ccc(c(c1)N)C 34a_100000758420_200000210301 [0,1,0,0,0,0|3,0,0]=4 4212 B11R1.192 COCc1ccc(c(c1)N)Cl 34a_106256033963_200000210301 [0,1,0,0,0,0|3,0,0]=4 4213 B11R1.192 COCc1ccc(c(c1)N)F 34a_102125399562_200000210301 [0,1,0,0,0,0|3,0,0]=4 4214 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [0,1,0,0,0,0|2,0,0]=3 4215 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [0,1,0,0,0,0|3,0,0]=4 4216 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [0,1,0,0,0,0|3,0,0]=4 4217 B11R1.192 CSCc1cc(=O)c(co1)O 62a_200000210301_100000010605 [0,1,0,0,0,0|3,0,0]=4 4218 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_100012353900_200000210301 [0,1,0,0,0,0|3,0,0]=4 4219 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_200000210301_100012353900 [0,1,0,0,0,0|3,0,0]=4 4220 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_100012232412_200000210301 [0,1,0,0,0,0|3,0,0]=4 4221 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_200000210301_100012232412 [0,1,0,0,0,0|3,0,0]=4 4222 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_100012353894_200000210301 [0,1,0,0,0,0|3,0,0]=4 4223 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_200000210301_100012353894 [0,1,0,0,0,0|3,0,0]=4 4224 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_100011206884_200000210301 [0,1,0,0,0,0|3,0,0]=4 4225 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_200000210301_100011206884 [0,1,0,0,0,0|3,0,0]=4 4226 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_100000727479_200000210301 [0,1,0,0,0,0|3,0,0]=4 4227 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_200000210301_100000727479 [0,1,0,0,0,0|3,0,0]=4 4228 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [0,1,0,0,0,0|3,0,0]=4 4229 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [0,1,0,0,0,0|3,0,0]=4 4230 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_100012184735_200000210301 [0,1,0,0,0,0|3,0,0]=4 4231 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_200000210301_100012184735 [0,1,0,0,0,0|3,0,0]=4 4232 B11R1.192 CSCc1ccc(c(c1)C)F 62a_100011216667_200000210301 [0,1,0,0,0,0|3,0,0]=4 4233 B11R1.192 CSCc1ccc(c(c1)C)F 62a_200000210301_100011216667 [0,1,0,0,0,0|3,0,0]=4 4234 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_100012353895_200000210301 [0,1,0,0,0,0|3,0,0]=4 4235 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_200000210301_100012353895 [0,1,0,0,0,0|3,0,0]=4 4236 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_100011823929_200000210301 [0,1,0,0,0,0|3,0,0]=4 4237 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_200000210301_100011823929 [0,1,0,0,0,0|3,0,0]=4 4238 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_100000184707_200000210301 [0,1,0,0,0,0|3,0,0]=4 4239 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_200000210301_100000184707 [0,1,0,0,0,0|3,0,0]=4 4240 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_100000717365_200000210301 [0,1,0,0,0,0|3,0,0]=4 4241 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_200000210301_100011934319 [0,1,0,0,0,0|3,0,0]=4 4242 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_100012349665_200000210301 [0,1,0,0,0,0|3,0,0]=4 4243 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_200000210301_100012349665 [0,1,0,0,0,0|3,0,0]=4 4244 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_100000767054_200000210301 [0,1,0,0,0,0|3,0,0]=4 4245 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_200000210301_100000767054 [0,1,0,0,0,0|3,0,0]=4 4246 B11R1.192 CSCc1ccc(c(c1)F)C 62a_100011217369_200000210301 [0,1,0,0,0,0|3,0,0]=4 4247 B11R1.192 CSCc1ccc(c(c1)F)C 62a_200000210301_100011217369 [0,1,0,0,0,0|3,0,0]=4 4248 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_100000716492_200000210301 [0,1,0,0,0,0|3,0,0]=4 4249 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_200000210301_100000716492 [0,1,0,0,0,0|3,0,0]=4 4250 B11R1.192 CSCc1ccc(c(c1)F)F 62a_100000757363_200000210301 [0,1,0,0,0,0|3,0,0]=4 4251 B11R1.192 CSCc1ccc(c(c1)F)F 62a_200000210301_100000757363 [0,1,0,0,0,0|3,0,0]=4 4252 B11R1.192 CSCc1ccc(c(c1)F)I 62a_100010149604_200000210301 [0,1,0,0,0,0|3,0,0]=4 4253 B11R1.192 CSCc1ccc(c(c1)F)I 62a_200000210301_100010149604 [0,1,0,0,0,0|3,0,0]=4 4254 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_100010146616_200000210301 [0,1,0,0,0,0|3,0,0]=4 4255 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_200000210301_100010146616 [0,1,0,0,0,0|3,0,0]=4 4256 B11R1.192 CSCc1ccc(c(c1)I)C 62a_100010206137_200000210301 [0,1,0,0,0,0|3,0,0]=4 4257 B11R1.192 CSCc1ccc(c(c1)I)C 62a_200000210301_100010206137 [0,1,0,0,0,0|3,0,0]=4 4258 B11R1.192 CSCc1ccc(c(c1)I)F 62a_100010188208_200000210301 [0,1,0,0,0,0|3,0,0]=4 4259 B11R1.192 CSCc1ccc(c(c1)I)F 62a_200000210301_100010188208 [0,1,0,0,0,0|3,0,0]=4 4260 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [0,1,0,0,0,0|3,0,0]=4 4261 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [0,1,0,0,0,0|3,0,0]=4 4262 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [0,1,0,0,0,0|3,0,0]=4 4263 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [0,1,0,0,0,0|3,0,0]=4 4264 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_100000727479_200025704644 [0,1,0,0,0,0|3,0,0]=4 4265 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100000727479 [0,1,0,0,0,0|3,0,0]=4 4266 B11R1.192 Cc1cc(ccc1Br)NCF 34a_100000210723_100015361967 [0,1,0,0,0,0|3,0,0]=4 4267 B11R1.192 Cc1cc(ccc1Br)NCF 7a_100000210723_100015361967 [0,1,0,0,0,0|3,0,0]=4 4268 B11R1.192 Cc1cc(ccc1Br)OCF 34a_100000690111_100015361967 [0,1,0,0,0,0|2,0,0]=3 4269 B11R1.192 Cc1cc(ccc1Br)OCF 7a_100000690111_100015361967 [0,1,0,0,0,0|2,0,0]=3 4270 B11R1.192 Cc1cc(ccc1Br)SCF 62a_100009813585_100015361967 [0,1,0,0,0,0|2,1,0]=4 4271 B11R1.192 Cc1cc(ccc1Br)SCF 62a_100015361967_100009813585 [0,1,0,0,0,0|2,1,0]=4 4272 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_100012184735_200025704644 [0,1,0,0,0,0|3,0,0]=4 4273 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100012184735 [0,1,0,0,0,0|3,0,0]=4 4274 B11R1.192 Cc1cc(ccc1Cl)NCF 34a_100000187808_100015361967 [0,1,0,0,0,0|3,0,0]=4 4275 B11R1.192 Cc1cc(ccc1Cl)NCF 7a_100000187808_100015361967 [0,1,0,0,0,0|3,0,0]=4 4276 B11R1.192 Cc1cc(ccc1Cl)OCF 34a_100000211092_100015361967 [0,1,0,0,0,0|2,0,0]=3 4277 B11R1.192 Cc1cc(ccc1Cl)OCF 7a_100000211092_100015361967 [0,1,0,0,0,0|2,0,0]=3 4278 B11R1.192 Cc1cc(ccc1Cl)SCF 62a_100000049509_100015361967 [0,1,0,0,0,0|2,1,0]=4 4279 B11R1.192 Cc1cc(ccc1Cl)SCF 62a_100015361967_100000049509 [0,1,0,0,0,0|2,1,0]=4 4280 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [0,1,0,0,0,0|3,0,0]=4 4281 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [0,1,0,0,0,0|3,0,0]=4 4282 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [0,1,0,0,0,0|3,0,0]=4 4283 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [0,1,0,0,0,0|3,0,0]=4 4284 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_100011216667_200025704644 [0,1,0,0,0,0|3,0,0]=4 4285 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_200025704644_100011216667 [0,1,0,0,0,0|3,0,0]=4 4286 B11R1.192 Cc1cc(ccc1F)NCF 34a_100000750164_100015361967 [0,1,0,0,0,0|3,0,0]=4 4287 B11R1.192 Cc1cc(ccc1F)NCF 7a_100000750164_100015361967 [0,1,0,0,0,0|3,0,0]=4 4288 B11R1.192 Cc1cc(ccc1F)OCF 34a_100000751312_100015361967 [0,1,0,0,0,0|2,0,0]=3 4289 B11R1.192 Cc1cc(ccc1F)OCF 7a_100000751312_100015361967 [0,1,0,0,0,0|2,0,0]=3 4290 B11R1.192 Cc1cc(ccc1F)SCF 62a_100011218330_100015361967 [0,1,0,0,0,0|2,1,0]=4 4291 B11R1.192 Cc1cc(ccc1F)SCF 62a_100015361967_100011218330 [0,1,0,0,0,0|2,1,0]=4 4292 B11R1.192 Cc1cc(ccc1I)NCF 34a_100000198070_100015361967 [0,1,0,0,0,0|3,0,0]=4 4293 B11R1.192 Cc1cc(ccc1I)NCF 7a_100000198070_100015361967 [0,1,0,0,0,0|3,0,0]=4 4294 B11R1.192 Cc1cc(ccc1I)OCF 34a_100000729255_100015361967 [0,1,0,0,0,0|2,0,0]=3 4295 B11R1.192 Cc1cc(ccc1I)OCF 7a_100000729255_100015361967 [0,1,0,0,0,0|2,0,0]=3 4296 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [0,1,0,0,0,0|3,0,0]=4 4297 B11R1.192 Cc1cc(ccc1N)OCF 34a_100000756630_100015361967 [0,1,0,0,0,0|2,0,0]=3 4298 B11R1.192 Cc1cc(ccc1N)OCF 7a_100000756630_100015361967 [0,1,0,0,0,0|2,0,0]=3 4299 B11R1.192 Cc1cc(ccc1N)SCF 62a_100000211769_100015361967 [0,1,0,0,0,0|2,1,0]=4 4300 B11R1.192 Cc1cc(ccc1N)SCF 62a_100015361967_100000211769 [0,1,0,0,0,0|2,1,0]=4 4301 B11R1.192 Cc1cc(ccc1O)CC#N 271570a_203496583355_100000726167 [0,1,0,0,0,0|2,0,1]=4 4302 B11R1.192 Cc1cc(ccc1O)NCF 34a_100011218179_100015361967 [0,1,0,0,0,0|2,0,0]=3 4303 B11R1.192 Cc1cc(ccc1O)NCF 7a_100011218179_100015361967 [0,1,0,0,0,0|2,0,0]=3 4304 B11R1.192 Cc1cc(ccc1O)SCF 62a_100015361967_100000186361 [0,1,0,0,0,0|1,1,0]=3 4305 B11R1.192 Cc1cc(cnc1Br)OCF 34a_100012000486_100015361967 [0,1,0,0,0,0|3,0,0]=4 4306 B11R1.192 Cc1cc(cnc1Br)OCF 7a_100012000486_100015361967 [0,1,0,0,0,0|3,0,0]=4 4307 B11R1.192 Cc1cc(cnc1C)OCF 34a_100009854398_100015361967 [0,1,0,0,0,0|3,0,0]=4 4308 B11R1.192 Cc1cc(cnc1C)OCF 7a_100009854398_100015361967 [0,1,0,0,0,0|3,0,0]=4 4309 B11R1.192 Cc1cc(cnc1Cl)OCF 34a_100012002680_100015361967 [0,1,0,0,0,0|3,0,0]=4 4310 B11R1.192 Cc1cc(cnc1Cl)OCF 7a_100012002680_100015361967 [0,1,0,0,0,0|3,0,0]=4 4311 B11R1.192 Cc1cc(cnc1F)OCF 34a_100000094615_100015361967 [0,1,0,0,0,0|3,0,0]=4 4312 B11R1.192 Cc1cc(cnc1F)OCF 7a_100000094615_100015361967 [0,1,0,0,0,0|3,0,0]=4 4313 B11R1.192 Cc1cc(cnc1O)SCF 62a_100000685391_100015361967 [0,1,0,0,0,0|2,1,0]=4 4314 B11R1.192 Cc1cc(cnc1O)SCF 62a_100015361967_100000685391 [0,1,0,0,0,0|2,1,0]=4 4315 B11R1.192 Cc1cc(ncc1Br)OCF 34a_100000766222_100015361967 [0,1,0,0,0,0|3,0,0]=4 4316 B11R1.192 Cc1cc(ncc1Cl)OCF 34a_200000085746_100015361967 [0,1,0,0,0,0|3,0,0]=4 4317 B11R1.192 Cc1cc(ncc1O)SCF 62a_100015361967_100000692680 [0,1,0,0,0,0|2,1,0]=4 4318 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 34a_100000708995_200025704644 [0,1,0,0,0,0|3,0,0]=4 4319 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 7a_100000708995_200025704644 [0,1,0,0,0,0|3,0,0]=4 4320 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_100012232412_200025704644 [0,1,0,0,0,0|3,0,0]=4 4321 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_200025704644_100012232412 [0,1,0,0,0,0|3,0,0]=4 4322 B11R1.192 Cc1ccc(cc1Br)NCF 34a_100000736455_100015361967 [0,1,0,0,0,0|3,0,0]=4 4323 B11R1.192 Cc1ccc(cc1Br)NCF 7a_100000736455_100015361967 [0,1,0,0,0,0|3,0,0]=4 4324 B11R1.192 Cc1ccc(cc1Br)OCF 34a_100011380479_100015361967 [0,1,0,0,0,0|2,0,0]=3 4325 B11R1.192 Cc1ccc(cc1Br)OCF 7a_100011380479_100015361967 [0,1,0,0,0,0|2,0,0]=3 4326 B11R1.192 Cc1ccc(cc1Br)SCF 62a_100011847877_100015361967 [0,1,0,0,0,0|2,1,0]=4 4327 B11R1.192 Cc1ccc(cc1Br)SCF 62a_100015361967_100011847877 [0,1,0,0,0,0|2,1,0]=4 4328 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [0,1,0,0,0,0|3,0,0]=4 4329 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [0,1,0,0,0,0|3,0,0]=4 4330 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [0,1,0,0,0,0|3,0,0]=4 4331 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [0,1,0,0,0,0|3,0,0]=4 4332 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [0,1,0,0,0,0|3,0,0]=4 4333 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [0,1,0,0,0,0|3,0,0]=4 4334 B11R1.192 Cc1ccc(cc1C)NCF 34a_100000724040_100015361967 [0,1,0,0,0,0|3,0,0]=4 4335 B11R1.192 Cc1ccc(cc1C)NCF 7a_100000724040_100015361967 [0,1,0,0,0,0|3,0,0]=4 4336 B11R1.192 Cc1ccc(cc1C)OCF 34a_100000210932_100015361967 [0,1,0,0,0,0|2,0,0]=3 4337 B11R1.192 Cc1ccc(cc1C)OCF 7a_100000210932_100015361967 [0,1,0,0,0,0|2,0,0]=3 4338 B11R1.192 Cc1ccc(cc1C)SCF 62a_100011215607_100015361967 [0,1,0,0,0,0|2,1,0]=4 4339 B11R1.192 Cc1ccc(cc1C)SCF 62a_100015361967_100011215607 [0,1,0,0,0,0|2,1,0]=4 4340 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 2230a_102495364989_200025704644 [0,1,0,0,0,0|3,0,0]=4 4341 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 34a_102495364989_200025704644 [0,1,0,0,0,0|3,0,0]=4 4342 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 34a_100011290783_200025704644 [0,1,0,0,0,0|3,0,0]=4 4343 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 7a_100011290783_200025704644 [0,1,0,0,0,0|3,0,0]=4 4344 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_100011823929_200025704644 [0,1,0,0,0,0|3,0,0]=4 4345 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100011823929 [0,1,0,0,0,0|3,0,0]=4 4346 B11R1.192 Cc1ccc(cc1Cl)NCF 34a_100000188892_100015361967 [0,1,0,0,0,0|3,0,0]=4 4347 B11R1.192 Cc1ccc(cc1Cl)NCF 7a_100000188892_100015361967 [0,1,0,0,0,0|3,0,0]=4 4348 B11R1.192 Cc1ccc(cc1Cl)OCF 34a_100011265682_100015361967 [0,1,0,0,0,0|2,0,0]=3 4349 B11R1.192 Cc1ccc(cc1Cl)OCF 7a_100011265682_100015361967 [0,1,0,0,0,0|2,0,0]=3 4350 B11R1.192 Cc1ccc(cc1Cl)SCF 62a_100011216363_100015361967 [0,1,0,0,0,0|2,1,0]=4 4351 B11R1.192 Cc1ccc(cc1Cl)SCF 62a_100015361967_100011216363 [0,1,0,0,0,0|2,1,0]=4 4352 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 2230a_100102708794_200025704644 [0,1,0,0,0,0|3,0,0]=4 4353 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 34a_100102708794_200025704644 [0,1,0,0,0,0|3,0,0]=4 4354 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 34a_100000702247_200025704644 [0,1,0,0,0,0|3,0,0]=4 4355 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 7a_100000702247_200025704644 [0,1,0,0,0,0|3,0,0]=4 4356 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_100011217369_200025704644 [0,1,0,0,0,0|3,0,0]=4 4357 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_200025704644_100011217369 [0,1,0,0,0,0|3,0,0]=4 4358 B11R1.192 Cc1ccc(cc1F)NCF 34a_100000210958_100015361967 [0,1,0,0,0,0|3,0,0]=4 4359 B11R1.192 Cc1ccc(cc1F)NCF 7a_100000210958_100015361967 [0,1,0,0,0,0|3,0,0]=4 4360 B11R1.192 Cc1ccc(cc1F)OCF 34a_100000722560_100015361967 [0,1,0,0,0,0|2,0,0]=3 4361 B11R1.192 Cc1ccc(cc1F)OCF 7a_100000722560_100015361967 [0,1,0,0,0,0|2,0,0]=3 4362 B11R1.192 Cc1ccc(cc1F)SCF 62a_100000720648_100015361967 [0,1,0,0,0,0|2,1,0]=4 4363 B11R1.192 Cc1ccc(cc1F)SCF 62a_100015361967_100000720648 [0,1,0,0,0,0|2,1,0]=4 4364 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 34a_100000050133_200025704644 [0,1,0,0,0,0|3,0,0]=4 4365 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 7a_100000050133_200025704644 [0,1,0,0,0,0|3,0,0]=4 4366 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_100010206137_200025704644 [0,1,0,0,0,0|3,0,0]=4 4367 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_200025704644_100010206137 [0,1,0,0,0,0|3,0,0]=4 4368 B11R1.192 Cc1ccc(cc1I)NCF 34a_100000184131_100015361967 [0,1,0,0,0,0|3,0,0]=4 4369 B11R1.192 Cc1ccc(cc1I)NCF 7a_100000184131_100015361967 [0,1,0,0,0,0|3,0,0]=4 4370 B11R1.192 Cc1ccc(cc1N)CO[13CH3] 34a_100000758420_200025704644 [0,1,0,0,0,0|3,0,0]=4 4371 B11R1.192 Cc1ccc(cc1N)OCF 34a_100011216113_100015361967 [0,1,0,0,0,0|2,0,0]=3 4372 B11R1.192 Cc1ccc(cc1N)OCF 7a_100011216113_100015361967 [0,1,0,0,0,0|2,0,0]=3 4373 B11R1.192 Cc1ccc(cc1N)SCF 62a_100000761890_100015361967 [0,1,0,0,0,0|2,1,0]=4 4374 B11R1.192 Cc1ccc(cc1N)SCF 62a_100015361967_100000761890 [0,1,0,0,0,0|2,1,0]=4 4375 B11R1.192 Cc1ccc(cc1O)NCF 34a_100000759471_100015361967 [0,1,0,0,0,0|3,0,0]=4 4376 B11R1.192 Cc1ccc(cc1O)NCF 7a_100000759471_100015361967 [0,1,0,0,0,0|3,0,0]=4 4377 B11R1.192 Cc1ccc(cc1O)SCF 62a_100000685420_100015361967 [0,1,0,0,0,0|2,1,0]=4 4378 B11R1.192 Cc1ccc(cc1O)SCF 62a_100015361967_100000685420 [0,1,0,0,0,0|2,1,0]=4 4379 B11R1.192 Cc1cnc(cc1Br)OCF 34a_100009831917_100015361967 [0,1,0,0,0,0|3,0,0]=4 4380 B11R1.192 Cc1nc(ccc1Br)OCF 34a_100000691680_100015361967 [0,1,0,0,0,0|3,0,0]=4 4381 B11R1.192 Cc1nc(ccc1Cl)OCF 34a_200009863735_100015361967 [0,1,0,0,0,0|3,0,0]=4 4382 B11R1.192 Cc1nc(ccc1O)SCF 62a_100010233687_100015361967 [0,1,0,0,0,0|2,1,0]=4 4383 B11R1.192 Cc1nc(ccc1O)SCF 62a_100015361967_100010233687 [0,1,0,0,0,0|2,1,0]=4 4384 B11R1.192 Cc1ncc(cc1Br)OCF 34a_100009819603_100015361967 [0,1,0,0,0,0|3,0,0]=4 4385 B11R1.192 Cc1ncc(cc1Br)OCF 7a_100009819603_100015361967 [0,1,0,0,0,0|3,0,0]=4 4386 B11R1.192 FCNc1ccc(c(c1)Br)Br 34a_100011306057_100015361967 [0,1,0,0,0,0|3,0,0]=4 4387 B11R1.192 FCNc1ccc(c(c1)Br)Br 7a_100011306057_100015361967 [0,1,0,0,0,0|3,0,0]=4 4388 B11R1.192 FCNc1ccc(c(c1)Br)Cl 34a_100000686031_100015361967 [0,1,0,0,0,0|3,0,0]=4 4389 B11R1.192 FCNc1ccc(c(c1)Br)F 34a_100000760356_100015361967 [0,1,0,0,0,0|3,0,0]=4 4390 B11R1.192 FCNc1ccc(c(c1)Br)F 7a_100000760356_100015361967 [0,1,0,0,0,0|3,0,0]=4 4391 B11R1.192 FCNc1ccc(c(c1)Br)I 34a_100000750458_100015361967 [0,1,0,0,0,0|3,0,0]=4 4392 B11R1.192 FCNc1ccc(c(c1)Cl)Br 34a_100000687081_100015361967 [0,1,0,0,0,0|3,0,0]=4 4393 B11R1.192 FCNc1ccc(c(c1)Cl)Br 7a_100000687081_100015361967 [0,1,0,0,0,0|3,0,0]=4 4394 B11R1.192 FCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100015361967 [0,1,0,0,0,0|3,0,0]=4 4395 B11R1.192 FCNc1ccc(c(c1)Cl)F 34a_100000211060_100015361967 [0,1,0,0,0,0|3,0,0]=4 4396 B11R1.192 FCNc1ccc(c(c1)Cl)F 7a_100000211060_100015361967 [0,1,0,0,0,0|3,0,0]=4 4397 B11R1.192 FCNc1ccc(c(c1)Cl)I 34a_100000761885_100015361967 [0,1,0,0,0,0|3,0,0]=4 4398 B11R1.192 FCNc1ccc(c(c1)F)Br 34a_100000759894_100015361967 [0,1,0,0,0,0|3,0,0]=4 4399 B11R1.192 FCNc1ccc(c(c1)F)Br 7a_100000759894_100015361967 [0,1,0,0,0,0|3,0,0]=4 4400 B11R1.192 FCNc1ccc(c(c1)F)Cl 34a_100000739366_100015361967 [0,1,0,0,0,0|3,0,0]=4 4401 B11R1.192 FCNc1ccc(c(c1)F)Cl 7a_100000739366_100015361967 [0,1,0,0,0,0|3,0,0]=4 4402 B11R1.192 FCNc1ccc(c(c1)F)F 34a_100000210724_100015361967 [0,1,0,0,0,0|3,0,0]=4 4403 B11R1.192 FCNc1ccc(c(c1)F)F 7a_100000210724_100015361967 [0,1,0,0,0,0|3,0,0]=4 4404 B11R1.192 FCNc1ccc(c(c1)F)I 34a_100011356925_100015361967 [0,1,0,0,0,0|3,0,0]=4 4405 B11R1.192 FCNc1ccc(c(c1)F)I 7a_100011356925_100015361967 [0,1,0,0,0,0|3,0,0]=4 4406 B11R1.192 FCNc1ccc(c(c1)I)Br 34a_100000750459_100015361967 [0,1,0,0,0,0|3,0,0]=4 4407 B11R1.192 FCNc1ccc(c(c1)I)Cl 34a_100012360549_100015361967 [0,1,0,0,0,0|3,0,0]=4 4408 B11R1.192 FCNc1ccc(c(c1)I)F 34a_114828291077_100015361967 [0,1,0,0,0,0|3,0,0]=4 4409 B11R1.192 FCNc1ccc(c(c1)I)F 7a_114828291077_100015361967 [0,1,0,0,0,0|3,0,0]=4 4410 B11R1.192 FCOc1cc(c(cn1)Br)Cl 34a_100010369989_100015361967 [0,1,0,0,0,0|3,0,0]=4 4411 B11R1.192 FCOc1cc(c(cn1)Cl)Cl 34a_200000099200_100015361967 [0,1,0,0,0,0|3,0,0]=4 4412 B11R1.192 FCOc1ccc(c(c1)Br)Cl 34a_100011933957_100015361967 [0,1,0,0,0,0|2,0,0]=3 4413 B11R1.192 FCOc1ccc(c(c1)Br)Cl 7a_100011933957_100015361967 [0,1,0,0,0,0|2,0,0]=3 4414 B11R1.192 FCOc1ccc(c(c1)Br)F 34a_100000693481_100015361967 [0,1,0,0,0,0|2,0,0]=3 4415 B11R1.192 FCOc1ccc(c(c1)Br)F 7a_100000693481_100015361967 [0,1,0,0,0,0|2,0,0]=3 4416 B11R1.192 FCOc1ccc(c(c1)Br)I 34a_100000701344_100015361967 [0,1,0,0,0,0|2,0,0]=3 4417 B11R1.192 FCOc1ccc(c(c1)Br)I 7a_100000701344_100015361967 [0,1,0,0,0,0|2,0,0]=3 4418 B11R1.192 FCOc1ccc(c(c1)Cl)Br 34a_100011215161_100015361967 [0,1,0,0,0,0|2,0,0]=3 4419 B11R1.192 FCOc1ccc(c(c1)Cl)Br 7a_100011215161_100015361967 [0,1,0,0,0,0|2,0,0]=3 4420 B11R1.192 FCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100015361967 [0,1,0,0,0,0|2,0,0]=3 4421 B11R1.192 FCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100015361967 [0,1,0,0,0,0|2,0,0]=3 4422 B11R1.192 FCOc1ccc(c(c1)Cl)F 34a_100000211030_100015361967 [0,1,0,0,0,0|2,0,0]=3 4423 B11R1.192 FCOc1ccc(c(c1)Cl)F 7a_100000211030_100015361967 [0,1,0,0,0,0|2,0,0]=3 4424 B11R1.192 FCOc1ccc(c(c1)Cl)I 34a_100000047559_100015361967 [0,1,0,0,0,0|2,0,0]=3 4425 B11R1.192 FCOc1ccc(c(c1)Cl)I 7a_100000047559_100015361967 [0,1,0,0,0,0|2,0,0]=3 4426 B11R1.192 FCOc1ccc(c(c1)F)Br 34a_100000755031_100015361967 [0,1,0,0,0,0|2,0,0]=3 4427 B11R1.192 FCOc1ccc(c(c1)F)Br 7a_100000755031_100015361967 [0,1,0,0,0,0|2,0,0]=3 4428 B11R1.192 FCOc1ccc(c(c1)F)Cl 34a_100000691581_100015361967 [0,1,0,0,0,0|2,0,0]=3 4429 B11R1.192 FCOc1ccc(c(c1)F)Cl 7a_100000691581_100015361967 [0,1,0,0,0,0|2,0,0]=3 4430 B11R1.192 FCOc1ccc(c(c1)F)F 34a_100000181275_100015361967 [0,1,0,0,0,0|2,0,0]=3 4431 B11R1.192 FCOc1ccc(c(c1)F)F 7a_100000181275_100015361967 [0,1,0,0,0,0|2,0,0]=3 4432 B11R1.192 FCOc1ccc(c(c1)F)I 34a_100009990212_100015361967 [0,1,0,0,0,0|2,0,0]=3 4433 B11R1.192 FCOc1ccc(c(c1)F)I 7a_100009990212_100015361967 [0,1,0,0,0,0|2,0,0]=3 4434 B11R1.192 FCOc1ccc(c(c1)I)Br 34a_100012339312_100015361967 [0,1,0,0,0,0|2,0,0]=3 4435 B11R1.192 FCOc1ccc(c(c1)I)Br 7a_100012339312_100015361967 [0,1,0,0,0,0|2,0,0]=3 4436 B11R1.192 FCOc1ccc(c(c1)I)Cl 34a_100000049588_100015361967 [0,1,0,0,0,0|2,0,0]=3 4437 B11R1.192 FCOc1ccc(c(c1)I)Cl 7a_100000049588_100015361967 [0,1,0,0,0,0|2,0,0]=3 4438 B11R1.192 FCOc1ccc(c(n1)F)Br 34a_100009879308_100015361967 [0,1,0,0,0,0|3,0,0]=4 4439 B11R1.192 FCOc1cnc(c(c1)Br)Cl 34a_100012356455_100015361967 [0,1,0,0,0,0|3,0,0]=4 4440 B11R1.192 FCOc1cnc(c(c1)Br)Cl 7a_100012356455_100015361967 [0,1,0,0,0,0|3,0,0]=4 4441 B11R1.192 FCOc1cnc(c(c1)Br)F 34a_100009817267_100015361967 [0,1,0,0,0,0|3,0,0]=4 4442 B11R1.192 FCOc1cnc(c(c1)Br)F 7a_100009817267_100015361967 [0,1,0,0,0,0|3,0,0]=4 4443 B11R1.192 FCOc1cnc(c(c1)Cl)Br 34a_100010209684_100015361967 [0,1,0,0,0,0|3,0,0]=4 4444 B11R1.192 FCOc1cnc(c(c1)Cl)Br 7a_100010209684_100015361967 [0,1,0,0,0,0|3,0,0]=4 4445 B11R1.192 FCOc1cnc(c(c1)Cl)Cl 34a_100000094354_100015361967 [0,1,0,0,0,0|3,0,0]=4 4446 B11R1.192 FCOc1cnc(c(c1)Cl)Cl 7a_100000094354_100015361967 [0,1,0,0,0,0|3,0,0]=4 4447 B11R1.192 FCOc1cnc(c(c1)Cl)F 34a_100000087088_100015361967 [0,1,0,0,0,0|3,0,0]=4 4448 B11R1.192 FCOc1cnc(c(c1)Cl)F 7a_100000087088_100015361967 [0,1,0,0,0,0|3,0,0]=4 4449 B11R1.192 FCOc1cnc(c(c1)F)Cl 34a_100000063512_100015361967 [0,1,0,0,0,0|3,0,0]=4 4450 B11R1.192 FCOc1cnc(c(c1)F)Cl 7a_100000063512_100015361967 [0,1,0,0,0,0|3,0,0]=4 4451 B11R1.192 FCSc1ccc(c(c1)Br)Br 62a_100012356285_100015361967 [0,1,0,0,0,0|2,1,0]=4 4452 B11R1.192 FCSc1ccc(c(c1)Br)Br 62a_100015361967_100012356285 [0,1,0,0,0,0|2,1,0]=4 4453 B11R1.192 FCSc1ccc(c(c1)Br)Cl 62a_100012353702_100015361967 [0,1,0,0,0,0|2,1,0]=4 4454 B11R1.192 FCSc1ccc(c(c1)Br)Cl 62a_100015361967_100012353702 [0,1,0,0,0,0|2,1,0]=4 4455 B11R1.192 FCSc1ccc(c(c1)Br)F 62a_100012047266_100015361967 [0,1,0,0,0,0|2,1,0]=4 4456 B11R1.192 FCSc1ccc(c(c1)Br)F 62a_100015361967_100012047266 [0,1,0,0,0,0|2,1,0]=4 4457 B11R1.192 FCSc1ccc(c(c1)Cl)Br 62a_100012047281_100015361967 [0,1,0,0,0,0|2,1,0]=4 4458 B11R1.192 FCSc1ccc(c(c1)Cl)Br 62a_100015361967_100012047281 [0,1,0,0,0,0|2,1,0]=4 4459 B11R1.192 FCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100015361967 [0,1,0,0,0,0|2,1,0]=4 4460 B11R1.192 FCSc1ccc(c(c1)Cl)Cl 62a_100015361967_100011214914 [0,1,0,0,0,0|2,1,0]=4 4461 B11R1.192 FCSc1ccc(c(c1)Cl)F 62a_100011215976_100015361967 [0,1,0,0,0,0|2,1,0]=4 4462 B11R1.192 FCSc1ccc(c(c1)Cl)F 62a_100015361967_100011215976 [0,1,0,0,0,0|2,1,0]=4 4463 B11R1.192 FCSc1ccc(c(c1)F)Br 62a_100000685389_100015361967 [0,1,0,0,0,0|2,1,0]=4 4464 B11R1.192 FCSc1ccc(c(c1)F)Br 62a_100015361967_100000685389 [0,1,0,0,0,0|2,1,0]=4 4465 B11R1.192 FCSc1ccc(c(c1)F)Cl 62a_100011216805_100015361967 [0,1,0,0,0,0|2,1,0]=4 4466 B11R1.192 FCSc1ccc(c(c1)F)Cl 62a_100015361967_100011216805 [0,1,0,0,0,0|2,1,0]=4 4467 B11R1.192 FCSc1ccc(c(c1)F)F 62a_100000703953_100015361967 [0,1,0,0,0,0|2,1,0]=4 4468 B11R1.192 FCSc1ccc(c(c1)F)F 62a_100015361967_100000703953 [0,1,0,0,0,0|2,1,0]=4 4469 B11R1.192 N#CCc1ccc(c(c1)F)O 271570a_203496583355_100000691973 [0,1,0,0,0,0|2,0,1]=4 4470 B11R1.192 N#CSc1ccc(c(c1)F)O 271570a_203496583355_100025703552 [0,1,0,0,0,0|1,1,1]=4 4471 B11R1.192 Nc1cc(ccc1Br)OCF 34a_100011999798_100015361967 [0,1,0,0,0,0|2,0,0]=3 4472 B11R1.192 Nc1cc(ccc1Br)OCF 7a_100011999798_100015361967 [0,1,0,0,0,0|2,0,0]=3 4473 B11R1.192 Nc1cc(ccc1Br)SCF 62a_100000750456_100015361967 [0,1,0,0,0,0|2,1,0]=4 4474 B11R1.192 Nc1cc(ccc1Br)SCF 62a_100015361967_100000750456 [0,1,0,0,0,0|2,1,0]=4 4475 B11R1.192 Nc1cc(ccc1Cl)OCF 34a_100011934297_100015361967 [0,1,0,0,0,0|2,0,0]=3 4476 B11R1.192 Nc1cc(ccc1Cl)SCF 62a_100015361967_200000761891 [0,1,0,0,0,0|2,1,0]=4 4477 B11R1.192 Nc1cc(ccc1Cl)SCF 62a_200000761891_100015361967 [0,1,0,0,0,0|2,1,0]=4 4478 B11R1.192 Nc1cc(ccc1F)OCF 34a_100012017239_100015361967 [0,1,0,0,0,0|2,0,0]=3 4479 B11R1.192 Nc1cc(ccc1F)OCF 7a_100012017239_100015361967 [0,1,0,0,0,0|2,0,0]=3 4480 B11R1.192 Nc1cc(ccc1F)SCF 62a_100000740924_100015361967 [0,1,0,0,0,0|2,1,0]=4 4481 B11R1.192 Nc1cc(ccc1F)SCF 62a_100015361967_100000740924 [0,1,0,0,0,0|2,1,0]=4 4482 B11R1.192 Nc1cc(ccc1O)SCF 62a_100000752626_100015361967 [0,1,0,0,0,0|1,1,0]=3 4483 B11R1.192 Nc1cc(ccc1O)SCF 62a_100015361967_100000752626 [0,1,0,0,0,0|1,1,0]=3 4484 B11R1.192 Nc1cc(cnc1O)SCF 62a_100000743729_100015361967 [0,1,0,0,0,0|2,1,0]=4 4485 B11R1.192 Nc1cc(cnc1O)SCF 62a_100015361967_100000743729 [0,1,0,0,0,0|2,1,0]=4 4486 B11R1.192 Nc1cc(ncc1O)SCF 62a_100009819941_100015361967 [0,1,0,0,0,0|2,1,0]=4 4487 B11R1.192 Nc1cc(ncc1O)SCF 62a_100015361967_100009819941 [0,1,0,0,0,0|2,1,0]=4 4488 B11R1.192 Nc1ccc(cc1Br)OCF 34a_100012001276_100015361967 [0,1,0,0,0,0|2,0,0]=3 4489 B11R1.192 Nc1ccc(cc1Br)OCF 7a_100012001276_100015361967 [0,1,0,0,0,0|2,0,0]=3 4490 B11R1.192 Nc1ccc(cc1Br)SCF 62a_100000750455_100015361967 [0,1,0,0,0,0|2,1,0]=4 4491 B11R1.192 Nc1ccc(cc1Br)SCF 62a_100015361967_100000750455 [0,1,0,0,0,0|2,1,0]=4 4492 B11R1.192 Nc1ccc(cc1Cl)OCF 34a_100011215599_100015361967 [0,1,0,0,0,0|2,0,0]=3 4493 B11R1.192 Nc1ccc(cc1Cl)OCF 7a_100011215599_100015361967 [0,1,0,0,0,0|2,0,0]=3 4494 B11R1.192 Nc1ccc(cc1Cl)SCF 62a_100011218065_100015361967 [0,1,0,0,0,0|2,1,0]=4 4495 B11R1.192 Nc1ccc(cc1Cl)SCF 62a_100015361967_100011218065 [0,1,0,0,0,0|2,1,0]=4 4496 B11R1.192 Nc1ccc(cc1F)OCF 34a_100000759473_100015361967 [0,1,0,0,0,0|2,0,0]=3 4497 B11R1.192 Nc1ccc(cc1F)OCF 7a_100000759473_100015361967 [0,1,0,0,0,0|2,0,0]=3 4498 B11R1.192 Nc1ccc(cc1F)SCF 62a_100011215594_100015361967 [0,1,0,0,0,0|2,1,0]=4 4499 B11R1.192 Nc1ccc(cc1F)SCF 62a_100015361967_100011215594 [0,1,0,0,0,0|2,1,0]=4 4500 B11R1.192 Nc1ccc(cc1I)OCF 34a_100010084370_100015361967 [0,1,0,0,0,0|2,0,0]=3 4501 B11R1.192 Nc1ccc(cc1I)OCF 7a_100010084370_100015361967 [0,1,0,0,0,0|2,0,0]=3 4502 B11R1.192 Nc1ccc(cc1N)OCF 34a_100025771000_100015361967 [0,1,0,0,0,0|2,0,0]=3 4503 B11R1.192 Nc1ccc(cc1N)SCF 62a_100000741789_100015361967 [0,1,0,0,0,0|2,1,0]=4 4504 B11R1.192 Nc1ccc(cc1N)SCF 62a_100015361967_100011534411 [0,1,0,0,0,0|2,1,0]=4 4505 B11R1.192 Nc1ccc(cc1O)SCF 62a_100000739049_100015361967 [0,1,0,0,0,0|2,1,0]=4 4506 B11R1.192 Nc1ccc(cc1O)SCF 62a_100015361967_100000739049 [0,1,0,0,0,0|2,1,0]=4 4507 B11R1.192 Nc1nc(ccc1O)SCF 62a_100000685527_100015361967 [0,1,0,0,0,0|2,1,0]=4 4508 B11R1.192 Nc1nc(ccc1O)SCF 62a_100015361967_100000685527 [0,1,0,0,0,0|2,1,0]=4 4509 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [0,1,0,0,0,0|2,0,0]=3 4510 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100012356990_100015361967 [0,1,0,0,0,0|2,1,0]=4 4511 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100015361967_100012356990 [0,1,0,0,0,0|2,1,0]=4 4512 B11R1.192 Oc1cc(ccc1Cl)NCF 34a_100011934209_100015361967 [0,1,0,0,0,0|3,0,0]=4 4513 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100011356854_100015361967 [0,1,0,0,0,0|2,1,0]=4 4514 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100015361967_100011356854 [0,1,0,0,0,0|2,1,0]=4 4515 B11R1.192 Oc1cc(ccc1F)NCF 34a_100012017398_100015361967 [0,1,0,0,0,0|3,0,0]=4 4516 B11R1.192 Oc1cc(ccc1F)NCF 7a_100012017398_100015361967 [0,1,0,0,0,0|3,0,0]=4 4517 B11R1.192 Oc1cc(ccc1F)SCF 62a_100000686035_100015361967 [0,1,0,0,0,0|2,1,0]=4 4518 B11R1.192 Oc1cc(ccc1F)SCF 62a_100015361967_100000686035 [0,1,0,0,0,0|2,1,0]=4 4519 B11R1.192 Oc1ccc(cc1Br)NCF 34a_100011534360_100015361967 [0,1,0,0,0,0|2,0,0]=3 4520 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100012361655_100015361967 [0,1,0,0,0,0|1,1,0]=3 4521 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100015361967_100012361655 [0,1,0,0,0,0|1,1,0]=3 4522 B11R1.192 Oc1ccc(cc1Cl)NCF 34a_100000744943_100015361967 [0,1,0,0,0,0|2,0,0]=3 4523 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100012360047_100015361967 [0,1,0,0,0,0|1,1,0]=3 4524 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100015361967_100012360047 [0,1,0,0,0,0|1,1,0]=3 4525 B11R1.192 Oc1ccc(cc1F)NCF 34a_100011220035_100015361967 [0,1,0,0,0,0|2,0,0]=3 4526 B11R1.192 Oc1ccc(cc1F)NCF 7a_100011220035_100015361967 [0,1,0,0,0,0|2,0,0]=3 4527 B11R1.192 Oc1ccc(cc1F)SCF 62a_100000185481_100015361967 [0,1,0,0,0,0|1,1,0]=3 4528 B11R1.192 Oc1ccc(cc1F)SCF 62a_100015361967_100000185481 [0,1,0,0,0,0|1,1,0]=3 4529 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [0,1,0,0,0,0|2,0,0]=3 4530 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [0,1,0,0,0,0|1,1,0]=3 4531 B11R1.192 Oc1ccc(nc1Br)SCF 62a_100000725334_100015361967 [0,1,0,0,0,0|2,1,0]=4 4532 B11R1.192 Oc1ccc(nc1Br)SCF 62a_100015361967_100000725334 [0,1,0,0,0,0|2,1,0]=4 4533 B11R1.192 Oc1ccc(nc1Cl)SCF 62a_100015361967_100000721234 [0,1,0,0,0,0|2,1,0]=4 4534 B11R1.192 Oc1ccc(nc1F)SCF 62a_100009819667_100015361967 [0,1,0,0,0,0|2,1,0]=4 4535 B11R1.192 Oc1ccc(nc1F)SCF 62a_100015361967_100009819667 [0,1,0,0,0,0|2,1,0]=4 4536 B11R1.192 Oc1ncc(cc1Cl)SCF 62a_100010238531_100015361967 [0,1,0,0,0,0|2,1,0]=4 4537 B11R1.192 Oc1ncc(cc1Cl)SCF 62a_100015361967_100010238531 [0,1,0,0,0,0|2,1,0]=4 4538 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 2230a_100012351559_200025704644 [0,1,0,0,0,0|3,0,0]=4 4539 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 34a_100012351559_200025704644 [0,1,0,0,0,0|3,0,0]=4 4540 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 2230a_100012349490_200025704644 [0,1,0,0,0,0|3,0,0]=4 4541 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 34a_100012349490_200025704644 [0,1,0,0,0,0|3,0,0]=4 4542 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 2230a_100015193890_200025704644 [0,1,0,0,0,0|3,0,0]=4 4543 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 34a_100015193890_200025704644 [0,1,0,0,0,0|3,0,0]=4 4544 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 2230a_100012362553_200025704644 [0,1,0,0,0,0|3,0,0]=4 4545 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 34a_100012362553_200025704644 [0,1,0,0,0,0|3,0,0]=4 4546 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200025704644 [0,1,0,0,0,0|3,0,0]=4 4547 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 34a_100000174881_200025704644 [0,1,0,0,0,0|3,0,0]=4 4548 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 2230a_100000749334_200025704644 [0,1,0,0,0,0|3,0,0]=4 4549 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 34a_100000749334_200025704644 [0,1,0,0,0,0|3,0,0]=4 4550 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 2230a_100000755036_200025704644 [0,1,0,0,0,0|3,0,0]=4 4551 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 34a_100000755036_200025704644 [0,1,0,0,0,0|3,0,0]=4 4552 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 2230a_100011219866_200025704644 [0,1,0,0,0,0|3,0,0]=4 4553 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 34a_100011219866_200025704644 [0,1,0,0,0,0|3,0,0]=4 4554 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 2230a_100000737897_200025704644 [0,1,0,0,0,0|3,0,0]=4 4555 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 34a_100000737897_200025704644 [0,1,0,0,0,0|3,0,0]=4 4556 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [0,1,0,0,0,0|2,0,0]=3 4557 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [0,1,0,0,0,0|3,0,0]=4 4558 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [0,1,0,0,0,0|3,0,0]=4 4559 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [0,1,0,0,0,0|2,0,0]=3 4560 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 34a_100012353893_200025704644 [0,1,0,0,0,0|3,0,0]=4 4561 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 7a_100012353893_200025704644 [0,1,0,0,0,0|3,0,0]=4 4562 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 34a_100000246287_200025704644 [0,1,0,0,0,0|3,0,0]=4 4563 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 7a_100000246287_200025704644 [0,1,0,0,0,0|3,0,0]=4 4564 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 34a_100000709168_200025704644 [0,1,0,0,0,0|3,0,0]=4 4565 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 7a_100000709168_200025704644 [0,1,0,0,0,0|3,0,0]=4 4566 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 34a_100000211588_200025704644 [0,1,0,0,0,0|3,0,0]=4 4567 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 7a_100000211588_200025704644 [0,1,0,0,0,0|3,0,0]=4 4568 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 34a_100011217911_200025704644 [0,1,0,0,0,0|3,0,0]=4 4569 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 7a_100011217911_200025704644 [0,1,0,0,0,0|3,0,0]=4 4570 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 34a_100000718186_200025704644 [0,1,0,0,0,0|3,0,0]=4 4571 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 7a_100000718186_200025704644 [0,1,0,0,0,0|3,0,0]=4 4572 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 34a_100011533735_200025704644 [0,1,0,0,0,0|3,0,0]=4 4573 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 7a_100011533735_200025704644 [0,1,0,0,0,0|3,0,0]=4 4574 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 34a_100011218299_200025704644 [0,1,0,0,0,0|3,0,0]=4 4575 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 7a_100011218299_200025704644 [0,1,0,0,0,0|3,0,0]=4 4576 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 34a_100011215442_200025704644 [0,1,0,0,0,0|3,0,0]=4 4577 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 7a_100011215442_200025704644 [0,1,0,0,0,0|3,0,0]=4 4578 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 34a_100010149597_200025704644 [0,1,0,0,0,0|3,0,0]=4 4579 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 7a_100010149597_200025704644 [0,1,0,0,0,0|3,0,0]=4 4580 B11R1.192 [13CH3]OCc1ccc(c(c1)F)N 34a_100011217239_200025704644 [0,1,0,0,0,0|3,0,0]=4 4581 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 34a_100000049585_200025704644 [0,1,0,0,0,0|3,0,0]=4 4582 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 7a_100000049585_200025704644 [0,1,0,0,0,0|3,0,0]=4 4583 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Br 34a_100012347568_200025704644 [0,1,0,0,0,0|3,0,0]=4 4584 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Cl 34a_106256033963_200025704644 [0,1,0,0,0,0|3,0,0]=4 4585 B11R1.192 [13CH3]OCc1ccc(c(c1)N)F 34a_102125399562_200025704644 [0,1,0,0,0,0|3,0,0]=4 4586 B11R1.192 [13CH3]SCc1cc(=O)c(co1)O 62a_200025704644_100000010605 [0,1,0,0,0,0|3,0,0]=4 4587 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_100012353900_200025704644 [0,1,0,0,0,0|3,0,0]=4 4588 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_200025704644_100012353900 [0,1,0,0,0,0|3,0,0]=4 4589 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_100012353894_200025704644 [0,1,0,0,0,0|3,0,0]=4 4590 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_200025704644_100012353894 [0,1,0,0,0,0|3,0,0]=4 4591 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_100011206884_200025704644 [0,1,0,0,0,0|3,0,0]=4 4592 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_200025704644_100011206884 [0,1,0,0,0,0|3,0,0]=4 4593 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_100012353895_200025704644 [0,1,0,0,0,0|3,0,0]=4 4594 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_200025704644_100012353895 [0,1,0,0,0,0|3,0,0]=4 4595 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_100000184707_200025704644 [0,1,0,0,0,0|3,0,0]=4 4596 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_200025704644_100000184707 [0,1,0,0,0,0|3,0,0]=4 4597 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_100000717365_200025704644 [0,1,0,0,0,0|3,0,0]=4 4598 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_200025704644_100011934319 [0,1,0,0,0,0|3,0,0]=4 4599 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_100012349665_200025704644 [0,1,0,0,0,0|3,0,0]=4 4600 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_200025704644_100012349665 [0,1,0,0,0,0|3,0,0]=4 4601 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_100000767054_200025704644 [0,1,0,0,0,0|3,0,0]=4 4602 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_200025704644_100000767054 [0,1,0,0,0,0|3,0,0]=4 4603 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_100000716492_200025704644 [0,1,0,0,0,0|3,0,0]=4 4604 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_200025704644_100000716492 [0,1,0,0,0,0|3,0,0]=4 4605 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_100000757363_200025704644 [0,1,0,0,0,0|3,0,0]=4 4606 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_200025704644_100000757363 [0,1,0,0,0,0|3,0,0]=4 4607 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_100010149604_200025704644 [0,1,0,0,0,0|3,0,0]=4 4608 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_200025704644_100010149604 [0,1,0,0,0,0|3,0,0]=4 4609 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_100010146616_200025704644 [0,1,0,0,0,0|3,0,0]=4 4610 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_200025704644_100010146616 [0,1,0,0,0,0|3,0,0]=4 4611 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_100010188208_200025704644 [0,1,0,0,0,0|3,0,0]=4 4612 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_200025704644_100010188208 [0,1,0,0,0,0|3,0,0]=4 4613 B9R0.48 CCOC(=O)C=CC(=O)C 1458a_100000210415_200000210301 [0,0,1,0,0,0|1,0,2]=4 4614 B9R0.48 CCOC(=O)C=CC(=O)[13CH3] 1458a_100000210415_200025704644 [0,0,1,0,0,0|1,0,2]=4 4615 B11R2.34 Brc1ccc(cc1)C2CC2 271570a_100011220607_100000752885 [0,0,0,1,0,0|2,0,0]=3 4616 B11R2.34 Brc1ccc(cn1)C2CC2 271570a_100011220607_100009814638 [0,0,0,1,0,0|3,0,0]=4 4617 B11R2.34 Brc1ccc(nc1)C2CC2 271570a_100011220607_100000686858 [0,0,0,1,0,0|3,0,0]=4 4618 B11R2.34 Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186775 [0,0,0,1,0,0|2,0,0]=3 4619 B11R2.34 Cc1ccc(cn1)C2CC2 271570a_100011220607_100000751577 [0,0,0,1,0,0|3,0,0]=4 4620 B11R2.34 Cc1ccc(nc1)C2CC2 271570a_100011220607_100000754016 [0,0,0,1,0,0|3,0,0]=4 4621 B11R2.34 Clc1ccc(cc1)C2CC2 271570a_100011220607_100000755918 [0,0,0,1,0,0|2,0,0]=3 4622 B11R2.34 Clc1ccc(cn1)C2CC2 271570a_100011220607_100000034144 [0,0,0,1,0,0|3,0,0]=4 4623 B11R2.34 Clc1ccc(nc1)C2CC2 271570a_100011220607_100011356976 [0,0,0,1,0,0|3,0,0]=4 4624 B11R2.34 Fc1ccc(cc1)C2CC2 271570a_100011220607_100000211213 [0,0,0,1,0,0|2,0,0]=3 4625 B11R2.34 Fc1ccc(cn1)C2CC2 271570a_100011220607_100000748661 [0,0,0,1,0,0|3,0,0]=4 4626 B11R2.34 Fc1ccc(nc1)C2CC2 271570a_100011220607_100000744514 [0,0,0,1,0,0|3,0,0]=4 4627 B11R2.34 Nc1ccc(cc1)C2CC2 271570a_100011220607_100000185761 [0,0,0,1,0,0|2,0,0]=3 4628 B11R2.34 Nc1ccc(cn1)C2CC2 271570a_100011220607_100000187370 [0,0,0,1,0,0|3,0,0]=4 4629 B11R2.34 Nc1ccc(nc1)C2CC2 271570a_100011220607_100000744251 [0,0,0,1,0,0|3,0,0]=4 4630 B11R2.34 O=c1ccc(c[nH]1)C2CC2 271570a_100011220607_100000212171 [0,0,0,1,0,0|2,0,1]=4 4631 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_100011220607_100000185759 [0,0,0,1,0,0|1,0,0]=2 4632 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_203496583355_100009820665 [0,0,0,1,0,0|1,0,0]=2 4633 B11R2.34 Oc1ccc(cn1)C2CC2 271570a_203496583355_200000118129 [0,0,0,1,0,0|2,0,0]=3 4634 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_100011220607_100000685995 [0,0,0,1,0,0|2,0,0]=3 4635 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_203496583355_100009850895 [0,0,0,1,0,0|2,0,0]=3 4636 B11R2.34 Oc1ccc(nn1)C2CC2 271570a_203496583355_100000754422 [0,0,0,1,0,0|3,0,0]=4 4637 B11R2.34 Oc1cnc(cn1)C2CC2 271570a_203496583355_100012002519 [0,0,0,1,0,0|3,0,0]=4 4638 B11R2.34 Oc1cnc(nc1)C2CC2 271570a_100011220607_100000730009 [0,0,0,1,0,0|3,0,0]=4 4639 B11R2.34 Oc1cnc(nc1)C2CC2 271570a_203496583355_100009840968 [0,0,0,1,0,0|3,0,0]=4 4640 B11R2.34 Oc1ncc(cn1)C2CC2 271570a_203496583355_100009869053 [0,0,0,1,0,0|3,0,0]=4 4641 B11R2.34 [O-][n+]1ccc(cc1)C2CC2 271570a_100011220607_100000039755 [0,0,0,1,0,0|2,0,1]=4 4642 B11R2.36 Oc1cc2c(cn1)CCN2 271570a_203496583355_100020639910 [0,0,0,1,0,0|3,0,0]=4 4643 B11R2.36 Oc1cc2c(cn1)CNC2 271570a_203496583355_100020645637 [0,0,0,1,0,0|3,0,0]=4 4644 B11R2.36 Oc1cc2c(cn1)NCC2 271570a_203496583355_100009884275 [0,0,0,1,0,0|2,0,0]=3 4645 B11R2.36 Oc1cc2c(cn1)OCC2 271570a_203496583355_102495363667 [0,0,0,1,0,0|1,0,0]=2 4646 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [0,0,0,1,0,0|1,0,2]=4 4647 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [0,0,0,1,0,0|2,0,1]=4 4648 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [0,0,0,1,0,0|2,0,1]=4 4649 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [0,0,0,1,0,0|1,0,2]=4 4650 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [0,0,0,1,0,0|1,0,1]=3 4651 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [0,0,0,1,0,0|1,0,0]=2 4652 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [0,0,0,1,0,0|1,0,0]=2 4653 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [0,0,0,1,0,0|0,0,0]=1 4654 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [0,0,0,1,0,0|2,0,0]=3 4655 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [0,0,0,1,0,0|2,0,0]=3 4656 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [0,0,0,1,0,0|2,0,0]=3 4657 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [0,0,0,1,0,0|2,0,0]=3 4658 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [0,0,0,1,0,0|1,0,0]=2 4659 B11R2.36 Oc1ccc2c(n1)CCC2 271570a_203496583355_100000046531 [0,0,0,1,0,0|2,0,0]=3 4660 B11R2.36 Oc1ccc2c(n1)CCN2 271570a_203496583355_100009872833 [0,0,0,1,0,0|2,0,0]=3 4661 B11R2.36 Oc1ccc2c(n1)CNC2 271570a_203496583355_100016995040 [0,0,0,1,0,0|3,0,0]=4 4662 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [0,0,0,1,0,0|2,0,1]=4 4663 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [0,0,0,1,0,0|2,0,1]=4 4664 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [0,0,0,1,0,0|2,0,1]=4 4665 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [0,0,0,1,0,0|3,0,0]=4 4666 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [0,0,0,1,0,0|3,0,0]=4 4667 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [0,0,0,1,0,0|2,0,1]=4 4668 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [0,0,0,1,0,0|3,0,0]=4 4669 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [0,0,0,1,0,0|2,0,1]=4 4670 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [0,0,0,1,0,0|2,0,1]=4 4671 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [0,0,0,1,0,0|3,0,0]=4 4672 B11R2.36 Oc1ccc2nonc2c1 271570a_203496583355_100009814275 [0,0,0,1,0,0|3,0,0]=4 4673 B11R2.36 Oc1ccc2nsnc2c1 271570a_203496583355_100009814274 [0,0,0,1,0,0|3,0,0]=4 4674 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [0,0,0,1,0,0|0,0,2]=3 4675 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [0,0,0,1,0,0|1,0,2]=4 4676 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [0,0,0,1,0,0|1,0,1]=3 4677 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [0,0,0,1,0,0|1,0,1]=3 4678 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [0,0,0,1,0,0|0,1,2]=4 4679 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [0,0,0,1,0,0|1,1,1]=4 4680 B11R2.36 Oc1cnc2c(c1)CCC2 271570a_203496583355_100000693888 [0,0,0,1,0,0|2,0,0]=3 4681 B11R2.36 Oc1cnc2c(c1)CCN2 271570a_203496583355_100009817725 [0,0,0,1,0,0|2,0,0]=3 4682 B11R2.36 Oc1cnc2c(c1)NCC2 271570a_203496583355_100000698607 [0,0,0,1,0,0|3,0,0]=4 4683 B11R2.36 Oc1ncc2c(n1)CCC2 271570a_203496583355_100009881048 [0,0,0,1,0,0|3,0,0]=4 4684 B9R1.7 CCCc1ccc(s1)O 271570a_203496583355_100010157708 [0,0,0,0,1,0|2,0,0]=3 4685 B9R1.7 CCCc1ncc([nH]1)O 271570a_203496583355_200009820212 [0,0,0,0,1,0|3,0,0]=4 4686 B9R1.7 CCCn1cc(cn1)O 271570a_203496583355_100011400188 [0,0,0,0,1,0|3,0,0]=4 4687 B9R1.7 CCCn1ccc(n1)O 271570a_203496583355_100012457951 [0,0,0,0,1,0|3,0,0]=4 4688 B9R1.7 CCOc1ccn(n1)C 34a_100012642153_100000210202 [0,0,0,0,1,0|3,0,0]=4 4689 B9R1.7 CCOc1cnn(c1)C 34a_100000707646_100000210202 [0,0,0,0,1,0|3,0,0]=4 4690 B9R1.7 CCOc1nc(cs1)O 271570a_203496583355_100011934640 [0,0,0,0,1,0|2,0,0]=3 4691 B9R1.7 CCSc1cc(cs1)C 62a_100000210202_100009876951 [0,0,0,0,1,0|2,1,0]=4 4692 B9R1.7 CCSc1cc(cs1)C 62a_100009876951_100000210202 [0,0,0,0,1,0|2,1,0]=4 4693 B9R1.7 CCSc1ccc(s1)Br 62a_100000210202_100010197418 [0,0,0,0,1,0|2,1,0]=4 4694 B9R1.7 CCSc1ccc(s1)Br 62a_100010197418_100000210202 [0,0,0,0,1,0|2,1,0]=4 4695 B9R1.7 CCSc1ccc(s1)C 62a_100000031368_100000210202 [0,0,0,0,1,0|2,1,0]=4 4696 B9R1.7 CCSc1ccc(s1)C 62a_100000210202_100000031368 [0,0,0,0,1,0|2,1,0]=4 4697 B9R1.7 CCSc1csc(c1)C 62a_100000210202_100000759034 [0,0,0,0,1,0|2,1,0]=4 4698 B9R1.7 CCSc1csc(c1)C 62a_100000759034_100000210202 [0,0,0,0,1,0|2,1,0]=4 4699 B9R1.7 CNCc1cc(cs1)O 271570a_203496583355_100000207611 [0,0,0,0,1,0|3,0,0]=4 4700 B9R1.7 CNCc1ccc(o1)O 271570a_203496583355_100000207588 [0,0,0,0,1,0|3,0,0]=4 4701 B9R1.7 COCc1cc(cs1)O 271570a_203496583355_100011542528 [0,0,0,0,1,0|3,0,0]=4 4702 B8R0.1 C=CC=CC(=O)CCC 1458a_100016291481_100000210303 [1,0,1,0,0,0|2,0,0]=4 4703 B8R0.22 C=CCC(C=C)OCC 34a_100000038011_100000210202 [1,0,1,0,0,0|0,0,2]=4 4704 B8R0.22 C=CCC(C=C)OCC 7a_100000038011_100000210202 [1,0,1,0,0,0|0,0,2]=4 4705 B8R0.4 C/C=C/C=C/COCC 34a_100016283227_100000210202 [1,0,1,0,0,0|0,0,2]=4 4706 B8R0.6 C=CC(=O)C/C=C\CC 1458a_100000185746_100103147603 [1,0,1,0,0,0|0,0,2]=4 4707 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,2]=4 4708 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|1,0,0]=3 4709 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|0,0,0]=2 4710 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|0,0,0]=2 4711 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|1,0,0]=3 4712 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|1,0,0]=3 4713 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|1,0,0]=3 4714 B8R1.2 COc1ccnnc1 34a_100015204005_200000210301 [2,0,0,0,0,0|2,0,0]=4 4715 B8R1.2 COc1cncnc1 7a_100000754086_200000210301 [2,0,0,0,0,0|2,0,0]=4 4716 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|0,1,0]=3 4717 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|0,1,0]=3 4718 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|1,1,0]=4 4719 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|1,1,0]=4 4720 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|1,1,0]=4 4721 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|1,1,0]=4 4722 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|1,1,0]=4 4723 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|1,1,0]=4 4724 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|1,0,0]=3 4725 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|0,0,0]=2 4726 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|0,0,0]=2 4727 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|1,0,0]=3 4728 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|1,0,0]=3 4729 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|1,0,0]=3 4730 B8R1.2 [13CH3]Oc1ccnnc1 34a_100015204005_200025704644 [2,0,0,0,0,0|2,0,0]=4 4731 B8R1.2 [13CH3]Oc1cncnc1 7a_100000754086_200025704644 [2,0,0,0,0,0|2,0,0]=4 4732 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|0,1,0]=3 4733 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|0,1,0]=3 4734 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|1,1,0]=4 4735 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|1,1,0]=4 4736 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|1,1,0]=4 4737 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|1,1,0]=4 4738 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|1,1,0]=4 4739 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|1,1,0]=4 4740 B8R1.3 Cc1ccc(cc1)O 271570a_203496583355_100000186775 [2,0,0,0,0,0|0,0,0]=2 4741 B8R1.3 Cc1ccc(cn1)O 271570a_203496583355_100000751577 [2,0,0,0,0,0|1,0,0]=3 4742 B8R1.3 Cc1ccc(nc1)O 271570a_203496583355_100000754016 [2,0,0,0,0,0|1,0,0]=3 4743 B8R1.3 Cc1ccc(nn1)O 271570a_203496583355_100011450037 [2,0,0,0,0,0|2,0,0]=4 4744 B8R1.3 Cc1cnc(cn1)O 271570a_203496583355_100011999403 [2,0,0,0,0,0|2,0,0]=4 4745 B8R1.3 Cc1cnc(nc1)O 271570a_203496583355_100011825175 [2,0,0,0,0,0|2,0,0]=4 4746 B8R1.3 Cc1ncc(cn1)O 271570a_203496583355_100000686985 [2,0,0,0,0,0|2,0,0]=4 4747 B8R1.3 Nc1ccc(cc1)O 271570a_203496583355_100000185761 [2,0,0,0,0,0|1,0,0]=3 4748 B8R1.3 Nc1ccc(cn1)O 271570a_203496583355_100000187370 [2,0,0,0,0,0|2,0,0]=4 4749 B8R1.3 Nc1ccc(nc1)O 271570a_203496583355_100000744251 [2,0,0,0,0,0|2,0,0]=4 4750 B8R1.3 O=c1ccc(c[nH]1)O 271570a_203496583355_100000212171 [2,0,0,0,0,0|1,0,1]=4 4751 B8R1.3 Oc1ccc(cc1)Br 271570a_203496583355_100000752885 [2,0,0,0,0,0|1,0,0]=3 4752 B8R1.3 Oc1ccc(cc1)Cl 271570a_203496583355_100000755918 [2,0,0,0,0,0|1,0,0]=3 4753 B8R1.3 Oc1ccc(cc1)F 271570a_203496583355_100000211213 [2,0,0,0,0,0|1,0,0]=3 4754 B8R1.3 Oc1ccc(cc1)O 271570a_203496583355_100000185759 [2,0,0,0,0,0|0,0,0]=2 4755 B8R1.3 Oc1ccc(cn1)Br 271570a_203496583355_100000686858 [2,0,0,0,0,0|2,0,0]=4 4756 B8R1.3 Oc1ccc(cn1)Cl 271570a_203496583355_100011356976 [2,0,0,0,0,0|2,0,0]=4 4757 B8R1.3 Oc1ccc(cn1)F 271570a_203496583355_100000744514 [2,0,0,0,0,0|2,0,0]=4 4758 B8R1.3 Oc1ccc(nc1)Br 271570a_203496583355_100009814638 [2,0,0,0,0,0|2,0,0]=4 4759 B8R1.3 Oc1ccc(nc1)Cl 271570a_203496583355_100000034144 [2,0,0,0,0,0|2,0,0]=4 4760 B8R1.3 Oc1ccc(nc1)F 271570a_203496583355_100000748661 [2,0,0,0,0,0|2,0,0]=4 4761 B8R1.3 Oc1ccc(nc1)O 271570a_203496583355_100000685995 [2,0,0,0,0,0|1,0,0]=3 4762 B8R1.3 Oc1cnc(nc1)O 271570a_203496583355_100000730009 [2,0,0,0,0,0|2,0,0]=4 4763 B8R1.3 [O-][n+]1ccc(cc1)O 271570a_203496583355_100000039755 [2,0,0,0,0,0|1,0,1]=4 4764 B10R1.3 C#Cc1ccc(cc1)NC 34a_100011215031_200000210301 [1,1,0,0,0,0|2,0,0]=4 4765 B10R1.3 C#Cc1ccc(cc1)N[13CH3] 34a_100011215031_200025704644 [1,1,0,0,0,0|2,0,0]=4 4766 B10R1.3 C#Cc1ccc(nc1)OC 34a_200009884252_200000210301 [1,1,0,0,0,0|2,0,0]=4 4767 B10R1.3 C#Cc1ccc(nc1)O[13CH3] 34a_200009884252_200025704644 [1,1,0,0,0,0|2,0,0]=4 4768 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [1,1,0,0,0,0|1,0,0]=3 4769 B10R1.3 C=Cc1ccc(cc1)CF 271570a_100011290941_100010268989 [1,1,0,0,0,0|2,0,0]=4 4770 B10R1.3 C=Cc1ccc(cc1)CN 271570a_100011290941_100016989417 [1,1,0,0,0,0|2,0,0]=4 4771 B10R1.3 C=Cc1ccc(cc1)CO 271570a_100011290941_100000690907 [1,1,0,0,0,0|0,0,2]=4 4772 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [1,1,0,0,0,0|2,0,0]=4 4773 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [1,1,0,0,0,0|2,0,0]=4 4774 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [1,1,0,0,0,0|2,0,0]=4 4775 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [1,1,0,0,0,0|1,0,0]=3 4776 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [1,1,0,0,0,0|1,0,0]=3 4777 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [1,1,0,0,0,0|1,0,0]=3 4778 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [1,1,0,0,0,0|1,0,0]=3 4779 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [1,1,0,0,0,0|1,0,0]=3 4780 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [1,1,0,0,0,0|1,1,0]=4 4781 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [1,1,0,0,0,0|1,1,0]=4 4782 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [1,1,0,0,0,0|1,1,0]=4 4783 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [1,1,0,0,0,0|1,1,0]=4 4784 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [1,1,0,0,0,0|1,1,0]=4 4785 B10R1.3 C=Cc1ccc(cn1)CC 271570a_100011290941_100009843584 [1,1,0,0,0,0|2,0,0]=4 4786 B10R1.3 C=Cc1ccc(cn1)OC 271570a_100011290941_100000755202 [1,1,0,0,0,0|2,0,0]=4 4787 B10R1.3 C=Cc1ccc(nc1)CC 271570a_100011290941_100009820025 [1,1,0,0,0,0|2,0,0]=4 4788 B10R1.3 C=Cc1ccc(nc1)OC 271570a_100011290941_100000047065 [1,1,0,0,0,0|2,0,0]=4 4789 B10R1.3 CCc1ccc(cc1)NC 2230a_100000211069_200000210301 [1,1,0,0,0,0|1,0,0]=3 4790 B10R1.3 CCc1ccc(cc1)NC 34a_100000211069_200000210301 [1,1,0,0,0,0|1,0,0]=3 4791 B10R1.3 CCc1ccc(cc1)N[13CH3] 2230a_100000211069_200025704644 [1,1,0,0,0,0|1,0,0]=3 4792 B10R1.3 CCc1ccc(cc1)N[13CH3] 34a_100000211069_200025704644 [1,1,0,0,0,0|1,0,0]=3 4793 B10R1.3 CCc1ccc(cc1)OC 34a_100000211359_200000210301 [1,1,0,0,0,0|0,0,0]=2 4794 B10R1.3 CCc1ccc(cc1)OC 7a_100000211359_200000210301 [1,1,0,0,0,0|0,0,0]=2 4795 B10R1.3 CCc1ccc(cc1)O[13CH3] 34a_100000211359_200025704644 [1,1,0,0,0,0|0,0,0]=2 4796 B10R1.3 CCc1ccc(cc1)O[13CH3] 7a_100000211359_200025704644 [1,1,0,0,0,0|0,0,0]=2 4797 B10R1.3 CCc1ccc(cc1)SC 62a_100011215824_200000210301 [1,1,0,0,0,0|0,1,0]=3 4798 B10R1.3 CCc1ccc(cc1)SC 62a_200000210301_100011215824 [1,1,0,0,0,0|0,1,0]=3 4799 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_100011215824_200025704644 [1,1,0,0,0,0|0,1,0]=3 4800 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_200025704644_100011215824 [1,1,0,0,0,0|0,1,0]=3 4801 B10R1.3 CCc1ccc(cn1)SC 62a_100009820025_200000210301 [1,1,0,0,0,0|1,1,0]=4 4802 B10R1.3 CCc1ccc(cn1)SC 62a_200000210301_100009820025 [1,1,0,0,0,0|1,1,0]=4 4803 B10R1.3 CCc1ccc(cn1)S[13CH3] 62a_100009820025_200025704644 [1,1,0,0,0,0|1,1,0]=4 4804 B10R1.3 CCc1ccc(cn1)S[13CH3] 62a_200025704644_100009820025 [1,1,0,0,0,0|1,1,0]=4 4805 B10R1.3 CCc1ccc(nc1)SC 62a_100009843584_200000210301 [1,1,0,0,0,0|1,1,0]=4 4806 B10R1.3 CCc1ccc(nc1)SC 62a_200000210301_100009843584 [1,1,0,0,0,0|1,1,0]=4 4807 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_100009843584_200025704644 [1,1,0,0,0,0|1,1,0]=4 4808 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_200025704644_100009843584 [1,1,0,0,0,0|1,1,0]=4 4809 B10R1.3 CNc1ccc(cc1)C#N 34a_100000185469_200000210301 [1,1,0,0,0,0|2,0,0]=4 4810 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [1,1,0,0,0,0|1,0,0]=3 4811 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,0]=3 4812 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [1,1,0,0,0,0|1,0,0]=3 4813 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [1,1,0,0,0,0|1,0,0]=3 4814 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [1,1,0,0,0,0|1,0,0]=3 4815 B10R1.3 CNc1ccc(cc1)SC 34a_100000212337_200000210301 [1,1,0,0,0,0|1,1,0]=4 4816 B10R1.3 CNc1ccc(cc1)SC 62a_100000743151_200000210301 [1,1,0,0,0,0|1,1,0]=4 4817 B10R1.3 CNc1ccc(cc1)SC 62a_200000210301_100000743151 [1,1,0,0,0,0|1,1,0]=4 4818 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_100000743151_200025704644 [1,1,0,0,0,0|1,1,0]=4 4819 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_200025704644_100000743151 [1,1,0,0,0,0|1,1,0]=4 4820 B10R1.3 COc1ccc(cc1)C#N 34a_100000210344_200000210301 [1,1,0,0,0,0|1,0,0]=3 4821 B10R1.3 COc1ccc(cc1)C#N 7a_100000210344_200000210301 [1,1,0,0,0,0|1,0,0]=3 4822 B10R1.3 COc1ccc(cc1)CN 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,0]=3 4823 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [1,1,0,0,0,0|0,0,0]=2 4824 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [1,1,0,0,0,0|1,0,0]=3 4825 B10R1.3 COc1ccc(cc1)OC 34a_100000210503_200000210301 [1,1,0,0,0,0|0,0,0]=2 4826 B10R1.3 COc1ccc(cc1)O[13CH3] 34a_100000210503_200025704644 [1,1,0,0,0,0|0,0,0]=2 4827 B10R1.3 COc1ccc(cc1)SC 34a_100000211864_200000210301 [1,1,0,0,0,0|0,1,0]=3 4828 B10R1.3 COc1ccc(cc1)SC 62a_200000210301_100000171711 [1,1,0,0,0,0|0,1,0]=3 4829 B10R1.3 COc1ccc(cc1)S[13CH3] 62a_200025704644_100000171711 [1,1,0,0,0,0|0,1,0]=3 4830 B10R1.3 COc1ccc(cn1)CN 34a_100000757128_200000210301 [1,1,0,0,0,0|2,0,0]=4 4831 B10R1.3 COc1ccc(cn1)O[13CH3] 34a_100011934560_200025704644 [1,1,0,0,0,0|1,0,0]=3 4832 B10R1.3 COc1ccc(cn1)SC 62a_100000047065_200000210301 [1,1,0,0,0,0|1,1,0]=4 4833 B10R1.3 COc1ccc(cn1)SC 62a_200000210301_100000047065 [1,1,0,0,0,0|1,1,0]=4 4834 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_100000047065_200025704644 [1,1,0,0,0,0|1,1,0]=4 4835 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_200025704644_100000047065 [1,1,0,0,0,0|1,1,0]=4 4836 B10R1.3 COc1ccc(nc1)C#N 34a_100011934750_200000210301 [1,1,0,0,0,0|2,0,0]=4 4837 B10R1.3 COc1ccc(nc1)C#N 7a_100011934750_200000210301 [1,1,0,0,0,0|2,0,0]=4 4838 B10R1.3 COc1ccc(nc1)CN 34a_100020605196_200000210301 [1,1,0,0,0,0|2,0,0]=4 4839 B10R1.3 COc1ccc(nc1)CO 34a_103436540053_200000210301 [1,1,0,0,0,0|1,0,0]=3 4840 B10R1.3 COc1ccc(nc1)OC 34a_100011934560_200000210301 [1,1,0,0,0,0|1,0,0]=3 4841 B10R1.3 COc1ccc(nc1)OC 34a_100012002028_200000210301 [1,1,0,0,0,0|1,0,0]=3 4842 B10R1.3 COc1ccc(nc1)O[13CH3] 34a_100012002028_200025704644 [1,1,0,0,0,0|1,0,0]=3 4843 B10R1.3 COc1ccc(nc1)SC 62a_100000755202_200000210301 [1,1,0,0,0,0|1,1,0]=4 4844 B10R1.3 COc1ccc(nc1)SC 62a_200000210301_100000744180 [1,1,0,0,0,0|1,1,0]=4 4845 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_100000755202_200025704644 [1,1,0,0,0,0|1,1,0]=4 4846 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_200025704644_100000744180 [1,1,0,0,0,0|1,1,0]=4 4847 B10R1.3 COc1cnc(nc1)OC 34a_100000099601_200000210301 [1,1,0,0,0,0|2,0,0]=4 4848 B10R1.3 COc1cnc(nc1)OC 7a_100000099601_200000210301 [1,1,0,0,0,0|2,0,0]=4 4849 B10R1.3 COc1ncc(cn1)O[13CH3] 34a_100000099601_200025704644 [1,1,0,0,0,0|2,0,0]=4 4850 B10R1.3 COc1ncc(cn1)O[13CH3] 7a_100000099601_200025704644 [1,1,0,0,0,0|2,0,0]=4 4851 B10R1.3 CSc1ccc(cc1)C#N 62a_200000210301_100000184291 [1,1,0,0,0,0|1,1,0]=4 4852 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [1,1,0,0,0,0|0,1,1]=4 4853 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [1,1,0,0,0,0|0,1,1]=4 4854 B10R1.3 CSc1ccc(cc1)CF 62a_100010268989_200000210301 [1,1,0,0,0,0|1,1,0]=4 4855 B10R1.3 CSc1ccc(cc1)CF 62a_200000210301_100010268989 [1,1,0,0,0,0|1,1,0]=4 4856 B10R1.3 CSc1ccc(cc1)CN 62a_100016989417_200000210301 [1,1,0,0,0,0|1,1,0]=4 4857 B10R1.3 CSc1ccc(cc1)CN 62a_200000210301_100016989417 [1,1,0,0,0,0|1,1,0]=4 4858 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [1,1,0,0,0,0|0,1,0]=3 4859 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [1,1,0,0,0,0|0,1,0]=3 4860 B10R1.3 CSc1ccc(cc1)NN 62a_100016988836_200000210301 [1,1,0,0,0,0|1,1,0]=4 4861 B10R1.3 CSc1ccc(cc1)NN 62a_200000210301_100016988836 [1,1,0,0,0,0|1,1,0]=4 4862 B10R1.3 CSc1ccc(cc1)N[13CH3] 34a_100000212337_200025704644 [1,1,0,0,0,0|1,1,0]=4 4863 B10R1.3 CSc1ccc(cc1)O[13CH3] 34a_100000211864_200025704644 [1,1,0,0,0,0|0,1,0]=3 4864 B10R1.3 CSc1ccc(cc1)SC 62a_100011263217_200000210301 [1,1,0,0,0,0|0,2,0]=4 4865 B10R1.3 CSc1ccc(cc1)SC 62a_200000210301_100011263217 [1,1,0,0,0,0|0,2,0]=4 4866 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_100011263217_200025704644 [1,1,0,0,0,0|0,2,0]=4 4867 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_200025704644_100011263217 [1,1,0,0,0,0|0,2,0]=4 4868 B10R1.3 CSc1ccc(cn1)CO 62a_100009816760_200000210301 [1,1,0,0,0,0|1,1,0]=4 4869 B10R1.3 CSc1ccc(cn1)CO 62a_200000210301_100009816760 [1,1,0,0,0,0|1,1,0]=4 4870 B10R1.3 CSc1ccc(nc1)CO 62a_100000754261_200000210301 [1,1,0,0,0,0|1,1,0]=4 4871 B10R1.3 CSc1ccc(nc1)CO 62a_200000210301_100000754261 [1,1,0,0,0,0|1,1,0]=4 4872 B10R1.3 [13CH3]Nc1ccc(cc1)C#N 34a_100000185469_200025704644 [1,1,0,0,0,0|2,0,0]=4 4873 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [1,1,0,0,0,0|1,0,0]=3 4874 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,0]=3 4875 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 34a_100000210344_200025704644 [1,1,0,0,0,0|1,0,0]=3 4876 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 7a_100000210344_200025704644 [1,1,0,0,0,0|1,0,0]=3 4877 B10R1.3 [13CH3]Oc1ccc(cc1)CN 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,0]=3 4878 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [1,1,0,0,0,0|0,0,0]=2 4879 B10R1.3 [13CH3]Oc1ccc(cn1)CN 34a_100000757128_200025704644 [1,1,0,0,0,0|2,0,0]=4 4880 B10R1.3 [13CH3]Oc1ccc(nc1)C#N 34a_100011934750_200025704644 [1,1,0,0,0,0|2,0,0]=4 4881 B10R1.3 [13CH3]Oc1ccc(nc1)C#N 7a_100011934750_200025704644 [1,1,0,0,0,0|2,0,0]=4 4882 B10R1.3 [13CH3]Oc1ccc(nc1)CN 34a_100020605196_200025704644 [1,1,0,0,0,0|2,0,0]=4 4883 B10R1.3 [13CH3]Oc1ccc(nc1)CO 34a_103436540053_200025704644 [1,1,0,0,0,0|1,0,0]=3 4884 B10R1.3 [13CH3]Sc1ccc(cc1)C#N 62a_200025704644_100000184291 [1,1,0,0,0,0|1,1,0]=4 4885 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [1,1,0,0,0,0|0,1,1]=4 4886 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [1,1,0,0,0,0|0,1,1]=4 4887 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_100010268989_200025704644 [1,1,0,0,0,0|1,1,0]=4 4888 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_200025704644_100010268989 [1,1,0,0,0,0|1,1,0]=4 4889 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_100016989417_200025704644 [1,1,0,0,0,0|1,1,0]=4 4890 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_200025704644_100016989417 [1,1,0,0,0,0|1,1,0]=4 4891 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [1,1,0,0,0,0|0,1,0]=3 4892 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [1,1,0,0,0,0|0,1,0]=3 4893 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_100016988836_200025704644 [1,1,0,0,0,0|1,1,0]=4 4894 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_200025704644_100016988836 [1,1,0,0,0,0|1,1,0]=4 4895 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_100009816760_200025704644 [1,1,0,0,0,0|1,1,0]=4 4896 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_200025704644_100009816760 [1,1,0,0,0,0|1,1,0]=4 4897 B10R1.3 [13CH3]Sc1ccc(nc1)CO 62a_100000754261_200025704644 [1,1,0,0,0,0|1,1,0]=4 4898 B10R1.3 [13CH3]Sc1ccc(nc1)CO 62a_200025704644_100000754261 [1,1,0,0,0,0|1,1,0]=4 4899 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,1,0,0,0,0|1,0,1]=4 4900 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,1,0,0,0,0|1,0,1]=4 4901 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,1,0,0,0,0|1,0,1]=4 4902 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,1,0,0,0,0|1,0,1]=4 4903 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,1,0,0,0,0|1,0,1]=4 4904 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,1,0,0,0,0|0,0,1]=3 4905 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,1,0,0,0,0|0,0,1]=3 4906 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [1,1,0,0,0,0|1,0,1]=4 4907 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,1,0,0,0,0|1,0,1]=4 4908 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,1,0,0,0,0|1,0,1]=4 4909 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,1,0,0,0,0|1,0,1]=4 4910 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,1,0,0,0,0|1,0,1]=4 4911 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,1,0,0,0,0|1,0,1]=4 4912 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,1,0,0,0,0|0,0,1]=3 4913 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,1,0,0,0,0|0,0,1]=3 4914 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,1,0,0,0,0|1,0,1]=4 4915 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,1,0,0,0,0|1,0,1]=4 4916 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [1,1,0,0,0,0|0,0,0]=2 4917 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [1,1,0,0,0,0|1,0,0]=3 4918 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [1,1,0,0,0,0|1,0,0]=3 4919 B10R1.13 CC(C)c1cnc(nc1)O 271570a_203496583355_100000102307 [1,1,0,0,0,0|2,0,0]=4 4920 B10R1.13 CC(C)c1ncc(cn1)O 271570a_203496583355_200009814916 [1,1,0,0,0,0|2,0,0]=4 4921 B10R1.13 CC(N)c1ccc(cn1)O 271570a_203496583355_100000723930 [1,1,0,0,0,0|1,0,0]=3 4922 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [1,1,0,0,0,0|0,0,0]=2 4923 B10R1.13 CC(O)c1ccc(cn1)O 271570a_203496583355_100012353650 [1,1,0,0,0,0|1,0,0]=3 4924 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [1,1,0,0,0,0|1,0,0]=3 4925 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 4926 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 4927 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 4928 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 4929 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 4930 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 4931 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 4932 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 4933 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 4934 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 4935 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 4936 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 4937 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [1,1,0,0,0,0|1,0,0]=3 4938 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [1,1,0,0,0,0|1,0,0]=3 4939 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [1,1,0,0,0,0|1,0,0]=3 4940 B10R1.13 CN(C)c1ccc(cn1)O 271570a_203496583355_100011465347 [1,1,0,0,0,0|2,0,0]=4 4941 B10R1.13 CN(C)c1ccc(nc1)O 271570a_203496583355_100009992925 [1,1,0,0,0,0|2,0,0]=4 4942 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 4943 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 4944 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 4945 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 4946 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 4947 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 4948 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 4949 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 4950 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 4951 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 4952 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 4953 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 4954 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [1,1,0,0,0,0|1,0,0]=3 4955 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [1,1,0,0,0,0|1,0,0]=3 4956 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,1,0,0,0,0|0,1,0]=3 4957 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [1,1,0,0,0,0|0,0,0]=2 4958 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [1,1,0,0,0,0|0,0,0]=2 4959 B10R1.13 C[C@H](N)c1ccc(nc1)O 271570a_203496583355_100015387476 [1,1,0,0,0,0|1,0,0]=3 4960 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,1,0,0,0,0|1,0,1]=4 4961 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 4962 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 4963 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 4964 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 4965 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 4966 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 4967 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,1,0,0,0,0|1,0,1]=4 4968 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [1,1,0,0,0,0|2,0,0]=4 4969 B10R1.13 Oc1ccc(cc1)C(F)F 271570a_203496583355_100010189923 [1,1,0,0,0,0|1,0,0]=3 4970 B10R1.13 Oc1ccc(cn1)C(F)F 271570a_203496583355_100000720607 [1,1,0,0,0,0|2,0,0]=4 4971 B10R1.13 Oc1ccc(nc1)C(F)F 271570a_203496583355_100010253924 [1,1,0,0,0,0|2,0,0]=4 4972 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,1,0,0,0,0|1,0,1]=4 4973 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,1,0,0,0,0|1,0,1]=4 4974 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,1,0,0,0,0|1,0,1]=4 4975 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,1,0,0,0,0|1,0,1]=4 4976 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,1,0,0,0,0|0,0,1]=3 4977 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [1,1,0,0,0,0|0,0,2]=4 4978 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [1,1,0,0,0,0|0,0,2]=4 4979 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [1,1,0,0,0,0|0,0,2]=4 4980 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [1,1,0,0,0,0|0,0,2]=4 4981 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [1,1,0,0,0,0|0,0,2]=4 4982 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,1,0,0,0,0|0,0,2]=4 4983 B10R1.25 CCc1ccc(cc1F)O 271570a_203496583355_200010071577 [1,1,0,0,0,0|0,0,0]=2 4984 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [1,1,0,0,0,0|0,0,0]=2 4985 B10R1.25 CCc1cnc(cc1O)C 271570a_203496583355_100010291839 [1,1,0,0,0,0|2,0,0]=4 4986 B10R1.25 CCc1ncc(cc1O)N 271570a_203496583355_100013085292 [1,1,0,0,0,0|2,0,0]=4 4987 B10R1.25 CNc1ccc(cc1Br)Br 34a_100000211012_200000210301 [1,1,0,0,0,0|2,0,0]=4 4988 B10R1.25 CNc1ccc(cc1Br)C 34a_100000210942_200000210301 [1,1,0,0,0,0|2,0,0]=4 4989 B10R1.25 CNc1ccc(cc1Br)Cl 34a_100000752454_200000210301 [1,1,0,0,0,0|2,0,0]=4 4990 B10R1.25 CNc1ccc(cc1Br)F 34a_100000738039_200000210301 [1,1,0,0,0,0|2,0,0]=4 4991 B10R1.25 CNc1ccc(cc1Br)O 34a_100012001276_200000210301 [1,1,0,0,0,0|1,0,0]=3 4992 B10R1.25 CNc1ccc(cc1C)Br 34a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 4993 B10R1.25 CNc1ccc(cc1C)Br 7a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 4994 B10R1.25 CNc1ccc(cc1C)C 34a_100000736561_200000210301 [1,1,0,0,0,0|2,0,0]=4 4995 B10R1.25 CNc1ccc(cc1C)C 7a_100000736561_200000210301 [1,1,0,0,0,0|2,0,0]=4 4996 B10R1.25 CNc1ccc(cc1C)Cl 34a_100000210418_200000210301 [1,1,0,0,0,0|2,0,0]=4 4997 B10R1.25 CNc1ccc(cc1C)Cl 7a_100000210418_200000210301 [1,1,0,0,0,0|2,0,0]=4 4998 B10R1.25 CNc1ccc(cc1C)F 34a_100000211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 4999 B10R1.25 CNc1ccc(cc1C)F 7a_100000211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 5000 B10R1.25 CNc1ccc(cc1C)I 34a_100000184554_200000210301 [1,1,0,0,0,0|2,0,0]=4 5001 B10R1.25 CNc1ccc(cc1C)I 7a_100000184554_200000210301 [1,1,0,0,0,0|2,0,0]=4 5002 B10R1.25 CNc1ccc(cc1C)O 271570a_203496583355_100000221803 [1,1,0,0,0,0|1,0,0]=3 5003 B10R1.25 CNc1ccc(cc1C)O 34a_100000756630_200000210301 [1,1,0,0,0,0|1,0,0]=3 5004 B10R1.25 CNc1ccc(cc1Cl)Br 34a_100000211467_200000210301 [1,1,0,0,0,0|2,0,0]=4 5005 B10R1.25 CNc1ccc(cc1Cl)C 34a_100000210522_200000210301 [1,1,0,0,0,0|2,0,0]=4 5006 B10R1.25 CNc1ccc(cc1Cl)Cl 34a_100000185861_200000210301 [1,1,0,0,0,0|2,0,0]=4 5007 B10R1.25 CNc1ccc(cc1Cl)F 34a_100000212003_200000210301 [1,1,0,0,0,0|2,0,0]=4 5008 B10R1.25 CNc1ccc(cc1Cl)I 34a_100011218065_200000210301 [1,1,0,0,0,0|2,0,0]=4 5009 B10R1.25 CNc1ccc(cc1Cl)O 34a_100011215599_200000210301 [1,1,0,0,0,0|1,0,0]=3 5010 B10R1.25 CNc1ccc(cc1F)Br 34a_100000210722_200000210301 [1,1,0,0,0,0|2,0,0]=4 5011 B10R1.25 CNc1ccc(cc1F)C 34a_100000211023_200000210301 [1,1,0,0,0,0|2,0,0]=4 5012 B10R1.25 CNc1ccc(cc1F)Cl 34a_100000211020_200000210301 [1,1,0,0,0,0|2,0,0]=4 5013 B10R1.25 CNc1ccc(cc1F)F 34a_100000210720_200000210301 [1,1,0,0,0,0|2,0,0]=4 5014 B10R1.25 CNc1ccc(cc1F)I 34a_100011215594_200000210301 [1,1,0,0,0,0|2,0,0]=4 5015 B10R1.25 CNc1ccc(cc1F)O 271570a_203496583355_100000743884 [1,1,0,0,0,0|1,0,0]=3 5016 B10R1.25 CNc1ccc(cc1F)O 34a_100000759473_200000210301 [1,1,0,0,0,0|1,0,0]=3 5017 B10R1.25 CNc1ccc(cc1I)Br 34a_100000187925_200000210301 [1,1,0,0,0,0|2,0,0]=4 5018 B10R1.25 CNc1ccc(cc1I)C 34a_100011356834_200000210301 [1,1,0,0,0,0|2,0,0]=4 5019 B10R1.25 CNc1ccc(cc1I)Cl 34a_100000761889_200000210301 [1,1,0,0,0,0|2,0,0]=4 5020 B10R1.25 CNc1ccc(cc1I)F 34a_100000760547_200000210301 [1,1,0,0,0,0|2,0,0]=4 5021 B10R1.25 CNc1ccc(cc1I)O 34a_100010084370_200000210301 [1,1,0,0,0,0|1,0,0]=3 5022 B10R1.25 CNc1ccc(cc1N)O 271570a_203496583355_100000741790 [1,1,0,0,0,0|1,0,0]=3 5023 B10R1.25 CNc1ccc(cc1O)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 5024 B10R1.25 CNc1ccc(cc1O)C 271570a_203496583355_100000221369 [1,1,0,0,0,0|2,0,0]=4 5025 B10R1.25 CNc1ccc(cc1O)C 34a_100000211527_200000210301 [1,1,0,0,0,0|2,0,0]=4 5026 B10R1.25 CNc1ccc(cc1O)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|2,0,0]=4 5027 B10R1.25 CNc1ccc(cc1O)F 271570a_203496583355_100011246292 [1,1,0,0,0,0|2,0,0]=4 5028 B10R1.25 CNc1ccc(cc1O)F 34a_100000753323_200000210301 [1,1,0,0,0,0|2,0,0]=4 5029 B10R1.25 CNc1ccc(cc1O)O 34a_100000106777_200000210301 [1,1,0,0,0,0|1,0,0]=3 5030 B10R1.25 CNc1cnc(cc1N)O 271570a_203496583355_200015721873 [1,1,0,0,0,0|2,0,0]=4 5031 B10R1.25 CNc1ncc(cc1C)O 271570a_203496583355_100012357622 [1,1,0,0,0,0|2,0,0]=4 5032 B10R1.25 CNc1ncc(cc1N)O 271570a_203496583355_100011432983 [1,1,0,0,0,0|2,0,0]=4 5033 B10R1.25 COc1c[nH]c(=O)cc1O 271570a_203496583355_100121573661 [1,1,0,0,0,0|1,0,1]=4 5034 B10R1.25 COc1ccc(cc1Br)Br 34a_100000188717_200000210301 [1,1,0,0,0,0|1,0,0]=3 5035 B10R1.25 COc1ccc(cc1Br)Br 7a_100000188717_200000210301 [1,1,0,0,0,0|1,0,0]=3 5036 B10R1.25 COc1ccc(cc1Br)C 34a_100000210800_200000210301 [1,1,0,0,0,0|1,0,0]=3 5037 B10R1.25 COc1ccc(cc1Br)C 7a_100000210800_200000210301 [1,1,0,0,0,0|1,0,0]=3 5038 B10R1.25 COc1ccc(cc1Br)Cl 34a_100000211998_200000210301 [1,1,0,0,0,0|1,0,0]=3 5039 B10R1.25 COc1ccc(cc1Br)Cl 7a_100000211998_200000210301 [1,1,0,0,0,0|1,0,0]=3 5040 B10R1.25 COc1ccc(cc1Br)F 34a_100000211999_200000210301 [1,1,0,0,0,0|1,0,0]=3 5041 B10R1.25 COc1ccc(cc1Br)F 7a_100000211999_200000210301 [1,1,0,0,0,0|1,0,0]=3 5042 B10R1.25 COc1ccc(cc1Br)I 34a_100012361655_200000210301 [1,1,0,0,0,0|1,0,0]=3 5043 B10R1.25 COc1ccc(cc1Br)I 7a_100012361655_200000210301 [1,1,0,0,0,0|1,0,0]=3 5044 B10R1.25 COc1ccc(cc1Br)N 34a_100011534360_200000210301 [1,1,0,0,0,0|1,0,0]=3 5045 B10R1.25 COc1ccc(cc1Br)N 7a_100011534360_200000210301 [1,1,0,0,0,0|1,0,0]=3 5046 B10R1.25 COc1ccc(cc1Br)O 271570a_203496583355_100011249507 [1,1,0,0,0,0|0,0,0]=2 5047 B10R1.25 COc1ccc(cc1C)Br 34a_100000186361_200000210301 [1,1,0,0,0,0|1,0,0]=3 5048 B10R1.25 COc1ccc(cc1C)Br 7a_100000186361_200000210301 [1,1,0,0,0,0|1,0,0]=3 5049 B10R1.25 COc1ccc(cc1C)C 34a_100000211776_200000210301 [1,1,0,0,0,0|1,0,0]=3 5050 B10R1.25 COc1ccc(cc1C)C 7a_100000211776_200000210301 [1,1,0,0,0,0|1,0,0]=3 5051 B10R1.25 COc1ccc(cc1C)Cl 34a_100000211091_200000210301 [1,1,0,0,0,0|1,0,0]=3 5052 B10R1.25 COc1ccc(cc1C)Cl 7a_100000211091_200000210301 [1,1,0,0,0,0|1,0,0]=3 5053 B10R1.25 COc1ccc(cc1C)F 34a_100000764316_200000210301 [1,1,0,0,0,0|1,0,0]=3 5054 B10R1.25 COc1ccc(cc1C)F 7a_100000764316_200000210301 [1,1,0,0,0,0|1,0,0]=3 5055 B10R1.25 COc1ccc(cc1C)I 34a_100011218673_200000210301 [1,1,0,0,0,0|1,0,0]=3 5056 B10R1.25 COc1ccc(cc1C)I 7a_100011218673_200000210301 [1,1,0,0,0,0|1,0,0]=3 5057 B10R1.25 COc1ccc(cc1C)N 34a_100011218179_200000210301 [1,1,0,0,0,0|1,0,0]=3 5058 B10R1.25 COc1ccc(cc1C)N 7a_100011218179_200000210301 [1,1,0,0,0,0|1,0,0]=3 5059 B10R1.25 COc1ccc(cc1C)O 271570a_203496583355_100011219705 [1,1,0,0,0,0|0,0,0]=2 5060 B10R1.25 COc1ccc(cc1Cl)Br 34a_100000186472_200000210301 [1,1,0,0,0,0|1,0,0]=3 5061 B10R1.25 COc1ccc(cc1Cl)Br 7a_100000186472_200000210301 [1,1,0,0,0,0|1,0,0]=3 5062 B10R1.25 COc1ccc(cc1Cl)C 34a_100000749699_200000210301 [1,1,0,0,0,0|1,0,0]=3 5063 B10R1.25 COc1ccc(cc1Cl)C 7a_100000749699_200000210301 [1,1,0,0,0,0|1,0,0]=3 5064 B10R1.25 COc1ccc(cc1Cl)Cl 34a_100015191787_200000210301 [1,1,0,0,0,0|1,0,0]=3 5065 B10R1.25 COc1ccc(cc1Cl)Cl 7a_100015191787_200000210301 [1,1,0,0,0,0|1,0,0]=3 5066 B10R1.25 COc1ccc(cc1Cl)F 34a_100000212004_200000210301 [1,1,0,0,0,0|1,0,0]=3 5067 B10R1.25 COc1ccc(cc1Cl)F 7a_100000212004_200000210301 [1,1,0,0,0,0|1,0,0]=3 5068 B10R1.25 COc1ccc(cc1Cl)I 34a_100012360047_200000210301 [1,1,0,0,0,0|1,0,0]=3 5069 B10R1.25 COc1ccc(cc1Cl)I 7a_100012360047_200000210301 [1,1,0,0,0,0|1,0,0]=3 5070 B10R1.25 COc1ccc(cc1Cl)N 34a_100000744943_200000210301 [1,1,0,0,0,0|1,0,0]=3 5071 B10R1.25 COc1ccc(cc1Cl)N 7a_100000744943_200000210301 [1,1,0,0,0,0|1,0,0]=3 5072 B10R1.25 COc1ccc(cc1Cl)O 271570a_203496583355_100012355395 [1,1,0,0,0,0|0,0,0]=2 5073 B10R1.25 COc1ccc(cc1F)Br 34a_100000185481_200000210301 [1,1,0,0,0,0|1,0,0]=3 5074 B10R1.25 COc1ccc(cc1F)Br 7a_100000185481_200000210301 [1,1,0,0,0,0|1,0,0]=3 5075 B10R1.25 COc1ccc(cc1F)C 34a_100011216688_200000210301 [1,1,0,0,0,0|1,0,0]=3 5076 B10R1.25 COc1ccc(cc1F)C 7a_100011216688_200000210301 [1,1,0,0,0,0|1,0,0]=3 5077 B10R1.25 COc1ccc(cc1F)Cl 34a_100000230166_200000210301 [1,1,0,0,0,0|1,0,0]=3 5078 B10R1.25 COc1ccc(cc1F)Cl 7a_100000230166_200000210301 [1,1,0,0,0,0|1,0,0]=3 5079 B10R1.25 COc1ccc(cc1F)F 34a_100000230127_200000210301 [1,1,0,0,0,0|1,0,0]=3 5080 B10R1.25 COc1ccc(cc1F)F 7a_100000230127_200000210301 [1,1,0,0,0,0|1,0,0]=3 5081 B10R1.25 COc1ccc(cc1F)I 34a_100011356965_200000210301 [1,1,0,0,0,0|1,0,0]=3 5082 B10R1.25 COc1ccc(cc1F)I 7a_100011356965_200000210301 [1,1,0,0,0,0|1,0,0]=3 5083 B10R1.25 COc1ccc(cc1F)N 34a_100011220035_200000210301 [1,1,0,0,0,0|1,0,0]=3 5084 B10R1.25 COc1ccc(cc1F)N 7a_100011220035_200000210301 [1,1,0,0,0,0|1,0,0]=3 5085 B10R1.25 COc1ccc(cc1F)O 271570a_203496583355_100000185480 [1,1,0,0,0,0|0,0,0]=2 5086 B10R1.25 COc1ccc(cc1I)Br 34a_100012355227_200000210301 [1,1,0,0,0,0|1,0,0]=3 5087 B10R1.25 COc1ccc(cc1I)Br 7a_100012355227_200000210301 [1,1,0,0,0,0|1,0,0]=3 5088 B10R1.25 COc1ccc(cc1I)C 34a_100000765521_200000210301 [1,1,0,0,0,0|1,0,0]=3 5089 B10R1.25 COc1ccc(cc1I)C 7a_100000765521_200000210301 [1,1,0,0,0,0|1,0,0]=3 5090 B10R1.25 COc1ccc(cc1I)Cl 34a_100011356953_200000210301 [1,1,0,0,0,0|1,0,0]=3 5091 B10R1.25 COc1ccc(cc1I)Cl 7a_100011356953_200000210301 [1,1,0,0,0,0|1,0,0]=3 5092 B10R1.25 COc1ccc(cc1I)F 34a_100012355409_200000210301 [1,1,0,0,0,0|1,0,0]=3 5093 B10R1.25 COc1ccc(cc1I)F 7a_100012355409_200000210301 [1,1,0,0,0,0|1,0,0]=3 5094 B10R1.25 COc1ccc(cc1I)I 7a_100010001573_200000210301 [1,1,0,0,0,0|1,0,0]=3 5095 B10R1.25 COc1ccc(cc1N)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|1,0,0]=3 5096 B10R1.25 COc1ccc(cc1N)Br 7a_100000752626_200000210301 [1,1,0,0,0,0|1,0,0]=3 5097 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [1,1,0,0,0,0|1,0,0]=3 5098 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [1,1,0,0,0,0|1,0,0]=3 5099 B10R1.25 COc1ccc(cc1N)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|1,0,0]=3 5100 B10R1.25 COc1ccc(cc1N)Cl 7a_100000210500_200000210301 [1,1,0,0,0,0|1,0,0]=3 5101 B10R1.25 COc1ccc(cc1N)F 34a_100000759472_200000210301 [1,1,0,0,0,0|1,0,0]=3 5102 B10R1.25 COc1ccc(cc1N)F 7a_100000759472_200000210301 [1,1,0,0,0,0|1,0,0]=3 5103 B10R1.25 COc1ccc(cc1N)I 34a_100000753495_200000210301 [1,1,0,0,0,0|1,0,0]=3 5104 B10R1.25 COc1ccc(cc1N)I 7a_100000753495_200000210301 [1,1,0,0,0,0|1,0,0]=3 5105 B10R1.25 COc1ccc(cc1N)N 34a_100000725306_200000210301 [1,1,0,0,0,0|1,0,0]=3 5106 B10R1.25 COc1ccc(cc1N)O 271570a_203496583355_100000743470 [1,1,0,0,0,0|0,0,0]=2 5107 B10R1.25 COc1ccc(cc1O)Br 271570a_203496583355_100012351588 [1,1,0,0,0,0|1,0,0]=3 5108 B10R1.25 COc1ccc(cc1O)C 271570a_203496583355_100000186399 [1,1,0,0,0,0|1,0,0]=3 5109 B10R1.25 COc1ccc(cc1O)Cl 271570a_203496583355_100011215930 [1,1,0,0,0,0|1,0,0]=3 5110 B10R1.25 COc1ccc(cc1O)F 271570a_203496583355_100000171694 [1,1,0,0,0,0|1,0,0]=3 5111 B10R1.25 COc1ccc(cc1O)N 271570a_203496583355_100000187427 [1,1,0,0,0,0|1,0,0]=3 5112 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100009816560 [1,1,0,0,0,0|0,0,0]=2 5113 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100010084122 [1,1,0,0,0,0|0,0,0]=2 5114 B10R1.25 COc1ccc(nc1Br)Br 34a_100009999766_200000210301 [1,1,0,0,0,0|2,0,0]=4 5115 B10R1.25 COc1ccc(nc1Br)Br 7a_100009999766_200000210301 [1,1,0,0,0,0|2,0,0]=4 5116 B10R1.25 COc1ccc(nc1Br)C 34a_100000702858_200000210301 [1,1,0,0,0,0|2,0,0]=4 5117 B10R1.25 COc1ccc(nc1Br)C 7a_100000702858_200000210301 [1,1,0,0,0,0|2,0,0]=4 5118 B10R1.25 COc1ccc(nc1Br)Cl 34a_100010219353_200000210301 [1,1,0,0,0,0|2,0,0]=4 5119 B10R1.25 COc1ccc(nc1Br)Cl 7a_100010219353_200000210301 [1,1,0,0,0,0|2,0,0]=4 5120 B10R1.25 COc1ccc(nc1Br)F 34a_100009887730_200000210301 [1,1,0,0,0,0|2,0,0]=4 5121 B10R1.25 COc1ccc(nc1Br)F 7a_100009887730_200000210301 [1,1,0,0,0,0|2,0,0]=4 5122 B10R1.25 COc1ccc(nc1Br)I 34a_100000725334_200000210301 [1,1,0,0,0,0|2,0,0]=4 5123 B10R1.25 COc1ccc(nc1Br)I 7a_100000725334_200000210301 [1,1,0,0,0,0|2,0,0]=4 5124 B10R1.25 COc1ccc(nc1Br)O 271570a_203496583355_100010214827 [1,1,0,0,0,0|1,0,0]=3 5125 B10R1.25 COc1ccc(nc1C)Br 34a_100012002022_200000210301 [1,1,0,0,0,0|2,0,0]=4 5126 B10R1.25 COc1ccc(nc1C)Br 7a_100012002022_200000210301 [1,1,0,0,0,0|2,0,0]=4 5127 B10R1.25 COc1ccc(nc1C)C 34a_100011218912_200000210301 [1,1,0,0,0,0|2,0,0]=4 5128 B10R1.25 COc1ccc(nc1C)C 7a_100011218912_200000210301 [1,1,0,0,0,0|2,0,0]=4 5129 B10R1.25 COc1ccc(nc1C)Cl 34a_100012184626_200000210301 [1,1,0,0,0,0|2,0,0]=4 5130 B10R1.25 COc1ccc(nc1C)Cl 7a_100012184626_200000210301 [1,1,0,0,0,0|2,0,0]=4 5131 B10R1.25 COc1ccc(nc1C)F 34a_100009881036_200000210301 [1,1,0,0,0,0|2,0,0]=4 5132 B10R1.25 COc1ccc(nc1C)F 7a_100009881036_200000210301 [1,1,0,0,0,0|2,0,0]=4 5133 B10R1.25 COc1ccc(nc1C)I 34a_100010233687_200000210301 [1,1,0,0,0,0|2,0,0]=4 5134 B10R1.25 COc1ccc(nc1C)I 7a_100010233687_200000210301 [1,1,0,0,0,0|2,0,0]=4 5135 B10R1.25 COc1ccc(nc1C)O 271570a_203496583355_100010244750 [1,1,0,0,0,0|1,0,0]=3 5136 B10R1.25 COc1ccc(nc1Cl)Br 34a_100010246206_200000210301 [1,1,0,0,0,0|2,0,0]=4 5137 B10R1.25 COc1ccc(nc1Cl)Br 7a_100010246206_200000210301 [1,1,0,0,0,0|2,0,0]=4 5138 B10R1.25 COc1ccc(nc1Cl)C 34a_100000086286_200000210301 [1,1,0,0,0,0|2,0,0]=4 5139 B10R1.25 COc1ccc(nc1Cl)C 7a_100000086286_200000210301 [1,1,0,0,0,0|2,0,0]=4 5140 B10R1.25 COc1ccc(nc1Cl)Cl 34a_100000101165_200000210301 [1,1,0,0,0,0|2,0,0]=4 5141 B10R1.25 COc1ccc(nc1Cl)Cl 7a_100000101165_200000210301 [1,1,0,0,0,0|2,0,0]=4 5142 B10R1.25 COc1ccc(nc1Cl)I 34a_100000721234_200000210301 [1,1,0,0,0,0|2,0,0]=4 5143 B10R1.25 COc1ccc(nc1Cl)I 7a_100000721234_200000210301 [1,1,0,0,0,0|2,0,0]=4 5144 B10R1.25 COc1ccc(nc1Cl)O 271570a_203496583355_100010233546 [1,1,0,0,0,0|1,0,0]=3 5145 B10R1.25 COc1ccc(nc1F)Br 34a_100009819667_200000210301 [1,1,0,0,0,0|2,0,0]=4 5146 B10R1.25 COc1ccc(nc1F)Br 7a_100009819667_200000210301 [1,1,0,0,0,0|2,0,0]=4 5147 B10R1.25 COc1ccc(nc1F)C 34a_100000079963_200000210301 [1,1,0,0,0,0|2,0,0]=4 5148 B10R1.25 COc1ccc(nc1F)C 7a_100000079963_200000210301 [1,1,0,0,0,0|2,0,0]=4 5149 B10R1.25 COc1ccc(nc1F)Cl 34a_100009880201_200000210301 [1,1,0,0,0,0|2,0,0]=4 5150 B10R1.25 COc1ccc(nc1F)Cl 7a_100009880201_200000210301 [1,1,0,0,0,0|2,0,0]=4 5151 B10R1.25 COc1ccc(nc1F)F 34a_100000101184_200000210301 [1,1,0,0,0,0|2,0,0]=4 5152 B10R1.25 COc1ccc(nc1F)F 7a_100000101184_200000210301 [1,1,0,0,0,0|2,0,0]=4 5153 B10R1.25 COc1ccc(nc1F)O 271570a_203496583355_100010138636 [1,1,0,0,0,0|1,0,0]=3 5154 B10R1.25 COc1ccc(nc1I)Br 34a_100010253912_200000210301 [1,1,0,0,0,0|2,0,0]=4 5155 B10R1.25 COc1ccc(nc1I)Br 7a_100010253912_200000210301 [1,1,0,0,0,0|2,0,0]=4 5156 B10R1.25 COc1ccc(nc1I)C 34a_100000023897_200000210301 [1,1,0,0,0,0|2,0,0]=4 5157 B10R1.25 COc1ccc(nc1I)C 7a_100000023897_200000210301 [1,1,0,0,0,0|2,0,0]=4 5158 B10R1.25 COc1ccc(nc1I)Cl 34a_100000696390_200000210301 [1,1,0,0,0,0|2,0,0]=4 5159 B10R1.25 COc1ccc(nc1I)Cl 7a_100000696390_200000210301 [1,1,0,0,0,0|2,0,0]=4 5160 B10R1.25 COc1ccc(nc1I)F 34a_100010382442_200000210301 [1,1,0,0,0,0|2,0,0]=4 5161 B10R1.25 COc1ccc(nc1I)F 7a_100010382442_200000210301 [1,1,0,0,0,0|2,0,0]=4 5162 B10R1.25 COc1ccc(nc1N)Br 34a_100000685527_200000210301 [1,1,0,0,0,0|2,0,0]=4 5163 B10R1.25 COc1ccc(nc1N)Br 7a_100000685527_200000210301 [1,1,0,0,0,0|2,0,0]=4 5164 B10R1.25 COc1ccc(nc1N)C 34a_100000694039_200000210301 [1,1,0,0,0,0|2,0,0]=4 5165 B10R1.25 COc1ccc(nc1N)C 7a_100000694039_200000210301 [1,1,0,0,0,0|2,0,0]=4 5166 B10R1.25 COc1ccc(nc1N)Cl 34a_100000717809_200000210301 [1,1,0,0,0,0|2,0,0]=4 5167 B10R1.25 COc1ccc(nc1N)Cl 7a_100000717809_200000210301 [1,1,0,0,0,0|2,0,0]=4 5168 B10R1.25 COc1ccc(nc1N)O 271570a_203496583355_100010192976 [1,1,0,0,0,0|1,0,0]=3 5169 B10R1.25 COc1ccc(nc1O)C 271570a_203496583355_100009820875 [1,1,0,0,0,0|2,0,0]=4 5170 B10R1.25 COc1ccc(nc1O)N 271570a_203496583355_100010172607 [1,1,0,0,0,0|2,0,0]=4 5171 B10R1.25 COc1cnc(cc1Br)C 34a_100009843476_200000210301 [1,1,0,0,0,0|2,0,0]=4 5172 B10R1.25 COc1cnc(cc1Br)C 7a_100009843476_200000210301 [1,1,0,0,0,0|2,0,0]=4 5173 B10R1.25 COc1cnc(cc1C)C 34a_200000068632_200000210301 [1,1,0,0,0,0|2,0,0]=4 5174 B10R1.25 COc1cnc(cc1C)C 7a_200000068632_200000210301 [1,1,0,0,0,0|2,0,0]=4 5175 B10R1.25 COc1cnc(cc1C)Cl 34a_100000692680_200000210301 [1,1,0,0,0,0|2,0,0]=4 5176 B10R1.25 COc1cnc(cc1C)Cl 7a_100000692680_200000210301 [1,1,0,0,0,0|2,0,0]=4 5177 B10R1.25 COc1cnc(cc1C)F 34a_100009856773_200000210301 [1,1,0,0,0,0|2,0,0]=4 5178 B10R1.25 COc1cnc(cc1C)F 7a_100009856773_200000210301 [1,1,0,0,0,0|2,0,0]=4 5179 B10R1.25 COc1cnc(cc1Cl)Cl 34a_100009868576_200000210301 [1,1,0,0,0,0|2,0,0]=4 5180 B10R1.25 COc1cnc(cc1Cl)Cl 7a_100009868576_200000210301 [1,1,0,0,0,0|2,0,0]=4 5181 B10R1.25 COc1cnc(cc1F)F 34a_100009885687_200000210301 [1,1,0,0,0,0|2,0,0]=4 5182 B10R1.25 COc1cnc(cc1F)F 7a_100009885687_200000210301 [1,1,0,0,0,0|2,0,0]=4 5183 B10R1.25 COc1cnc(cc1I)Cl 34a_100000698892_200000210301 [1,1,0,0,0,0|2,0,0]=4 5184 B10R1.25 COc1cnc(cc1I)Cl 7a_100000698892_200000210301 [1,1,0,0,0,0|2,0,0]=4 5185 B10R1.25 COc1cnc(cc1N)Br 34a_100009819941_200000210301 [1,1,0,0,0,0|2,0,0]=4 5186 B10R1.25 COc1cnc(cc1N)Br 7a_100009819941_200000210301 [1,1,0,0,0,0|2,0,0]=4 5187 B10R1.25 COc1cnc(cc1N)O 271570a_203496583355_100010896307 [1,1,0,0,0,0|1,0,0]=3 5188 B10R1.25 COc1cnc(cc1O)C 271570a_203496583355_100010109759 [1,1,0,0,0,0|2,0,0]=4 5189 B10R1.25 COc1cnc(cc1O)O 271570a_203496583355_100010264082 [1,1,0,0,0,0|1,0,0]=3 5190 B10R1.25 COc1cnc(nc1C)O 271570a_203496583355_100010382893 [1,1,0,0,0,0|2,0,0]=4 5191 B10R1.25 COc1cnc(nc1N)O 271570a_203496583355_100009886850 [1,1,0,0,0,0|2,0,0]=4 5192 B10R1.25 COc1coc(cc1=O)C 34a_100000081520_200000210301 [1,1,0,0,0,0|2,0,0]=4 5193 B10R1.25 COc1ncc(cc1Br)Br 34a_100000701035_200000210301 [1,1,0,0,0,0|2,0,0]=4 5194 B10R1.25 COc1ncc(cc1Br)C 34a_100000719714_200000210301 [1,1,0,0,0,0|2,0,0]=4 5195 B10R1.25 COc1ncc(cc1Br)O 271570a_203496583355_200010988584 [1,1,0,0,0,0|1,0,0]=3 5196 B10R1.25 COc1ncc(cc1C)Br 34a_100000685391_200000210301 [1,1,0,0,0,0|2,0,0]=4 5197 B10R1.25 COc1ncc(cc1C)O 271570a_203496583355_100011290809 [1,1,0,0,0,0|1,0,0]=3 5198 B10R1.25 COc1ncc(cc1Cl)Br 34a_100012339560_200000210301 [1,1,0,0,0,0|2,0,0]=4 5199 B10R1.25 COc1ncc(cc1Cl)F 34a_100009847679_200000210301 [1,1,0,0,0,0|2,0,0]=4 5200 B10R1.25 COc1ncc(cc1F)Cl 34a_100011998252_200000210301 [1,1,0,0,0,0|2,0,0]=4 5201 B10R1.25 COc1ncc(cc1F)F 34a_100012025737_200000210301 [1,1,0,0,0,0|2,0,0]=4 5202 B10R1.25 COc1ncc(cc1F)O 271570a_203496583355_100011880707 [1,1,0,0,0,0|1,0,0]=3 5203 B10R1.25 COc1ncc(cc1N)Br 34a_100000743729_200000210301 [1,1,0,0,0,0|2,0,0]=4 5204 B10R1.25 COc1ncc(cc1N)C 34a_100012000488_200000210301 [1,1,0,0,0,0|2,0,0]=4 5205 B10R1.25 COc1ncc(cc1N)Cl 34a_100011998249_200000210301 [1,1,0,0,0,0|2,0,0]=4 5206 B10R1.25 COc1ncc(cc1N)O 271570a_203496583355_100000748608 [1,1,0,0,0,0|1,0,0]=3 5207 B10R1.25 COc1ncc(cc1O)Br 271570a_203496583355_100009814608 [1,1,0,0,0,0|2,0,0]=4 5208 B10R1.25 COc1ncc(cc1O)C 271570a_203496583355_100012353929 [1,1,0,0,0,0|2,0,0]=4 5209 B10R1.25 COc1ncc(cc1O)F 271570a_203496583355_100009828472 [1,1,0,0,0,0|2,0,0]=4 5210 B10R1.25 COc1ncc(cc1O)N 271570a_203496583355_100012351452 [1,1,0,0,0,0|2,0,0]=4 5211 B10R1.25 COc1ncc(cc1O)O 271570a_203496583355_100010135713 [1,1,0,0,0,0|1,0,0]=3 5212 B10R1.25 COc1nnc(cc1C)O 271570a_203496583355_100010272851 [1,1,0,0,0,0|2,0,0]=4 5213 B10R1.25 CSc1ccc(cc1Br)Br 62a_100011484698_200000210301 [1,1,0,0,0,0|1,1,0]=4 5214 B10R1.25 CSc1ccc(cc1Br)Br 62a_200000210301_100011484698 [1,1,0,0,0,0|1,1,0]=4 5215 B10R1.25 CSc1ccc(cc1Br)C 62a_100009813563_200000210301 [1,1,0,0,0,0|1,1,0]=4 5216 B10R1.25 CSc1ccc(cc1Br)C 62a_200000210301_100009813563 [1,1,0,0,0,0|1,1,0]=4 5217 B10R1.25 CSc1ccc(cc1Br)Cl 62a_100011219703_200000210301 [1,1,0,0,0,0|1,1,0]=4 5218 B10R1.25 CSc1ccc(cc1Br)Cl 62a_200000210301_100011219703 [1,1,0,0,0,0|1,1,0]=4 5219 B10R1.25 CSc1ccc(cc1Br)F 62a_100011217111_200000210301 [1,1,0,0,0,0|1,1,0]=4 5220 B10R1.25 CSc1ccc(cc1Br)F 62a_200000210301_100011217111 [1,1,0,0,0,0|1,1,0]=4 5221 B10R1.25 CSc1ccc(cc1Br)N 62a_100000750458_200000210301 [1,1,0,0,0,0|1,1,0]=4 5222 B10R1.25 CSc1ccc(cc1Br)N 62a_200000210301_100000750458 [1,1,0,0,0,0|1,1,0]=4 5223 B10R1.25 CSc1ccc(cc1Br)O 62a_100000701344_200000210301 [1,1,0,0,0,0|0,1,0]=3 5224 B10R1.25 CSc1ccc(cc1Br)O 62a_200000210301_100000701344 [1,1,0,0,0,0|0,1,0]=3 5225 B10R1.25 CSc1ccc(cc1C)Br 62a_100000701812_200000210301 [1,1,0,0,0,0|1,1,0]=4 5226 B10R1.25 CSc1ccc(cc1C)Br 62a_200000210301_100000701812 [1,1,0,0,0,0|1,1,0]=4 5227 B10R1.25 CSc1ccc(cc1C)C 62a_100011217332_200000210301 [1,1,0,0,0,0|1,1,0]=4 5228 B10R1.25 CSc1ccc(cc1C)C 62a_200000210301_100011217332 [1,1,0,0,0,0|1,1,0]=4 5229 B10R1.25 CSc1ccc(cc1C)Cl 62a_100011219607_200000210301 [1,1,0,0,0,0|1,1,0]=4 5230 B10R1.25 CSc1ccc(cc1C)Cl 62a_200000210301_100011219607 [1,1,0,0,0,0|1,1,0]=4 5231 B10R1.25 CSc1ccc(cc1C)F 62a_100011205405_200000210301 [1,1,0,0,0,0|1,1,0]=4 5232 B10R1.25 CSc1ccc(cc1C)F 62a_200000210301_100011205405 [1,1,0,0,0,0|1,1,0]=4 5233 B10R1.25 CSc1ccc(cc1C)N 62a_100000210723_200000210301 [1,1,0,0,0,0|1,1,0]=4 5234 B10R1.25 CSc1ccc(cc1C)N 62a_200000210301_100000210723 [1,1,0,0,0,0|1,1,0]=4 5235 B10R1.25 CSc1ccc(cc1C)O 62a_200000210301_100000690111 [1,1,0,0,0,0|0,1,0]=3 5236 B10R1.25 CSc1ccc(cc1Cl)Br 62a_100011216062_200000210301 [1,1,0,0,0,0|1,1,0]=4 5237 B10R1.25 CSc1ccc(cc1Cl)Br 62a_200000210301_100011216062 [1,1,0,0,0,0|1,1,0]=4 5238 B10R1.25 CSc1ccc(cc1Cl)C 62a_100011263221_200000210301 [1,1,0,0,0,0|1,1,0]=4 5239 B10R1.25 CSc1ccc(cc1Cl)C 62a_200000210301_100011263221 [1,1,0,0,0,0|1,1,0]=4 5240 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_100000699841_200000210301 [1,1,0,0,0,0|1,1,0]=4 5241 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_200000210301_100000699841 [1,1,0,0,0,0|1,1,0]=4 5242 B10R1.25 CSc1ccc(cc1Cl)F 62a_100000733362_200000210301 [1,1,0,0,0,0|1,1,0]=4 5243 B10R1.25 CSc1ccc(cc1Cl)F 62a_200000210301_100000733362 [1,1,0,0,0,0|1,1,0]=4 5244 B10R1.25 CSc1ccc(cc1Cl)N 62a_100000761885_200000210301 [1,1,0,0,0,0|1,1,0]=4 5245 B10R1.25 CSc1ccc(cc1Cl)N 62a_200000210301_100000761885 [1,1,0,0,0,0|1,1,0]=4 5246 B10R1.25 CSc1ccc(cc1Cl)O 271570a_203496583355_206447510565 [1,1,0,0,0,0|0,1,0]=3 5247 B10R1.25 CSc1ccc(cc1Cl)O 62a_100000047559_200000210301 [1,1,0,0,0,0|0,1,0]=3 5248 B10R1.25 CSc1ccc(cc1Cl)O 62a_200000210301_100000047559 [1,1,0,0,0,0|0,1,0]=3 5249 B10R1.25 CSc1ccc(cc1F)Br 62a_100009814013_200000210301 [1,1,0,0,0,0|1,1,0]=4 5250 B10R1.25 CSc1ccc(cc1F)Br 62a_200000210301_100009814013 [1,1,0,0,0,0|1,1,0]=4 5251 B10R1.25 CSc1ccc(cc1F)C 62a_100011216119_200000210301 [1,1,0,0,0,0|1,1,0]=4 5252 B10R1.25 CSc1ccc(cc1F)C 62a_200000210301_100011216119 [1,1,0,0,0,0|1,1,0]=4 5253 B10R1.25 CSc1ccc(cc1F)Cl 62a_100011216042_200000210301 [1,1,0,0,0,0|1,1,0]=4 5254 B10R1.25 CSc1ccc(cc1F)Cl 62a_200000210301_100011216042 [1,1,0,0,0,0|1,1,0]=4 5255 B10R1.25 CSc1ccc(cc1F)F 62a_100000750030_200000210301 [1,1,0,0,0,0|1,1,0]=4 5256 B10R1.25 CSc1ccc(cc1F)F 62a_200000210301_100000750030 [1,1,0,0,0,0|1,1,0]=4 5257 B10R1.25 CSc1ccc(cc1F)N 62a_100011356925_200000210301 [1,1,0,0,0,0|1,1,0]=4 5258 B10R1.25 CSc1ccc(cc1F)N 62a_200000210301_100011356925 [1,1,0,0,0,0|1,1,0]=4 5259 B10R1.25 CSc1ccc(cc1F)O 271570a_203496583355_100010161220 [1,1,0,0,0,0|0,1,0]=3 5260 B10R1.25 CSc1ccc(cc1F)O 62a_100000755031_200000210301 [1,1,0,0,0,0|0,1,0]=3 5261 B10R1.25 CSc1ccc(cc1F)O 62a_200000210301_100000755031 [1,1,0,0,0,0|0,1,0]=3 5262 B10R1.25 CSc1ccc(cc1N)Br 62a_100000743836_200000210301 [1,1,0,0,0,0|1,1,0]=4 5263 B10R1.25 CSc1ccc(cc1N)Br 62a_200000210301_100000743836 [1,1,0,0,0,0|1,1,0]=4 5264 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [1,1,0,0,0,0|1,1,0]=4 5265 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [1,1,0,0,0,0|1,1,0]=4 5266 B10R1.25 CSc1ccc(cc1N)Cl 62a_100000761886_200000210301 [1,1,0,0,0,0|1,1,0]=4 5267 B10R1.25 CSc1ccc(cc1N)Cl 62a_200000210301_100000761886 [1,1,0,0,0,0|1,1,0]=4 5268 B10R1.25 CSc1ccc(cc1N)F 62a_100000687223_200000210301 [1,1,0,0,0,0|1,1,0]=4 5269 B10R1.25 CSc1ccc(cc1N)F 62a_200000210301_100000687223 [1,1,0,0,0,0|1,1,0]=4 5270 B10R1.25 CSc1ccc(cc1N)N 62a_200000210301_200012175722 [1,1,0,0,0,0|1,1,0]=4 5271 B10R1.25 CSc1ccc(cc1N)N 62a_200012175722_200000210301 [1,1,0,0,0,0|1,1,0]=4 5272 B10R1.25 CSc1ccc(cc1N)O 62a_100011999798_200000210301 [1,1,0,0,0,0|0,1,0]=3 5273 B10R1.25 CSc1ccc(cc1N)O 62a_200000210301_100011999798 [1,1,0,0,0,0|0,1,0]=3 5274 B10R1.25 CSc1ccc(cc1O)Br 62a_100012344904_200000210301 [1,1,0,0,0,0|1,1,0]=4 5275 B10R1.25 CSc1ccc(cc1O)Br 62a_200000210301_100012344904 [1,1,0,0,0,0|1,1,0]=4 5276 B10R1.25 CSc1ccc(cc1O)C 271570a_203496583355_200010201864 [1,1,0,0,0,0|1,1,0]=4 5277 B10R1.25 CSc1ccc(cc1O)C 62a_100012002257_200000210301 [1,1,0,0,0,0|1,1,0]=4 5278 B10R1.25 CSc1ccc(cc1O)C 62a_200000210301_100012002257 [1,1,0,0,0,0|1,1,0]=4 5279 B10R1.25 CSc1ccc(cc1O)Cl 62a_100000050036_200000210301 [1,1,0,0,0,0|1,1,0]=4 5280 B10R1.25 CSc1ccc(cc1O)Cl 62a_200000210301_100000050036 [1,1,0,0,0,0|1,1,0]=4 5281 B10R1.25 CSc1ccc(cc1O)F 271570a_203496583355_100009817003 [1,1,0,0,0,0|1,1,0]=4 5282 B10R1.25 CSc1ccc(cc1O)F 62a_100000690578_200000210301 [1,1,0,0,0,0|1,1,0]=4 5283 B10R1.25 CSc1ccc(cc1O)F 62a_200000210301_100000690578 [1,1,0,0,0,0|1,1,0]=4 5284 B10R1.25 CSc1ccc(cc1O)O 62a_200000210301_100009813921 [1,1,0,0,0,0|0,1,0]=3 5285 B10R1.25 CSc1ccc(nc1C)O 62a_100000691680_200000210301 [1,1,0,0,0,0|1,1,0]=4 5286 B10R1.25 CSc1ccc(nc1C)O 62a_200000210301_100000691680 [1,1,0,0,0,0|1,1,0]=4 5287 B10R1.25 CSc1ccc(nc1F)O 62a_100009879308_200000210301 [1,1,0,0,0,0|1,1,0]=4 5288 B10R1.25 CSc1ccc(nc1F)O 62a_200000210301_100009879308 [1,1,0,0,0,0|1,1,0]=4 5289 B10R1.25 CSc1cnc(cc1C)O 62a_100000766222_200000210301 [1,1,0,0,0,0|1,1,0]=4 5290 B10R1.25 CSc1cnc(cc1C)O 62a_200000210301_100000766222 [1,1,0,0,0,0|1,1,0]=4 5291 B10R1.25 CSc1ncc(cc1C)O 62a_100012000486_200000210301 [1,1,0,0,0,0|1,1,0]=4 5292 B10R1.25 CSc1ncc(cc1C)O 62a_200000210301_100012000486 [1,1,0,0,0,0|1,1,0]=4 5293 B10R1.25 CSc1ncc(cc1F)O 62a_200000210301_100000063512 [1,1,0,0,0,0|1,1,0]=4 5294 B10R1.25 Cc1cc(=O)c(co1)O[13CH3] 34a_100000081520_200025704644 [1,1,0,0,0,0|2,0,0]=4 5295 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 34a_100009843476_200025704644 [1,1,0,0,0,0|2,0,0]=4 5296 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 7a_100009843476_200025704644 [1,1,0,0,0,0|2,0,0]=4 5297 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 34a_200000068632_200025704644 [1,1,0,0,0,0|2,0,0]=4 5298 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 7a_200000068632_200025704644 [1,1,0,0,0,0|2,0,0]=4 5299 B10R1.25 Cc1cc(ccc1C#N)O 271570a_203496583355_100000687762 [1,1,0,0,0,0|1,0,1]=4 5300 B10R1.25 Cc1cc(ccc1C=O)O 271570a_203496583355_100000687586 [1,1,0,0,0,0|1,0,1]=4 5301 B10R1.25 Cc1cc(ccc1CF)O 271570a_203496583355_200010711859 [1,1,0,0,0,0|1,0,0]=3 5302 B10R1.25 Cc1cc(ccc1CN)O 271570a_203496583355_100000753881 [1,1,0,0,0,0|1,0,0]=3 5303 B10R1.25 Cc1cc(ccc1CO)O 271570a_203496583355_100000748258 [1,1,0,0,0,0|1,0,0]=3 5304 B10R1.25 Cc1cc(ccc1NN)O 271570a_203496583355_100000751375 [1,1,0,0,0,0|2,0,0]=4 5305 B10R1.25 Cc1cc(ccc1N[13CH3])Br 34a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 5306 B10R1.25 Cc1cc(ccc1N[13CH3])Br 7a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 5307 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 34a_100000210418_200025704644 [1,1,0,0,0,0|2,0,0]=4 5308 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 7a_100000210418_200025704644 [1,1,0,0,0,0|2,0,0]=4 5309 B10R1.25 Cc1cc(ccc1N[13CH3])F 34a_100000211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 5310 B10R1.25 Cc1cc(ccc1N[13CH3])F 7a_100000211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 5311 B10R1.25 Cc1cc(ccc1N[13CH3])I 34a_100000184554_200025704644 [1,1,0,0,0,0|2,0,0]=4 5312 B10R1.25 Cc1cc(ccc1N[13CH3])I 7a_100000184554_200025704644 [1,1,0,0,0,0|2,0,0]=4 5313 B10R1.25 Cc1cc(ccc1N[13CH3])O 34a_100000756630_200025704644 [1,1,0,0,0,0|1,0,0]=3 5314 B10R1.25 Cc1cc(ccc1O[13CH3])Br 34a_100000186361_200025704644 [1,1,0,0,0,0|1,0,0]=3 5315 B10R1.25 Cc1cc(ccc1O[13CH3])Br 7a_100000186361_200025704644 [1,1,0,0,0,0|1,0,0]=3 5316 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 34a_100000211091_200025704644 [1,1,0,0,0,0|1,0,0]=3 5317 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 7a_100000211091_200025704644 [1,1,0,0,0,0|1,0,0]=3 5318 B10R1.25 Cc1cc(ccc1O[13CH3])F 34a_100000764316_200025704644 [1,1,0,0,0,0|1,0,0]=3 5319 B10R1.25 Cc1cc(ccc1O[13CH3])F 7a_100000764316_200025704644 [1,1,0,0,0,0|1,0,0]=3 5320 B10R1.25 Cc1cc(ccc1O[13CH3])I 34a_100011218673_200025704644 [1,1,0,0,0,0|1,0,0]=3 5321 B10R1.25 Cc1cc(ccc1O[13CH3])I 7a_100011218673_200025704644 [1,1,0,0,0,0|1,0,0]=3 5322 B10R1.25 Cc1cc(ccc1O[13CH3])N 34a_100011218179_200025704644 [1,1,0,0,0,0|1,0,0]=3 5323 B10R1.25 Cc1cc(ccc1O[13CH3])N 7a_100011218179_200025704644 [1,1,0,0,0,0|1,0,0]=3 5324 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_100000701812_200025704644 [1,1,0,0,0,0|1,1,0]=4 5325 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_200025704644_100000701812 [1,1,0,0,0,0|1,1,0]=4 5326 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_100011219607_200025704644 [1,1,0,0,0,0|1,1,0]=4 5327 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_200025704644_100011219607 [1,1,0,0,0,0|1,1,0]=4 5328 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_100011205405_200025704644 [1,1,0,0,0,0|1,1,0]=4 5329 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_200025704644_100011205405 [1,1,0,0,0,0|1,1,0]=4 5330 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_100000210723_200025704644 [1,1,0,0,0,0|1,1,0]=4 5331 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_200025704644_100000210723 [1,1,0,0,0,0|1,1,0]=4 5332 B10R1.25 Cc1cc(ccc1S[13CH3])O 62a_200025704644_100000690111 [1,1,0,0,0,0|0,1,0]=3 5333 B10R1.25 Cc1cc(cnc1CO)O 271570a_203496583355_100010116297 [1,1,0,0,0,0|2,0,0]=4 5334 B10R1.25 Cc1cc(cnc1O[13CH3])Br 34a_100000685391_200025704644 [1,1,0,0,0,0|2,0,0]=4 5335 B10R1.25 Cc1cc(cnc1S[13CH3])O 62a_100012000486_200025704644 [1,1,0,0,0,0|1,1,0]=4 5336 B10R1.25 Cc1cc(cnc1S[13CH3])O 62a_200025704644_100012000486 [1,1,0,0,0,0|1,1,0]=4 5337 B10R1.25 Cc1cc(ncc1CO)O 271570a_203496583355_100010277336 [1,1,0,0,0,0|2,0,0]=4 5338 B10R1.25 Cc1cc(ncc1O[13CH3])Cl 34a_100000692680_200025704644 [1,1,0,0,0,0|2,0,0]=4 5339 B10R1.25 Cc1cc(ncc1O[13CH3])Cl 7a_100000692680_200025704644 [1,1,0,0,0,0|2,0,0]=4 5340 B10R1.25 Cc1cc(ncc1O[13CH3])F 34a_100009856773_200025704644 [1,1,0,0,0,0|2,0,0]=4 5341 B10R1.25 Cc1cc(ncc1O[13CH3])F 7a_100009856773_200025704644 [1,1,0,0,0,0|2,0,0]=4 5342 B10R1.25 Cc1cc(ncc1S[13CH3])O 62a_100000766222_200025704644 [1,1,0,0,0,0|1,1,0]=4 5343 B10R1.25 Cc1cc(ncc1S[13CH3])O 62a_200025704644_100000766222 [1,1,0,0,0,0|1,1,0]=4 5344 B10R1.25 Cc1ccc(c(c1)Br)N[13CH3] 34a_100000210942_200025704644 [1,1,0,0,0,0|2,0,0]=4 5345 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 34a_100000210800_200025704644 [1,1,0,0,0,0|1,0,0]=3 5346 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 7a_100000210800_200025704644 [1,1,0,0,0,0|1,0,0]=3 5347 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_100009813563_200025704644 [1,1,0,0,0,0|1,1,0]=4 5348 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100009813563 [1,1,0,0,0,0|1,1,0]=4 5349 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 34a_100000736561_200025704644 [1,1,0,0,0,0|2,0,0]=4 5350 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 7a_100000736561_200025704644 [1,1,0,0,0,0|2,0,0]=4 5351 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 34a_100000211776_200025704644 [1,1,0,0,0,0|1,0,0]=3 5352 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 7a_100000211776_200025704644 [1,1,0,0,0,0|1,0,0]=3 5353 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_100011217332_200025704644 [1,1,0,0,0,0|1,1,0]=4 5354 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011217332 [1,1,0,0,0,0|1,1,0]=4 5355 B10R1.25 Cc1ccc(c(c1)Cl)N[13CH3] 34a_100000210522_200025704644 [1,1,0,0,0,0|2,0,0]=4 5356 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 34a_100000749699_200025704644 [1,1,0,0,0,0|1,0,0]=3 5357 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 7a_100000749699_200025704644 [1,1,0,0,0,0|1,0,0]=3 5358 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_100011263221_200025704644 [1,1,0,0,0,0|1,1,0]=4 5359 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100011263221 [1,1,0,0,0,0|1,1,0]=4 5360 B10R1.25 Cc1ccc(c(c1)F)N[13CH3] 34a_100000211023_200025704644 [1,1,0,0,0,0|2,0,0]=4 5361 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 34a_100011216688_200025704644 [1,1,0,0,0,0|1,0,0]=3 5362 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 7a_100011216688_200025704644 [1,1,0,0,0,0|1,0,0]=3 5363 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_100011216119_200025704644 [1,1,0,0,0,0|1,1,0]=4 5364 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011216119 [1,1,0,0,0,0|1,1,0]=4 5365 B10R1.25 Cc1ccc(c(c1)I)N[13CH3] 34a_100011356834_200025704644 [1,1,0,0,0,0|2,0,0]=4 5366 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 34a_100000765521_200025704644 [1,1,0,0,0,0|1,0,0]=3 5367 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 7a_100000765521_200025704644 [1,1,0,0,0,0|1,0,0]=3 5368 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [1,1,0,0,0,0|1,0,0]=3 5369 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [1,1,0,0,0,0|1,0,0]=3 5370 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [1,1,0,0,0,0|1,1,0]=4 5371 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [1,1,0,0,0,0|1,1,0]=4 5372 B10R1.25 Cc1ccc(c(c1)O)N[13CH3] 34a_100000211527_200025704644 [1,1,0,0,0,0|2,0,0]=4 5373 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_100012002257_200025704644 [1,1,0,0,0,0|1,1,0]=4 5374 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012002257 [1,1,0,0,0,0|1,1,0]=4 5375 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 34a_100000702858_200025704644 [1,1,0,0,0,0|2,0,0]=4 5376 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 7a_100000702858_200025704644 [1,1,0,0,0,0|2,0,0]=4 5377 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 34a_100011218912_200025704644 [1,1,0,0,0,0|2,0,0]=4 5378 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 7a_100011218912_200025704644 [1,1,0,0,0,0|2,0,0]=4 5379 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 34a_100000086286_200025704644 [1,1,0,0,0,0|2,0,0]=4 5380 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 7a_100000086286_200025704644 [1,1,0,0,0,0|2,0,0]=4 5381 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 34a_100000079963_200025704644 [1,1,0,0,0,0|2,0,0]=4 5382 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 7a_100000079963_200025704644 [1,1,0,0,0,0|2,0,0]=4 5383 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 34a_100000023897_200025704644 [1,1,0,0,0,0|2,0,0]=4 5384 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 7a_100000023897_200025704644 [1,1,0,0,0,0|2,0,0]=4 5385 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 34a_100000694039_200025704644 [1,1,0,0,0,0|2,0,0]=4 5386 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 7a_100000694039_200025704644 [1,1,0,0,0,0|2,0,0]=4 5387 B10R1.25 Cc1cnc(c(c1)Br)O[13CH3] 34a_100000719714_200025704644 [1,1,0,0,0,0|2,0,0]=4 5388 B10R1.25 Cc1cnc(c(c1)N)O[13CH3] 34a_100012000488_200025704644 [1,1,0,0,0,0|2,0,0]=4 5389 B10R1.25 Cc1nc(ccc1O[13CH3])Br 34a_100012002022_200025704644 [1,1,0,0,0,0|2,0,0]=4 5390 B10R1.25 Cc1nc(ccc1O[13CH3])Br 7a_100012002022_200025704644 [1,1,0,0,0,0|2,0,0]=4 5391 B10R1.25 Cc1nc(ccc1O[13CH3])Cl 34a_100012184626_200025704644 [1,1,0,0,0,0|2,0,0]=4 5392 B10R1.25 Cc1nc(ccc1O[13CH3])Cl 7a_100012184626_200025704644 [1,1,0,0,0,0|2,0,0]=4 5393 B10R1.25 Cc1nc(ccc1O[13CH3])F 34a_100009881036_200025704644 [1,1,0,0,0,0|2,0,0]=4 5394 B10R1.25 Cc1nc(ccc1O[13CH3])F 7a_100009881036_200025704644 [1,1,0,0,0,0|2,0,0]=4 5395 B10R1.25 Cc1nc(ccc1O[13CH3])I 34a_100010233687_200025704644 [1,1,0,0,0,0|2,0,0]=4 5396 B10R1.25 Cc1nc(ccc1O[13CH3])I 7a_100010233687_200025704644 [1,1,0,0,0,0|2,0,0]=4 5397 B10R1.25 Cc1nc(ccc1S[13CH3])O 62a_100000691680_200025704644 [1,1,0,0,0,0|1,1,0]=4 5398 B10R1.25 Cc1nc(ccc1S[13CH3])O 62a_200025704644_100000691680 [1,1,0,0,0,0|1,1,0]=4 5399 B10R1.25 N#Cc1ccc(cc1Br)O 271570a_203496583355_100012349582 [1,1,0,0,0,0|1,0,1]=4 5400 B10R1.25 N#Cc1ccc(cc1Cl)O 271570a_203496583355_100012349662 [1,1,0,0,0,0|1,0,1]=4 5401 B10R1.25 N#Cc1ccc(cc1F)O 271570a_203496583355_100000037869 [1,1,0,0,0,0|1,0,1]=4 5402 B10R1.25 N#Cc1ccc(cc1N)O 271570a_203496583355_100000699244 [1,1,0,0,0,0|1,0,1]=4 5403 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100011934713 [1,1,0,0,0,0|1,0,1]=4 5404 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100012184851 [1,1,0,0,0,0|1,0,1]=4 5405 B10R1.25 NCc1ccc(cc1F)O 271570a_203496583355_100000754580 [1,1,0,0,0,0|1,0,0]=3 5406 B10R1.25 NCc1ccc(cc1O)F 271570a_203496583355_100000708791 [1,1,0,0,0,0|2,0,0]=4 5407 B10R1.25 NCc1ncc(cc1F)O 271570a_203496583355_100015188786 [1,1,0,0,0,0|2,0,0]=4 5408 B10R1.25 NNc1ccc(cc1F)O 271570a_203496583355_100000751572 [1,1,0,0,0,0|2,0,0]=4 5409 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [1,1,0,0,0,0|1,0,1]=4 5410 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [1,1,0,0,0,0|1,0,0]=3 5411 B10R1.25 Nc1cc(ncc1CO)O 271570a_203496583355_100009830438 [1,1,0,0,0,0|2,0,0]=4 5412 B10R1.25 O=Cc1ccc(cc1Br)O 271570a_203496583355_100010185650 [1,1,0,0,0,0|1,0,1]=4 5413 B10R1.25 O=Cc1ccc(cc1Cl)O 271570a_203496583355_100000727542 [1,1,0,0,0,0|1,0,1]=4 5414 B10R1.25 O=Cc1ccc(cc1F)O 271570a_203496583355_100000211676 [1,1,0,0,0,0|1,0,1]=4 5415 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [1,1,0,0,0,0|1,0,1]=4 5416 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [1,1,0,0,0,0|1,0,1]=4 5417 B10R1.25 OCc1ccc(cc1Br)O 271570a_203496583355_100010240206 [1,1,0,0,0,0|1,0,0]=3 5418 B10R1.25 OCc1ccc(cc1F)O 271570a_203496583355_100011191541 [1,1,0,0,0,0|1,0,0]=3 5419 B10R1.25 OCc1ccc(cc1O)Br 271570a_203496583355_100010146605 [1,1,0,0,0,0|2,0,0]=4 5420 B10R1.25 OCc1ccc(cc1O)Cl 271570a_203496583355_100000722340 [1,1,0,0,0,0|2,0,0]=4 5421 B10R1.25 OCc1ccc(cc1O)F 271570a_203496583355_100000744086 [1,1,0,0,0,0|2,0,0]=4 5422 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100000071718 [1,1,0,0,0,0|1,0,0]=3 5423 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100010146404 [1,1,0,0,0,0|1,0,0]=3 5424 B10R1.25 OCc1ccc(nc1F)O 271570a_203496583355_100009870654 [1,1,0,0,0,0|2,0,0]=4 5425 B10R1.25 OCc1ncc(cc1F)O 271570a_203496583355_100010065252 [1,1,0,0,0,0|2,0,0]=4 5426 B10R1.25 [13CH3]Nc1ccc(cc1Br)Br 34a_100000211012_200025704644 [1,1,0,0,0,0|2,0,0]=4 5427 B10R1.25 [13CH3]Nc1ccc(cc1Br)Cl 34a_100000752454_200025704644 [1,1,0,0,0,0|2,0,0]=4 5428 B10R1.25 [13CH3]Nc1ccc(cc1Br)F 34a_100000738039_200025704644 [1,1,0,0,0,0|2,0,0]=4 5429 B10R1.25 [13CH3]Nc1ccc(cc1Br)O 34a_100012001276_200025704644 [1,1,0,0,0,0|1,0,0]=3 5430 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Br 34a_100000211467_200025704644 [1,1,0,0,0,0|2,0,0]=4 5431 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Cl 34a_100000185861_200025704644 [1,1,0,0,0,0|2,0,0]=4 5432 B10R1.25 [13CH3]Nc1ccc(cc1Cl)F 34a_100000212003_200025704644 [1,1,0,0,0,0|2,0,0]=4 5433 B10R1.25 [13CH3]Nc1ccc(cc1Cl)I 34a_100011218065_200025704644 [1,1,0,0,0,0|2,0,0]=4 5434 B10R1.25 [13CH3]Nc1ccc(cc1Cl)O 34a_100011215599_200025704644 [1,1,0,0,0,0|1,0,0]=3 5435 B10R1.25 [13CH3]Nc1ccc(cc1F)Br 34a_100000210722_200025704644 [1,1,0,0,0,0|2,0,0]=4 5436 B10R1.25 [13CH3]Nc1ccc(cc1F)Cl 34a_100000211020_200025704644 [1,1,0,0,0,0|2,0,0]=4 5437 B10R1.25 [13CH3]Nc1ccc(cc1F)F 34a_100000210720_200025704644 [1,1,0,0,0,0|2,0,0]=4 5438 B10R1.25 [13CH3]Nc1ccc(cc1F)I 34a_100011215594_200025704644 [1,1,0,0,0,0|2,0,0]=4 5439 B10R1.25 [13CH3]Nc1ccc(cc1F)O 34a_100000759473_200025704644 [1,1,0,0,0,0|1,0,0]=3 5440 B10R1.25 [13CH3]Nc1ccc(cc1I)Br 34a_100000187925_200025704644 [1,1,0,0,0,0|2,0,0]=4 5441 B10R1.25 [13CH3]Nc1ccc(cc1I)Cl 34a_100000761889_200025704644 [1,1,0,0,0,0|2,0,0]=4 5442 B10R1.25 [13CH3]Nc1ccc(cc1I)F 34a_100000760547_200025704644 [1,1,0,0,0,0|2,0,0]=4 5443 B10R1.25 [13CH3]Nc1ccc(cc1I)O 34a_100010084370_200025704644 [1,1,0,0,0,0|1,0,0]=3 5444 B10R1.25 [13CH3]Nc1ccc(cc1O)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 5445 B10R1.25 [13CH3]Nc1ccc(cc1O)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|2,0,0]=4 5446 B10R1.25 [13CH3]Nc1ccc(cc1O)F 34a_100000753323_200025704644 [1,1,0,0,0,0|2,0,0]=4 5447 B10R1.25 [13CH3]Nc1ccc(cc1O)O 34a_100000106777_200025704644 [1,1,0,0,0,0|1,0,0]=3 5448 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 34a_100000188717_200025704644 [1,1,0,0,0,0|1,0,0]=3 5449 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 7a_100000188717_200025704644 [1,1,0,0,0,0|1,0,0]=3 5450 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 34a_100000211998_200025704644 [1,1,0,0,0,0|1,0,0]=3 5451 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 7a_100000211998_200025704644 [1,1,0,0,0,0|1,0,0]=3 5452 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 34a_100000211999_200025704644 [1,1,0,0,0,0|1,0,0]=3 5453 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 7a_100000211999_200025704644 [1,1,0,0,0,0|1,0,0]=3 5454 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 34a_100012361655_200025704644 [1,1,0,0,0,0|1,0,0]=3 5455 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 7a_100012361655_200025704644 [1,1,0,0,0,0|1,0,0]=3 5456 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 34a_100011534360_200025704644 [1,1,0,0,0,0|1,0,0]=3 5457 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 7a_100011534360_200025704644 [1,1,0,0,0,0|1,0,0]=3 5458 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 34a_100000186472_200025704644 [1,1,0,0,0,0|1,0,0]=3 5459 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 7a_100000186472_200025704644 [1,1,0,0,0,0|1,0,0]=3 5460 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 34a_100015191787_200025704644 [1,1,0,0,0,0|1,0,0]=3 5461 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 7a_100015191787_200025704644 [1,1,0,0,0,0|1,0,0]=3 5462 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 34a_100000212004_200025704644 [1,1,0,0,0,0|1,0,0]=3 5463 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 7a_100000212004_200025704644 [1,1,0,0,0,0|1,0,0]=3 5464 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 34a_100012360047_200025704644 [1,1,0,0,0,0|1,0,0]=3 5465 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 7a_100012360047_200025704644 [1,1,0,0,0,0|1,0,0]=3 5466 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 34a_100000744943_200025704644 [1,1,0,0,0,0|1,0,0]=3 5467 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 7a_100000744943_200025704644 [1,1,0,0,0,0|1,0,0]=3 5468 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 34a_100000185481_200025704644 [1,1,0,0,0,0|1,0,0]=3 5469 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 7a_100000185481_200025704644 [1,1,0,0,0,0|1,0,0]=3 5470 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 34a_100000230166_200025704644 [1,1,0,0,0,0|1,0,0]=3 5471 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 7a_100000230166_200025704644 [1,1,0,0,0,0|1,0,0]=3 5472 B10R1.25 [13CH3]Oc1ccc(cc1F)F 34a_100000230127_200025704644 [1,1,0,0,0,0|1,0,0]=3 5473 B10R1.25 [13CH3]Oc1ccc(cc1F)F 7a_100000230127_200025704644 [1,1,0,0,0,0|1,0,0]=3 5474 B10R1.25 [13CH3]Oc1ccc(cc1F)I 34a_100011356965_200025704644 [1,1,0,0,0,0|1,0,0]=3 5475 B10R1.25 [13CH3]Oc1ccc(cc1F)I 7a_100011356965_200025704644 [1,1,0,0,0,0|1,0,0]=3 5476 B10R1.25 [13CH3]Oc1ccc(cc1F)N 34a_100011220035_200025704644 [1,1,0,0,0,0|1,0,0]=3 5477 B10R1.25 [13CH3]Oc1ccc(cc1F)N 7a_100011220035_200025704644 [1,1,0,0,0,0|1,0,0]=3 5478 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 34a_100012355227_200025704644 [1,1,0,0,0,0|1,0,0]=3 5479 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 7a_100012355227_200025704644 [1,1,0,0,0,0|1,0,0]=3 5480 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 34a_100011356953_200025704644 [1,1,0,0,0,0|1,0,0]=3 5481 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 7a_100011356953_200025704644 [1,1,0,0,0,0|1,0,0]=3 5482 B10R1.25 [13CH3]Oc1ccc(cc1I)F 34a_100012355409_200025704644 [1,1,0,0,0,0|1,0,0]=3 5483 B10R1.25 [13CH3]Oc1ccc(cc1I)F 7a_100012355409_200025704644 [1,1,0,0,0,0|1,0,0]=3 5484 B10R1.25 [13CH3]Oc1ccc(cc1I)I 7a_100010001573_200025704644 [1,1,0,0,0,0|1,0,0]=3 5485 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|1,0,0]=3 5486 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 7a_100000752626_200025704644 [1,1,0,0,0,0|1,0,0]=3 5487 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|1,0,0]=3 5488 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 7a_100000210500_200025704644 [1,1,0,0,0,0|1,0,0]=3 5489 B10R1.25 [13CH3]Oc1ccc(cc1N)F 34a_100000759472_200025704644 [1,1,0,0,0,0|1,0,0]=3 5490 B10R1.25 [13CH3]Oc1ccc(cc1N)F 7a_100000759472_200025704644 [1,1,0,0,0,0|1,0,0]=3 5491 B10R1.25 [13CH3]Oc1ccc(cc1N)I 34a_100000753495_200025704644 [1,1,0,0,0,0|1,0,0]=3 5492 B10R1.25 [13CH3]Oc1ccc(cc1N)I 7a_100000753495_200025704644 [1,1,0,0,0,0|1,0,0]=3 5493 B10R1.25 [13CH3]Oc1ccc(cc1N)N 34a_100000725306_200025704644 [1,1,0,0,0,0|1,0,0]=3 5494 B10R1.25 [13CH3]Oc1ccc(nc1Br)Br 34a_100009999766_200025704644 [1,1,0,0,0,0|2,0,0]=4 5495 B10R1.25 [13CH3]Oc1ccc(nc1Br)Br 7a_100009999766_200025704644 [1,1,0,0,0,0|2,0,0]=4 5496 B10R1.25 [13CH3]Oc1ccc(nc1Br)Cl 34a_100010219353_200025704644 [1,1,0,0,0,0|2,0,0]=4 5497 B10R1.25 [13CH3]Oc1ccc(nc1Br)Cl 7a_100010219353_200025704644 [1,1,0,0,0,0|2,0,0]=4 5498 B10R1.25 [13CH3]Oc1ccc(nc1Br)F 34a_100009887730_200025704644 [1,1,0,0,0,0|2,0,0]=4 5499 B10R1.25 [13CH3]Oc1ccc(nc1Br)F 7a_100009887730_200025704644 [1,1,0,0,0,0|2,0,0]=4 5500 B10R1.25 [13CH3]Oc1ccc(nc1Br)I 34a_100000725334_200025704644 [1,1,0,0,0,0|2,0,0]=4 5501 B10R1.25 [13CH3]Oc1ccc(nc1Br)I 7a_100000725334_200025704644 [1,1,0,0,0,0|2,0,0]=4 5502 B10R1.25 [13CH3]Oc1ccc(nc1Cl)Br 34a_100010246206_200025704644 [1,1,0,0,0,0|2,0,0]=4 5503 B10R1.25 [13CH3]Oc1ccc(nc1Cl)Br 7a_100010246206_200025704644 [1,1,0,0,0,0|2,0,0]=4 5504 B10R1.25 [13CH3]Oc1ccc(nc1Cl)Cl 34a_100000101165_200025704644 [1,1,0,0,0,0|2,0,0]=4 5505 B10R1.25 [13CH3]Oc1ccc(nc1Cl)Cl 7a_100000101165_200025704644 [1,1,0,0,0,0|2,0,0]=4 5506 B10R1.25 [13CH3]Oc1ccc(nc1Cl)I 34a_100000721234_200025704644 [1,1,0,0,0,0|2,0,0]=4 5507 B10R1.25 [13CH3]Oc1ccc(nc1Cl)I 7a_100000721234_200025704644 [1,1,0,0,0,0|2,0,0]=4 5508 B10R1.25 [13CH3]Oc1ccc(nc1F)Br 34a_100009819667_200025704644 [1,1,0,0,0,0|2,0,0]=4 5509 B10R1.25 [13CH3]Oc1ccc(nc1F)Br 7a_100009819667_200025704644 [1,1,0,0,0,0|2,0,0]=4 5510 B10R1.25 [13CH3]Oc1ccc(nc1F)Cl 34a_100009880201_200025704644 [1,1,0,0,0,0|2,0,0]=4 5511 B10R1.25 [13CH3]Oc1ccc(nc1F)Cl 7a_100009880201_200025704644 [1,1,0,0,0,0|2,0,0]=4 5512 B10R1.25 [13CH3]Oc1ccc(nc1F)F 34a_100000101184_200025704644 [1,1,0,0,0,0|2,0,0]=4 5513 B10R1.25 [13CH3]Oc1ccc(nc1F)F 7a_100000101184_200025704644 [1,1,0,0,0,0|2,0,0]=4 5514 B10R1.25 [13CH3]Oc1ccc(nc1I)Br 34a_100010253912_200025704644 [1,1,0,0,0,0|2,0,0]=4 5515 B10R1.25 [13CH3]Oc1ccc(nc1I)Br 7a_100010253912_200025704644 [1,1,0,0,0,0|2,0,0]=4 5516 B10R1.25 [13CH3]Oc1ccc(nc1I)Cl 34a_100000696390_200025704644 [1,1,0,0,0,0|2,0,0]=4 5517 B10R1.25 [13CH3]Oc1ccc(nc1I)Cl 7a_100000696390_200025704644 [1,1,0,0,0,0|2,0,0]=4 5518 B10R1.25 [13CH3]Oc1ccc(nc1I)F 34a_100010382442_200025704644 [1,1,0,0,0,0|2,0,0]=4 5519 B10R1.25 [13CH3]Oc1ccc(nc1I)F 7a_100010382442_200025704644 [1,1,0,0,0,0|2,0,0]=4 5520 B10R1.25 [13CH3]Oc1ccc(nc1N)Br 34a_100000685527_200025704644 [1,1,0,0,0,0|2,0,0]=4 5521 B10R1.25 [13CH3]Oc1ccc(nc1N)Br 7a_100000685527_200025704644 [1,1,0,0,0,0|2,0,0]=4 5522 B10R1.25 [13CH3]Oc1ccc(nc1N)Cl 34a_100000717809_200025704644 [1,1,0,0,0,0|2,0,0]=4 5523 B10R1.25 [13CH3]Oc1ccc(nc1N)Cl 7a_100000717809_200025704644 [1,1,0,0,0,0|2,0,0]=4 5524 B10R1.25 [13CH3]Oc1cnc(cc1Cl)Cl 34a_100009868576_200025704644 [1,1,0,0,0,0|2,0,0]=4 5525 B10R1.25 [13CH3]Oc1cnc(cc1Cl)Cl 7a_100009868576_200025704644 [1,1,0,0,0,0|2,0,0]=4 5526 B10R1.25 [13CH3]Oc1cnc(cc1F)F 34a_100009885687_200025704644 [1,1,0,0,0,0|2,0,0]=4 5527 B10R1.25 [13CH3]Oc1cnc(cc1F)F 7a_100009885687_200025704644 [1,1,0,0,0,0|2,0,0]=4 5528 B10R1.25 [13CH3]Oc1cnc(cc1I)Cl 34a_100000698892_200025704644 [1,1,0,0,0,0|2,0,0]=4 5529 B10R1.25 [13CH3]Oc1cnc(cc1I)Cl 7a_100000698892_200025704644 [1,1,0,0,0,0|2,0,0]=4 5530 B10R1.25 [13CH3]Oc1cnc(cc1N)Br 34a_100009819941_200025704644 [1,1,0,0,0,0|2,0,0]=4 5531 B10R1.25 [13CH3]Oc1cnc(cc1N)Br 7a_100009819941_200025704644 [1,1,0,0,0,0|2,0,0]=4 5532 B10R1.25 [13CH3]Oc1ncc(cc1Br)Br 34a_100000701035_200025704644 [1,1,0,0,0,0|2,0,0]=4 5533 B10R1.25 [13CH3]Oc1ncc(cc1Cl)Br 34a_100012339560_200025704644 [1,1,0,0,0,0|2,0,0]=4 5534 B10R1.25 [13CH3]Oc1ncc(cc1Cl)F 34a_100009847679_200025704644 [1,1,0,0,0,0|2,0,0]=4 5535 B10R1.25 [13CH3]Oc1ncc(cc1F)Cl 34a_100011998252_200025704644 [1,1,0,0,0,0|2,0,0]=4 5536 B10R1.25 [13CH3]Oc1ncc(cc1F)F 34a_100012025737_200025704644 [1,1,0,0,0,0|2,0,0]=4 5537 B10R1.25 [13CH3]Oc1ncc(cc1N)Br 34a_100000743729_200025704644 [1,1,0,0,0,0|2,0,0]=4 5538 B10R1.25 [13CH3]Oc1ncc(cc1N)Cl 34a_100011998249_200025704644 [1,1,0,0,0,0|2,0,0]=4 5539 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_100011484698_200025704644 [1,1,0,0,0,0|1,1,0]=4 5540 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_200025704644_100011484698 [1,1,0,0,0,0|1,1,0]=4 5541 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_100011219703_200025704644 [1,1,0,0,0,0|1,1,0]=4 5542 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_200025704644_100011219703 [1,1,0,0,0,0|1,1,0]=4 5543 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_100011217111_200025704644 [1,1,0,0,0,0|1,1,0]=4 5544 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_200025704644_100011217111 [1,1,0,0,0,0|1,1,0]=4 5545 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_100000750458_200025704644 [1,1,0,0,0,0|1,1,0]=4 5546 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_200025704644_100000750458 [1,1,0,0,0,0|1,1,0]=4 5547 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_100000701344_200025704644 [1,1,0,0,0,0|0,1,0]=3 5548 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_200025704644_100000701344 [1,1,0,0,0,0|0,1,0]=3 5549 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_100011216062_200025704644 [1,1,0,0,0,0|1,1,0]=4 5550 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_200025704644_100011216062 [1,1,0,0,0,0|1,1,0]=4 5551 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_100000699841_200025704644 [1,1,0,0,0,0|1,1,0]=4 5552 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_200025704644_100000699841 [1,1,0,0,0,0|1,1,0]=4 5553 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_100000733362_200025704644 [1,1,0,0,0,0|1,1,0]=4 5554 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_200025704644_100000733362 [1,1,0,0,0,0|1,1,0]=4 5555 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_100000761885_200025704644 [1,1,0,0,0,0|1,1,0]=4 5556 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_200025704644_100000761885 [1,1,0,0,0,0|1,1,0]=4 5557 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_100000047559_200025704644 [1,1,0,0,0,0|0,1,0]=3 5558 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_200025704644_100000047559 [1,1,0,0,0,0|0,1,0]=3 5559 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_100009814013_200025704644 [1,1,0,0,0,0|1,1,0]=4 5560 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_200025704644_100009814013 [1,1,0,0,0,0|1,1,0]=4 5561 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_100011216042_200025704644 [1,1,0,0,0,0|1,1,0]=4 5562 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_200025704644_100011216042 [1,1,0,0,0,0|1,1,0]=4 5563 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_100000750030_200025704644 [1,1,0,0,0,0|1,1,0]=4 5564 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_200025704644_100000750030 [1,1,0,0,0,0|1,1,0]=4 5565 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_100011356925_200025704644 [1,1,0,0,0,0|1,1,0]=4 5566 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_200025704644_100011356925 [1,1,0,0,0,0|1,1,0]=4 5567 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_100000755031_200025704644 [1,1,0,0,0,0|0,1,0]=3 5568 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_200025704644_100000755031 [1,1,0,0,0,0|0,1,0]=3 5569 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_100000743836_200025704644 [1,1,0,0,0,0|1,1,0]=4 5570 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_200025704644_100000743836 [1,1,0,0,0,0|1,1,0]=4 5571 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_100000761886_200025704644 [1,1,0,0,0,0|1,1,0]=4 5572 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_200025704644_100000761886 [1,1,0,0,0,0|1,1,0]=4 5573 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_100000687223_200025704644 [1,1,0,0,0,0|1,1,0]=4 5574 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_200025704644_100000687223 [1,1,0,0,0,0|1,1,0]=4 5575 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200012175722_200025704644 [1,1,0,0,0,0|1,1,0]=4 5576 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200025704644_200012175722 [1,1,0,0,0,0|1,1,0]=4 5577 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_100011999798_200025704644 [1,1,0,0,0,0|0,1,0]=3 5578 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_200025704644_100011999798 [1,1,0,0,0,0|0,1,0]=3 5579 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_100012344904_200025704644 [1,1,0,0,0,0|1,1,0]=4 5580 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_200025704644_100012344904 [1,1,0,0,0,0|1,1,0]=4 5581 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_100000050036_200025704644 [1,1,0,0,0,0|1,1,0]=4 5582 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_200025704644_100000050036 [1,1,0,0,0,0|1,1,0]=4 5583 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_100000690578_200025704644 [1,1,0,0,0,0|1,1,0]=4 5584 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_200025704644_100000690578 [1,1,0,0,0,0|1,1,0]=4 5585 B10R1.25 [13CH3]Sc1ccc(cc1O)O 62a_200025704644_100009813921 [1,1,0,0,0,0|0,1,0]=3 5586 B10R1.25 [13CH3]Sc1ccc(nc1F)O 62a_100009879308_200025704644 [1,1,0,0,0,0|1,1,0]=4 5587 B10R1.25 [13CH3]Sc1ccc(nc1F)O 62a_200025704644_100009879308 [1,1,0,0,0,0|1,1,0]=4 5588 B10R1.25 [13CH3]Sc1ncc(cc1F)O 62a_200025704644_100000063512 [1,1,0,0,0,0|1,1,0]=4 5589 B10R1.176 C=Cc1ccc(c(c1)Br)O 271570a_100011290941_100012361655 [1,1,0,0,0,0|0,0,2]=4 5590 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [1,1,0,0,0,0|0,0,2]=4 5591 B10R1.176 C=Cc1ccc(c(c1)Cl)O 271570a_100011290941_100012360047 [1,1,0,0,0,0|0,0,2]=4 5592 B10R1.176 C=Cc1ccc(c(c1)F)O 271570a_100011290941_100000185481 [1,1,0,0,0,0|0,0,2]=4 5593 B10R1.176 C=Cc1ccc(c(c1)N)O 271570a_100011290941_100000752626 [1,1,0,0,0,0|0,0,2]=4 5594 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [1,1,0,0,0,0|0,0,2]=4 5595 B10R1.176 CCc1ccc(c(c1)Br)O 271570a_203496583355_200009997437 [1,1,0,0,0,0|0,0,0]=2 5596 B10R1.176 CCc1ccc(c(c1)F)O 271570a_203496583355_200010339503 [1,1,0,0,0,0|0,0,0]=2 5597 B10R1.176 CCc1ccc(c(c1)O)F 271570a_203496583355_200010244628 [1,1,0,0,0,0|1,0,0]=3 5598 B10R1.176 CCc1ccc(c(c1)O)N 271570a_203496583355_100012339725 [1,1,0,0,0,0|1,0,0]=3 5599 B10R1.176 CCc1ccc(c(c1)O)O 271570a_203496583355_100012339963 [1,1,0,0,0,0|0,0,0]=2 5600 B10R1.176 CNc1cc(c(cn1)O)C 271570a_203496583355_100012352278 [1,1,0,0,0,0|2,0,0]=4 5601 B10R1.176 CNc1ccc(c(c1)Br)Br 2230a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 5602 B10R1.176 CNc1ccc(c(c1)Br)Br 34a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 5603 B10R1.176 CNc1ccc(c(c1)Br)Br 7a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 5604 B10R1.176 CNc1ccc(c(c1)Br)C 2230a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 5605 B10R1.176 CNc1ccc(c(c1)Br)C 34a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 5606 B10R1.176 CNc1ccc(c(c1)Br)C 7a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 5607 B10R1.176 CNc1ccc(c(c1)Br)Cl 2230a_100000686031_200000210301 [1,1,0,0,0,0|2,0,0]=4 5608 B10R1.176 CNc1ccc(c(c1)Br)Cl 34a_100000686031_200000210301 [1,1,0,0,0,0|2,0,0]=4 5609 B10R1.176 CNc1ccc(c(c1)Br)F 2230a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 5610 B10R1.176 CNc1ccc(c(c1)Br)F 34a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 5611 B10R1.176 CNc1ccc(c(c1)Br)F 7a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 5612 B10R1.176 CNc1ccc(c(c1)Br)I 34a_100000750458_200000210301 [1,1,0,0,0,0|2,0,0]=4 5613 B10R1.176 CNc1ccc(c(c1)Br)O 34a_100011534360_200000210301 [1,1,0,0,0,0|1,0,0]=3 5614 B10R1.176 CNc1ccc(c(c1)C)Br 2230a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 5615 B10R1.176 CNc1ccc(c(c1)C)Br 34a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 5616 B10R1.176 CNc1ccc(c(c1)C)Br 7a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 5617 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [1,1,0,0,0,0|2,0,0]=4 5618 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [1,1,0,0,0,0|2,0,0]=4 5619 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [1,1,0,0,0,0|2,0,0]=4 5620 B10R1.176 CNc1ccc(c(c1)C)Cl 2230a_100000187808_200000210301 [1,1,0,0,0,0|2,0,0]=4 5621 B10R1.176 CNc1ccc(c(c1)C)Cl 34a_100000187808_200000210301 [1,1,0,0,0,0|2,0,0]=4 5622 B10R1.176 CNc1ccc(c(c1)C)Cl 7a_100000187808_200000210301 [1,1,0,0,0,0|2,0,0]=4 5623 B10R1.176 CNc1ccc(c(c1)C)F 2230a_100000750164_200000210301 [1,1,0,0,0,0|2,0,0]=4 5624 B10R1.176 CNc1ccc(c(c1)C)F 34a_100000750164_200000210301 [1,1,0,0,0,0|2,0,0]=4 5625 B10R1.176 CNc1ccc(c(c1)C)F 7a_100000750164_200000210301 [1,1,0,0,0,0|2,0,0]=4 5626 B10R1.176 CNc1ccc(c(c1)C)I 34a_100000198070_200000210301 [1,1,0,0,0,0|2,0,0]=4 5627 B10R1.176 CNc1ccc(c(c1)C)I 7a_100000198070_200000210301 [1,1,0,0,0,0|2,0,0]=4 5628 B10R1.176 CNc1ccc(c(c1)C)O 271570a_203496583355_100102888905 [1,1,0,0,0,0|1,0,0]=3 5629 B10R1.176 CNc1ccc(c(c1)C)O 34a_100011218179_200000210301 [1,1,0,0,0,0|1,0,0]=3 5630 B10R1.176 CNc1ccc(c(c1)C)O 7a_100011218179_200000210301 [1,1,0,0,0,0|1,0,0]=3 5631 B10R1.176 CNc1ccc(c(c1)Cl)Br 2230a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 5632 B10R1.176 CNc1ccc(c(c1)Cl)Br 34a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 5633 B10R1.176 CNc1ccc(c(c1)Cl)Br 7a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 5634 B10R1.176 CNc1ccc(c(c1)Cl)C 2230a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 5635 B10R1.176 CNc1ccc(c(c1)Cl)C 34a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 5636 B10R1.176 CNc1ccc(c(c1)Cl)C 7a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 5637 B10R1.176 CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_200000210301 [1,1,0,0,0,0|2,0,0]=4 5638 B10R1.176 CNc1ccc(c(c1)Cl)Cl 34a_100000184108_200000210301 [1,1,0,0,0,0|2,0,0]=4 5639 B10R1.176 CNc1ccc(c(c1)Cl)F 2230a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 5640 B10R1.176 CNc1ccc(c(c1)Cl)F 34a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 5641 B10R1.176 CNc1ccc(c(c1)Cl)F 7a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 5642 B10R1.176 CNc1ccc(c(c1)Cl)I 34a_100000761885_200000210301 [1,1,0,0,0,0|2,0,0]=4 5643 B10R1.176 CNc1ccc(c(c1)Cl)O 34a_100000744943_200000210301 [1,1,0,0,0,0|1,0,0]=3 5644 B10R1.176 CNc1ccc(c(c1)F)Br 2230a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 5645 B10R1.176 CNc1ccc(c(c1)F)Br 34a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 5646 B10R1.176 CNc1ccc(c(c1)F)Br 7a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 5647 B10R1.176 CNc1ccc(c(c1)F)C 2230a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 5648 B10R1.176 CNc1ccc(c(c1)F)C 34a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 5649 B10R1.176 CNc1ccc(c(c1)F)C 7a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 5650 B10R1.176 CNc1ccc(c(c1)F)Cl 2230a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 5651 B10R1.176 CNc1ccc(c(c1)F)Cl 34a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 5652 B10R1.176 CNc1ccc(c(c1)F)Cl 7a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 5653 B10R1.176 CNc1ccc(c(c1)F)F 2230a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 5654 B10R1.176 CNc1ccc(c(c1)F)F 34a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 5655 B10R1.176 CNc1ccc(c(c1)F)F 7a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 5656 B10R1.176 CNc1ccc(c(c1)F)I 34a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 5657 B10R1.176 CNc1ccc(c(c1)F)I 7a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 5658 B10R1.176 CNc1ccc(c(c1)F)O 271570a_203496583355_100012285320 [1,1,0,0,0,0|1,0,0]=3 5659 B10R1.176 CNc1ccc(c(c1)F)O 34a_100011220035_200000210301 [1,1,0,0,0,0|1,0,0]=3 5660 B10R1.176 CNc1ccc(c(c1)F)O 7a_100011220035_200000210301 [1,1,0,0,0,0|1,0,0]=3 5661 B10R1.176 CNc1ccc(c(c1)I)Br 34a_100000750459_200000210301 [1,1,0,0,0,0|2,0,0]=4 5662 B10R1.176 CNc1ccc(c(c1)I)C 34a_100000184131_200000210301 [1,1,0,0,0,0|2,0,0]=4 5663 B10R1.176 CNc1ccc(c(c1)I)C 7a_100000184131_200000210301 [1,1,0,0,0,0|2,0,0]=4 5664 B10R1.176 CNc1ccc(c(c1)I)Cl 34a_100012360549_200000210301 [1,1,0,0,0,0|2,0,0]=4 5665 B10R1.176 CNc1ccc(c(c1)I)F 34a_114828291077_200000210301 [1,1,0,0,0,0|2,0,0]=4 5666 B10R1.176 CNc1ccc(c(c1)I)F 7a_114828291077_200000210301 [1,1,0,0,0,0|2,0,0]=4 5667 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [1,1,0,0,0,0|2,0,0]=4 5668 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 5669 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 5670 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [1,1,0,0,0,0|2,0,0]=4 5671 B10R1.176 CNc1ccc(c(c1)O)F 34a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 5672 B10R1.176 CNc1ccc(c(c1)O)F 7a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 5673 B10R1.176 CNc1ccc(c(c1)O)O 34a_100102946323_200000210301 [1,1,0,0,0,0|1,0,0]=3 5674 B10R1.176 COc1cc(c(cn1)Br)C 34a_100000766222_200000210301 [1,1,0,0,0,0|2,0,0]=4 5675 B10R1.176 COc1cc(c(cn1)Br)Cl 34a_100010369989_200000210301 [1,1,0,0,0,0|2,0,0]=4 5676 B10R1.176 COc1cc(c(cn1)C)Br 34a_100009831917_200000210301 [1,1,0,0,0,0|2,0,0]=4 5677 B10R1.176 COc1cc(c(cn1)C)O 271570a_203496583355_100010068546 [1,1,0,0,0,0|2,0,0]=4 5678 B10R1.176 COc1cc(c(cn1)Cl)C 34a_200000085746_200000210301 [1,1,0,0,0,0|2,0,0]=4 5679 B10R1.176 COc1cc(c(cn1)Cl)Cl 34a_200000099200_200000210301 [1,1,0,0,0,0|2,0,0]=4 5680 B10R1.176 COc1cc(c(cn1)Cl)O 271570a_203496583355_100010068019 [1,1,0,0,0,0|2,0,0]=4 5681 B10R1.176 COc1cc(c(cn1)F)O 271570a_203496583355_100010160775 [1,1,0,0,0,0|2,0,0]=4 5682 B10R1.176 COc1cc(c(cn1)O)C 271570a_203496583355_100011934368 [1,1,0,0,0,0|1,0,0]=3 5683 B10R1.176 COc1cc(c(cn1)O)F 271570a_203496583355_100010136277 [1,1,0,0,0,0|1,0,0]=3 5684 B10R1.176 COc1cc(c(cn1)O)N 271570a_203496583355_100010254562 [1,1,0,0,0,0|1,0,0]=3 5685 B10R1.176 COc1cc(c(cn1)O)O 271570a_203496583355_100010738159 [1,1,0,0,0,0|1,0,0]=3 5686 B10R1.176 COc1ccc(c(c1)Br)C 34a_100011380479_200000210301 [1,1,0,0,0,0|1,0,0]=3 5687 B10R1.176 COc1ccc(c(c1)Br)C 7a_100011380479_200000210301 [1,1,0,0,0,0|1,0,0]=3 5688 B10R1.176 COc1ccc(c(c1)Br)Cl 34a_100011933957_200000210301 [1,1,0,0,0,0|1,0,0]=3 5689 B10R1.176 COc1ccc(c(c1)Br)Cl 7a_100011933957_200000210301 [1,1,0,0,0,0|1,0,0]=3 5690 B10R1.176 COc1ccc(c(c1)Br)F 34a_100000693481_200000210301 [1,1,0,0,0,0|1,0,0]=3 5691 B10R1.176 COc1ccc(c(c1)Br)F 7a_100000693481_200000210301 [1,1,0,0,0,0|1,0,0]=3 5692 B10R1.176 COc1ccc(c(c1)Br)I 34a_100000701344_200000210301 [1,1,0,0,0,0|1,0,0]=3 5693 B10R1.176 COc1ccc(c(c1)Br)I 7a_100000701344_200000210301 [1,1,0,0,0,0|1,0,0]=3 5694 B10R1.176 COc1ccc(c(c1)Br)N 34a_100012001276_200000210301 [1,1,0,0,0,0|1,0,0]=3 5695 B10R1.176 COc1ccc(c(c1)Br)N 7a_100012001276_200000210301 [1,1,0,0,0,0|1,0,0]=3 5696 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [1,1,0,0,0,0|0,0,0]=2 5697 B10R1.176 COc1ccc(c(c1)C)Br 34a_100000690111_200000210301 [1,1,0,0,0,0|1,0,0]=3 5698 B10R1.176 COc1ccc(c(c1)C)Br 7a_100000690111_200000210301 [1,1,0,0,0,0|1,0,0]=3 5699 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [1,1,0,0,0,0|1,0,0]=3 5700 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [1,1,0,0,0,0|1,0,0]=3 5701 B10R1.176 COc1ccc(c(c1)C)Cl 34a_100000211092_200000210301 [1,1,0,0,0,0|1,0,0]=3 5702 B10R1.176 COc1ccc(c(c1)C)Cl 7a_100000211092_200000210301 [1,1,0,0,0,0|1,0,0]=3 5703 B10R1.176 COc1ccc(c(c1)C)F 34a_100000751312_200000210301 [1,1,0,0,0,0|1,0,0]=3 5704 B10R1.176 COc1ccc(c(c1)C)F 7a_100000751312_200000210301 [1,1,0,0,0,0|1,0,0]=3 5705 B10R1.176 COc1ccc(c(c1)C)I 34a_100000729255_200000210301 [1,1,0,0,0,0|1,0,0]=3 5706 B10R1.176 COc1ccc(c(c1)C)I 7a_100000729255_200000210301 [1,1,0,0,0,0|1,0,0]=3 5707 B10R1.176 COc1ccc(c(c1)C)N 34a_100000756630_200000210301 [1,1,0,0,0,0|1,0,0]=3 5708 B10R1.176 COc1ccc(c(c1)C)N 7a_100000756630_200000210301 [1,1,0,0,0,0|1,0,0]=3 5709 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [1,1,0,0,0,0|0,0,0]=2 5710 B10R1.176 COc1ccc(c(c1)Cl)Br 34a_100011215161_200000210301 [1,1,0,0,0,0|1,0,0]=3 5711 B10R1.176 COc1ccc(c(c1)Cl)Br 7a_100011215161_200000210301 [1,1,0,0,0,0|1,0,0]=3 5712 B10R1.176 COc1ccc(c(c1)Cl)C 34a_100011265682_200000210301 [1,1,0,0,0,0|1,0,0]=3 5713 B10R1.176 COc1ccc(c(c1)Cl)C 7a_100011265682_200000210301 [1,1,0,0,0,0|1,0,0]=3 5714 B10R1.176 COc1ccc(c(c1)Cl)Cl 34a_100000211054_200000210301 [1,1,0,0,0,0|1,0,0]=3 5715 B10R1.176 COc1ccc(c(c1)Cl)Cl 7a_100000211054_200000210301 [1,1,0,0,0,0|1,0,0]=3 5716 B10R1.176 COc1ccc(c(c1)Cl)F 34a_100000211030_200000210301 [1,1,0,0,0,0|1,0,0]=3 5717 B10R1.176 COc1ccc(c(c1)Cl)F 7a_100000211030_200000210301 [1,1,0,0,0,0|1,0,0]=3 5718 B10R1.176 COc1ccc(c(c1)Cl)I 34a_100000047559_200000210301 [1,1,0,0,0,0|1,0,0]=3 5719 B10R1.176 COc1ccc(c(c1)Cl)I 7a_100000047559_200000210301 [1,1,0,0,0,0|1,0,0]=3 5720 B10R1.176 COc1ccc(c(c1)Cl)N 34a_100011215599_200000210301 [1,1,0,0,0,0|1,0,0]=3 5721 B10R1.176 COc1ccc(c(c1)Cl)N 7a_100011215599_200000210301 [1,1,0,0,0,0|1,0,0]=3 5722 B10R1.176 COc1ccc(c(c1)F)Br 34a_100000755031_200000210301 [1,1,0,0,0,0|1,0,0]=3 5723 B10R1.176 COc1ccc(c(c1)F)Br 7a_100000755031_200000210301 [1,1,0,0,0,0|1,0,0]=3 5724 B10R1.176 COc1ccc(c(c1)F)C 34a_100000722560_200000210301 [1,1,0,0,0,0|1,0,0]=3 5725 B10R1.176 COc1ccc(c(c1)F)C 7a_100000722560_200000210301 [1,1,0,0,0,0|1,0,0]=3 5726 B10R1.176 COc1ccc(c(c1)F)Cl 34a_100000691581_200000210301 [1,1,0,0,0,0|1,0,0]=3 5727 B10R1.176 COc1ccc(c(c1)F)Cl 7a_100000691581_200000210301 [1,1,0,0,0,0|1,0,0]=3 5728 B10R1.176 COc1ccc(c(c1)F)F 34a_100000181275_200000210301 [1,1,0,0,0,0|1,0,0]=3 5729 B10R1.176 COc1ccc(c(c1)F)F 7a_100000181275_200000210301 [1,1,0,0,0,0|1,0,0]=3 5730 B10R1.176 COc1ccc(c(c1)F)I 34a_100009990212_200000210301 [1,1,0,0,0,0|1,0,0]=3 5731 B10R1.176 COc1ccc(c(c1)F)I 7a_100009990212_200000210301 [1,1,0,0,0,0|1,0,0]=3 5732 B10R1.176 COc1ccc(c(c1)F)N 34a_100000759473_200000210301 [1,1,0,0,0,0|1,0,0]=3 5733 B10R1.176 COc1ccc(c(c1)F)N 7a_100000759473_200000210301 [1,1,0,0,0,0|1,0,0]=3 5734 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [1,1,0,0,0,0|0,0,0]=2 5735 B10R1.176 COc1ccc(c(c1)I)Br 34a_100012339312_200000210301 [1,1,0,0,0,0|1,0,0]=3 5736 B10R1.176 COc1ccc(c(c1)I)Br 7a_100012339312_200000210301 [1,1,0,0,0,0|1,0,0]=3 5737 B10R1.176 COc1ccc(c(c1)I)Cl 34a_100000049588_200000210301 [1,1,0,0,0,0|1,0,0]=3 5738 B10R1.176 COc1ccc(c(c1)I)Cl 7a_100000049588_200000210301 [1,1,0,0,0,0|1,0,0]=3 5739 B10R1.176 COc1ccc(c(c1)I)N 34a_100010084370_200000210301 [1,1,0,0,0,0|1,0,0]=3 5740 B10R1.176 COc1ccc(c(c1)I)N 7a_100010084370_200000210301 [1,1,0,0,0,0|1,0,0]=3 5741 B10R1.176 COc1ccc(c(c1)N)Br 34a_100011999798_200000210301 [1,1,0,0,0,0|1,0,0]=3 5742 B10R1.176 COc1ccc(c(c1)N)Br 7a_100011999798_200000210301 [1,1,0,0,0,0|1,0,0]=3 5743 B10R1.176 COc1ccc(c(c1)N)C 34a_100011216113_200000210301 [1,1,0,0,0,0|1,0,0]=3 5744 B10R1.176 COc1ccc(c(c1)N)C 7a_100011216113_200000210301 [1,1,0,0,0,0|1,0,0]=3 5745 B10R1.176 COc1ccc(c(c1)N)Cl 34a_100011934297_200000210301 [1,1,0,0,0,0|1,0,0]=3 5746 B10R1.176 COc1ccc(c(c1)N)F 34a_100012017239_200000210301 [1,1,0,0,0,0|1,0,0]=3 5747 B10R1.176 COc1ccc(c(c1)N)F 7a_100012017239_200000210301 [1,1,0,0,0,0|1,0,0]=3 5748 B10R1.176 COc1ccc(c(c1)N)N 34a_100025771000_200000210301 [1,1,0,0,0,0|1,0,0]=3 5749 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [1,1,0,0,0,0|0,0,0]=2 5750 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [1,1,0,0,0,0|1,0,0]=3 5751 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [1,1,0,0,0,0|1,0,0]=3 5752 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [1,1,0,0,0,0|1,0,0]=3 5753 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [1,1,0,0,0,0|1,0,0]=3 5754 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [1,1,0,0,0,0|1,0,0]=3 5755 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [1,1,0,0,0,0|0,0,0]=2 5756 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [1,1,0,0,0,0|0,0,0]=2 5757 B10R1.176 COc1ccc(c(n1)C)Br 34a_100000691680_200000210301 [1,1,0,0,0,0|2,0,0]=4 5758 B10R1.176 COc1ccc(c(n1)C)Cl 34a_200009863735_200000210301 [1,1,0,0,0,0|2,0,0]=4 5759 B10R1.176 COc1ccc(c(n1)C)O 271570a_203496583355_100000766551 [1,1,0,0,0,0|1,0,0]=3 5760 B10R1.176 COc1ccc(c(n1)F)Br 34a_100009879308_200000210301 [1,1,0,0,0,0|2,0,0]=4 5761 B10R1.176 COc1ccc(c(n1)F)O 271570a_203496583355_100010067559 [1,1,0,0,0,0|1,0,0]=3 5762 B10R1.176 COc1ccc(c(n1)N)O 271570a_203496583355_100010187629 [1,1,0,0,0,0|1,0,0]=3 5763 B10R1.176 COc1ccc(c(n1)O)N 271570a_203496583355_100000069805 [1,1,0,0,0,0|2,0,0]=4 5764 B10R1.176 COc1cnc(c(c1)Br)C 34a_100009819603_200000210301 [1,1,0,0,0,0|2,0,0]=4 5765 B10R1.176 COc1cnc(c(c1)Br)C 7a_100009819603_200000210301 [1,1,0,0,0,0|2,0,0]=4 5766 B10R1.176 COc1cnc(c(c1)Br)Cl 34a_100012356455_200000210301 [1,1,0,0,0,0|2,0,0]=4 5767 B10R1.176 COc1cnc(c(c1)Br)Cl 7a_100012356455_200000210301 [1,1,0,0,0,0|2,0,0]=4 5768 B10R1.176 COc1cnc(c(c1)Br)F 34a_100009817267_200000210301 [1,1,0,0,0,0|2,0,0]=4 5769 B10R1.176 COc1cnc(c(c1)Br)F 7a_100009817267_200000210301 [1,1,0,0,0,0|2,0,0]=4 5770 B10R1.176 COc1cnc(c(c1)C)Br 34a_100012000486_200000210301 [1,1,0,0,0,0|2,0,0]=4 5771 B10R1.176 COc1cnc(c(c1)C)Br 7a_100012000486_200000210301 [1,1,0,0,0,0|2,0,0]=4 5772 B10R1.176 COc1cnc(c(c1)C)C 34a_100009854398_200000210301 [1,1,0,0,0,0|2,0,0]=4 5773 B10R1.176 COc1cnc(c(c1)C)C 7a_100009854398_200000210301 [1,1,0,0,0,0|2,0,0]=4 5774 B10R1.176 COc1cnc(c(c1)C)Cl 34a_100012002680_200000210301 [1,1,0,0,0,0|2,0,0]=4 5775 B10R1.176 COc1cnc(c(c1)C)Cl 7a_100012002680_200000210301 [1,1,0,0,0,0|2,0,0]=4 5776 B10R1.176 COc1cnc(c(c1)C)F 34a_100000094615_200000210301 [1,1,0,0,0,0|2,0,0]=4 5777 B10R1.176 COc1cnc(c(c1)C)F 7a_100000094615_200000210301 [1,1,0,0,0,0|2,0,0]=4 5778 B10R1.176 COc1cnc(c(c1)C)O 271570a_203496583355_200009851512 [1,1,0,0,0,0|1,0,0]=3 5779 B10R1.176 COc1cnc(c(c1)Cl)Br 34a_100010209684_200000210301 [1,1,0,0,0,0|2,0,0]=4 5780 B10R1.176 COc1cnc(c(c1)Cl)Br 7a_100010209684_200000210301 [1,1,0,0,0,0|2,0,0]=4 5781 B10R1.176 COc1cnc(c(c1)Cl)Cl 34a_100000094354_200000210301 [1,1,0,0,0,0|2,0,0]=4 5782 B10R1.176 COc1cnc(c(c1)Cl)Cl 7a_100000094354_200000210301 [1,1,0,0,0,0|2,0,0]=4 5783 B10R1.176 COc1cnc(c(c1)Cl)F 34a_100000087088_200000210301 [1,1,0,0,0,0|2,0,0]=4 5784 B10R1.176 COc1cnc(c(c1)Cl)F 7a_100000087088_200000210301 [1,1,0,0,0,0|2,0,0]=4 5785 B10R1.176 COc1cnc(c(c1)F)Cl 34a_100000063512_200000210301 [1,1,0,0,0,0|2,0,0]=4 5786 B10R1.176 COc1cnc(c(c1)F)Cl 7a_100000063512_200000210301 [1,1,0,0,0,0|2,0,0]=4 5787 B10R1.176 COc1cnc(c(c1)N)O 271570a_203496583355_100010074831 [1,1,0,0,0,0|1,0,0]=3 5788 B10R1.176 COc1cnc(c(c1)O)F 271570a_203496583355_100010068374 [1,1,0,0,0,0|2,0,0]=4 5789 B10R1.176 COc1cnc(c(n1)C)O 271570a_203496583355_200010730098 [1,1,0,0,0,0|2,0,0]=4 5790 B10R1.176 COc1cnc(c(n1)N)O 271570a_203496583355_100009955223 [1,1,0,0,0,0|2,0,0]=4 5791 B10R1.176 COc1ncc(c(n1)C)O 271570a_203496583355_100010152497 [1,1,0,0,0,0|2,0,0]=4 5792 B10R1.176 COc1ncc(c(n1)N)O 271570a_203496583355_100010218985 [1,1,0,0,0,0|2,0,0]=4 5793 B10R1.176 CSc1cc(c(cn1)O)C 62a_200000210301_100000692680 [1,1,0,0,0,0|1,1,0]=4 5794 B10R1.176 CSc1cc(c(cn1)O)N 62a_100009819941_200000210301 [1,1,0,0,0,0|1,1,0]=4 5795 B10R1.176 CSc1cc(c(cn1)O)N 62a_200000210301_100009819941 [1,1,0,0,0,0|1,1,0]=4 5796 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_100012356285_200000210301 [1,1,0,0,0,0|1,1,0]=4 5797 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_200000210301_100012356285 [1,1,0,0,0,0|1,1,0]=4 5798 B10R1.176 CSc1ccc(c(c1)Br)C 62a_100011847877_200000210301 [1,1,0,0,0,0|1,1,0]=4 5799 B10R1.176 CSc1ccc(c(c1)Br)C 62a_200000210301_100011847877 [1,1,0,0,0,0|1,1,0]=4 5800 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_100012353702_200000210301 [1,1,0,0,0,0|1,1,0]=4 5801 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_200000210301_100012353702 [1,1,0,0,0,0|1,1,0]=4 5802 B10R1.176 CSc1ccc(c(c1)Br)F 62a_100012047266_200000210301 [1,1,0,0,0,0|1,1,0]=4 5803 B10R1.176 CSc1ccc(c(c1)Br)F 62a_200000210301_100012047266 [1,1,0,0,0,0|1,1,0]=4 5804 B10R1.176 CSc1ccc(c(c1)Br)N 62a_100000750455_200000210301 [1,1,0,0,0,0|1,1,0]=4 5805 B10R1.176 CSc1ccc(c(c1)Br)N 62a_200000210301_100000750455 [1,1,0,0,0,0|1,1,0]=4 5806 B10R1.176 CSc1ccc(c(c1)Br)O 62a_100012361655_200000210301 [1,1,0,0,0,0|0,1,0]=3 5807 B10R1.176 CSc1ccc(c(c1)Br)O 62a_200000210301_100012361655 [1,1,0,0,0,0|0,1,0]=3 5808 B10R1.176 CSc1ccc(c(c1)C)Br 62a_100009813585_200000210301 [1,1,0,0,0,0|1,1,0]=4 5809 B10R1.176 CSc1ccc(c(c1)C)Br 62a_200000210301_100009813585 [1,1,0,0,0,0|1,1,0]=4 5810 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [1,1,0,0,0,0|1,1,0]=4 5811 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [1,1,0,0,0,0|1,1,0]=4 5812 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_100000049509_200000210301 [1,1,0,0,0,0|1,1,0]=4 5813 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_200000210301_100000049509 [1,1,0,0,0,0|1,1,0]=4 5814 B10R1.176 CSc1ccc(c(c1)C)F 62a_100011218330_200000210301 [1,1,0,0,0,0|1,1,0]=4 5815 B10R1.176 CSc1ccc(c(c1)C)F 62a_200000210301_100011218330 [1,1,0,0,0,0|1,1,0]=4 5816 B10R1.176 CSc1ccc(c(c1)C)N 62a_100000211769_200000210301 [1,1,0,0,0,0|1,1,0]=4 5817 B10R1.176 CSc1ccc(c(c1)C)N 62a_200000210301_100000211769 [1,1,0,0,0,0|1,1,0]=4 5818 B10R1.176 CSc1ccc(c(c1)C)O 62a_200000210301_100000186361 [1,1,0,0,0,0|0,1,0]=3 5819 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_100012047281_200000210301 [1,1,0,0,0,0|1,1,0]=4 5820 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_200000210301_100012047281 [1,1,0,0,0,0|1,1,0]=4 5821 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_100011216363_200000210301 [1,1,0,0,0,0|1,1,0]=4 5822 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_200000210301_100011216363 [1,1,0,0,0,0|1,1,0]=4 5823 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_100011214914_200000210301 [1,1,0,0,0,0|1,1,0]=4 5824 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_200000210301_100011214914 [1,1,0,0,0,0|1,1,0]=4 5825 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_100011215976_200000210301 [1,1,0,0,0,0|1,1,0]=4 5826 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_200000210301_100011215976 [1,1,0,0,0,0|1,1,0]=4 5827 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_100011218065_200000210301 [1,1,0,0,0,0|1,1,0]=4 5828 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_200000210301_100011218065 [1,1,0,0,0,0|1,1,0]=4 5829 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_100012360047_200000210301 [1,1,0,0,0,0|0,1,0]=3 5830 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_200000210301_100012360047 [1,1,0,0,0,0|0,1,0]=3 5831 B10R1.176 CSc1ccc(c(c1)F)Br 62a_100000685389_200000210301 [1,1,0,0,0,0|1,1,0]=4 5832 B10R1.176 CSc1ccc(c(c1)F)Br 62a_200000210301_100000685389 [1,1,0,0,0,0|1,1,0]=4 5833 B10R1.176 CSc1ccc(c(c1)F)C 62a_100000720648_200000210301 [1,1,0,0,0,0|1,1,0]=4 5834 B10R1.176 CSc1ccc(c(c1)F)C 62a_200000210301_100000720648 [1,1,0,0,0,0|1,1,0]=4 5835 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_100011216805_200000210301 [1,1,0,0,0,0|1,1,0]=4 5836 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_200000210301_100011216805 [1,1,0,0,0,0|1,1,0]=4 5837 B10R1.176 CSc1ccc(c(c1)F)F 62a_100000703953_200000210301 [1,1,0,0,0,0|1,1,0]=4 5838 B10R1.176 CSc1ccc(c(c1)F)F 62a_200000210301_100000703953 [1,1,0,0,0,0|1,1,0]=4 5839 B10R1.176 CSc1ccc(c(c1)F)N 62a_100011215594_200000210301 [1,1,0,0,0,0|1,1,0]=4 5840 B10R1.176 CSc1ccc(c(c1)F)N 62a_200000210301_100011215594 [1,1,0,0,0,0|1,1,0]=4 5841 B10R1.176 CSc1ccc(c(c1)F)O 271570a_203496583355_100009816902 [1,1,0,0,0,0|0,1,0]=3 5842 B10R1.176 CSc1ccc(c(c1)F)O 62a_100000185481_200000210301 [1,1,0,0,0,0|0,1,0]=3 5843 B10R1.176 CSc1ccc(c(c1)F)O 62a_200000210301_100000185481 [1,1,0,0,0,0|0,1,0]=3 5844 B10R1.176 CSc1ccc(c(c1)N)Br 62a_100000750456_200000210301 [1,1,0,0,0,0|1,1,0]=4 5845 B10R1.176 CSc1ccc(c(c1)N)Br 62a_200000210301_100000750456 [1,1,0,0,0,0|1,1,0]=4 5846 B10R1.176 CSc1ccc(c(c1)N)C 62a_100000761890_200000210301 [1,1,0,0,0,0|1,1,0]=4 5847 B10R1.176 CSc1ccc(c(c1)N)C 62a_200000210301_100000761890 [1,1,0,0,0,0|1,1,0]=4 5848 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000210301_200000761891 [1,1,0,0,0,0|1,1,0]=4 5849 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000761891_200000210301 [1,1,0,0,0,0|1,1,0]=4 5850 B10R1.176 CSc1ccc(c(c1)N)F 62a_100000740924_200000210301 [1,1,0,0,0,0|1,1,0]=4 5851 B10R1.176 CSc1ccc(c(c1)N)F 62a_200000210301_100000740924 [1,1,0,0,0,0|1,1,0]=4 5852 B10R1.176 CSc1ccc(c(c1)N)N 62a_100000741789_200000210301 [1,1,0,0,0,0|1,1,0]=4 5853 B10R1.176 CSc1ccc(c(c1)N)N 62a_200000210301_100011534411 [1,1,0,0,0,0|1,1,0]=4 5854 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [1,1,0,0,0,0|0,1,0]=3 5855 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [1,1,0,0,0,0|0,1,0]=3 5856 B10R1.176 CSc1ccc(c(c1)O)Br 62a_100012356990_200000210301 [1,1,0,0,0,0|1,1,0]=4 5857 B10R1.176 CSc1ccc(c(c1)O)Br 62a_200000210301_100012356990 [1,1,0,0,0,0|1,1,0]=4 5858 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [1,1,0,0,0,0|1,1,0]=4 5859 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [1,1,0,0,0,0|1,1,0]=4 5860 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [1,1,0,0,0,0|1,1,0]=4 5861 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [1,1,0,0,0,0|1,1,0]=4 5862 B10R1.176 CSc1ccc(c(c1)O)F 271570a_203496583355_200010708804 [1,1,0,0,0,0|1,1,0]=4 5863 B10R1.176 CSc1ccc(c(c1)O)F 62a_100000686035_200000210301 [1,1,0,0,0,0|1,1,0]=4 5864 B10R1.176 CSc1ccc(c(c1)O)F 62a_200000210301_100000686035 [1,1,0,0,0,0|1,1,0]=4 5865 B10R1.176 CSc1ccc(c(c1)O)N 62a_100000739049_200000210301 [1,1,0,0,0,0|1,1,0]=4 5866 B10R1.176 CSc1ccc(c(c1)O)N 62a_200000210301_100000739049 [1,1,0,0,0,0|1,1,0]=4 5867 B10R1.176 CSc1ccc(c(c1)O)O 62a_200000210301_100009813601 [1,1,0,0,0,0|0,1,0]=3 5868 B10R1.176 CSc1ccc(c(n1)Br)O 62a_100000725334_200000210301 [1,1,0,0,0,0|1,1,0]=4 5869 B10R1.176 CSc1ccc(c(n1)Br)O 62a_200000210301_100000725334 [1,1,0,0,0,0|1,1,0]=4 5870 B10R1.176 CSc1ccc(c(n1)C)O 62a_100010233687_200000210301 [1,1,0,0,0,0|1,1,0]=4 5871 B10R1.176 CSc1ccc(c(n1)C)O 62a_200000210301_100010233687 [1,1,0,0,0,0|1,1,0]=4 5872 B10R1.176 CSc1ccc(c(n1)Cl)O 62a_200000210301_100000721234 [1,1,0,0,0,0|1,1,0]=4 5873 B10R1.176 CSc1ccc(c(n1)F)O 62a_100009819667_200000210301 [1,1,0,0,0,0|1,1,0]=4 5874 B10R1.176 CSc1ccc(c(n1)F)O 62a_200000210301_100009819667 [1,1,0,0,0,0|1,1,0]=4 5875 B10R1.176 CSc1ccc(c(n1)N)O 62a_100000685527_200000210301 [1,1,0,0,0,0|1,1,0]=4 5876 B10R1.176 CSc1ccc(c(n1)N)O 62a_200000210301_100000685527 [1,1,0,0,0,0|1,1,0]=4 5877 B10R1.176 CSc1cnc(c(c1)C)O 271570a_203496583355_203440288091 [1,1,0,0,0,0|1,1,0]=4 5878 B10R1.176 CSc1cnc(c(c1)C)O 62a_100000685391_200000210301 [1,1,0,0,0,0|1,1,0]=4 5879 B10R1.176 CSc1cnc(c(c1)C)O 62a_200000210301_100000685391 [1,1,0,0,0,0|1,1,0]=4 5880 B10R1.176 CSc1cnc(c(c1)Cl)O 62a_100010238531_200000210301 [1,1,0,0,0,0|1,1,0]=4 5881 B10R1.176 CSc1cnc(c(c1)Cl)O 62a_200000210301_100010238531 [1,1,0,0,0,0|1,1,0]=4 5882 B10R1.176 CSc1cnc(c(c1)F)O 271570a_203496583355_100010884644 [1,1,0,0,0,0|1,1,0]=4 5883 B10R1.176 CSc1cnc(c(c1)N)O 62a_100000743729_200000210301 [1,1,0,0,0,0|1,1,0]=4 5884 B10R1.176 CSc1cnc(c(c1)N)O 62a_200000210301_100000743729 [1,1,0,0,0,0|1,1,0]=4 5885 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 2230a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 5886 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 34a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 5887 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 7a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 5888 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 34a_100000690111_200025704644 [1,1,0,0,0,0|1,0,0]=3 5889 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 7a_100000690111_200025704644 [1,1,0,0,0,0|1,0,0]=3 5890 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_100009813585_200025704644 [1,1,0,0,0,0|1,1,0]=4 5891 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_200025704644_100009813585 [1,1,0,0,0,0|1,1,0]=4 5892 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 2230a_100000187808_200025704644 [1,1,0,0,0,0|2,0,0]=4 5893 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 34a_100000187808_200025704644 [1,1,0,0,0,0|2,0,0]=4 5894 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 7a_100000187808_200025704644 [1,1,0,0,0,0|2,0,0]=4 5895 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 34a_100000211092_200025704644 [1,1,0,0,0,0|1,0,0]=3 5896 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 7a_100000211092_200025704644 [1,1,0,0,0,0|1,0,0]=3 5897 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_100000049509_200025704644 [1,1,0,0,0,0|1,1,0]=4 5898 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100000049509 [1,1,0,0,0,0|1,1,0]=4 5899 B10R1.176 Cc1cc(ccc1F)N[13CH3] 2230a_100000750164_200025704644 [1,1,0,0,0,0|2,0,0]=4 5900 B10R1.176 Cc1cc(ccc1F)N[13CH3] 34a_100000750164_200025704644 [1,1,0,0,0,0|2,0,0]=4 5901 B10R1.176 Cc1cc(ccc1F)N[13CH3] 7a_100000750164_200025704644 [1,1,0,0,0,0|2,0,0]=4 5902 B10R1.176 Cc1cc(ccc1F)O[13CH3] 34a_100000751312_200025704644 [1,1,0,0,0,0|1,0,0]=3 5903 B10R1.176 Cc1cc(ccc1F)O[13CH3] 7a_100000751312_200025704644 [1,1,0,0,0,0|1,0,0]=3 5904 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_100011218330_200025704644 [1,1,0,0,0,0|1,1,0]=4 5905 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100011218330 [1,1,0,0,0,0|1,1,0]=4 5906 B10R1.176 Cc1cc(ccc1I)N[13CH3] 34a_100000198070_200025704644 [1,1,0,0,0,0|2,0,0]=4 5907 B10R1.176 Cc1cc(ccc1I)N[13CH3] 7a_100000198070_200025704644 [1,1,0,0,0,0|2,0,0]=4 5908 B10R1.176 Cc1cc(ccc1I)O[13CH3] 34a_100000729255_200025704644 [1,1,0,0,0,0|1,0,0]=3 5909 B10R1.176 Cc1cc(ccc1I)O[13CH3] 7a_100000729255_200025704644 [1,1,0,0,0,0|1,0,0]=3 5910 B10R1.176 Cc1cc(ccc1N)O[13CH3] 34a_100000756630_200025704644 [1,1,0,0,0,0|1,0,0]=3 5911 B10R1.176 Cc1cc(ccc1N)O[13CH3] 7a_100000756630_200025704644 [1,1,0,0,0,0|1,0,0]=3 5912 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_100000211769_200025704644 [1,1,0,0,0,0|1,1,0]=4 5913 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_200025704644_100000211769 [1,1,0,0,0,0|1,1,0]=4 5914 B10R1.176 Cc1cc(ccc1O)C#N 271570a_203496583355_100000212329 [1,1,0,0,0,0|1,0,1]=4 5915 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [1,1,0,0,0,0|1,0,1]=4 5916 B10R1.176 Cc1cc(ccc1O)CN 271570a_203496583355_100015205234 [1,1,0,0,0,0|1,0,0]=3 5917 B10R1.176 Cc1cc(ccc1O)CO 271570a_203496583355_100000718852 [1,1,0,0,0,0|1,0,0]=3 5918 B10R1.176 Cc1cc(ccc1O)NN 271570a_203496583355_100000745493 [1,1,0,0,0,0|2,0,0]=4 5919 B10R1.176 Cc1cc(ccc1O)N[13CH3] 34a_100011218179_200025704644 [1,1,0,0,0,0|1,0,0]=3 5920 B10R1.176 Cc1cc(ccc1O)N[13CH3] 7a_100011218179_200025704644 [1,1,0,0,0,0|1,0,0]=3 5921 B10R1.176 Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100000186361 [1,1,0,0,0,0|0,1,0]=3 5922 B10R1.176 Cc1cc(cnc1Br)O[13CH3] 34a_100012000486_200025704644 [1,1,0,0,0,0|2,0,0]=4 5923 B10R1.176 Cc1cc(cnc1Br)O[13CH3] 7a_100012000486_200025704644 [1,1,0,0,0,0|2,0,0]=4 5924 B10R1.176 Cc1cc(cnc1C)O[13CH3] 34a_100009854398_200025704644 [1,1,0,0,0,0|2,0,0]=4 5925 B10R1.176 Cc1cc(cnc1C)O[13CH3] 7a_100009854398_200025704644 [1,1,0,0,0,0|2,0,0]=4 5926 B10R1.176 Cc1cc(cnc1Cl)O[13CH3] 34a_100012002680_200025704644 [1,1,0,0,0,0|2,0,0]=4 5927 B10R1.176 Cc1cc(cnc1Cl)O[13CH3] 7a_100012002680_200025704644 [1,1,0,0,0,0|2,0,0]=4 5928 B10R1.176 Cc1cc(cnc1F)O[13CH3] 34a_100000094615_200025704644 [1,1,0,0,0,0|2,0,0]=4 5929 B10R1.176 Cc1cc(cnc1F)O[13CH3] 7a_100000094615_200025704644 [1,1,0,0,0,0|2,0,0]=4 5930 B10R1.176 Cc1cc(cnc1O)CO 271570a_203496583355_200000092119 [1,1,0,0,0,0|2,0,0]=4 5931 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_100000685391_200025704644 [1,1,0,0,0,0|1,1,0]=4 5932 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_200025704644_100000685391 [1,1,0,0,0,0|1,1,0]=4 5933 B10R1.176 Cc1cc(ncc1Br)O[13CH3] 34a_100000766222_200025704644 [1,1,0,0,0,0|2,0,0]=4 5934 B10R1.176 Cc1cc(ncc1Cl)O[13CH3] 34a_200000085746_200025704644 [1,1,0,0,0,0|2,0,0]=4 5935 B10R1.176 Cc1cc(ncc1O)CO 271570a_203496583355_200010713146 [1,1,0,0,0,0|2,0,0]=4 5936 B10R1.176 Cc1cc(ncc1O)S[13CH3] 62a_200025704644_100000692680 [1,1,0,0,0,0|1,1,0]=4 5937 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 2230a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 5938 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 34a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 5939 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 7a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 5940 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 34a_100011380479_200025704644 [1,1,0,0,0,0|1,0,0]=3 5941 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 7a_100011380479_200025704644 [1,1,0,0,0,0|1,0,0]=3 5942 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_100011847877_200025704644 [1,1,0,0,0,0|1,1,0]=4 5943 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011847877 [1,1,0,0,0,0|1,1,0]=4 5944 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [1,1,0,0,0,0|2,0,0]=4 5945 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [1,1,0,0,0,0|2,0,0]=4 5946 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [1,1,0,0,0,0|2,0,0]=4 5947 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [1,1,0,0,0,0|1,0,0]=3 5948 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [1,1,0,0,0,0|1,0,0]=3 5949 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [1,1,0,0,0,0|1,1,0]=4 5950 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [1,1,0,0,0,0|1,1,0]=4 5951 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 2230a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 5952 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 34a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 5953 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 7a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 5954 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 34a_100011265682_200025704644 [1,1,0,0,0,0|1,0,0]=3 5955 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 7a_100011265682_200025704644 [1,1,0,0,0,0|1,0,0]=3 5956 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_100011216363_200025704644 [1,1,0,0,0,0|1,1,0]=4 5957 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100011216363 [1,1,0,0,0,0|1,1,0]=4 5958 B10R1.176 Cc1ccc(cc1F)N[13CH3] 2230a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 5959 B10R1.176 Cc1ccc(cc1F)N[13CH3] 34a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 5960 B10R1.176 Cc1ccc(cc1F)N[13CH3] 7a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 5961 B10R1.176 Cc1ccc(cc1F)O[13CH3] 34a_100000722560_200025704644 [1,1,0,0,0,0|1,0,0]=3 5962 B10R1.176 Cc1ccc(cc1F)O[13CH3] 7a_100000722560_200025704644 [1,1,0,0,0,0|1,0,0]=3 5963 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_100000720648_200025704644 [1,1,0,0,0,0|1,1,0]=4 5964 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100000720648 [1,1,0,0,0,0|1,1,0]=4 5965 B10R1.176 Cc1ccc(cc1I)N[13CH3] 34a_100000184131_200025704644 [1,1,0,0,0,0|2,0,0]=4 5966 B10R1.176 Cc1ccc(cc1I)N[13CH3] 7a_100000184131_200025704644 [1,1,0,0,0,0|2,0,0]=4 5967 B10R1.176 Cc1ccc(cc1N)O[13CH3] 34a_100011216113_200025704644 [1,1,0,0,0,0|1,0,0]=3 5968 B10R1.176 Cc1ccc(cc1N)O[13CH3] 7a_100011216113_200025704644 [1,1,0,0,0,0|1,0,0]=3 5969 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_100000761890_200025704644 [1,1,0,0,0,0|1,1,0]=4 5970 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_200025704644_100000761890 [1,1,0,0,0,0|1,1,0]=4 5971 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [1,1,0,0,0,0|2,0,0]=4 5972 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 5973 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 5974 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [1,1,0,0,0,0|1,1,0]=4 5975 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [1,1,0,0,0,0|1,1,0]=4 5976 B10R1.176 Cc1cnc(cc1Br)O[13CH3] 34a_100009831917_200025704644 [1,1,0,0,0,0|2,0,0]=4 5977 B10R1.176 Cc1nc(ccc1Br)O[13CH3] 34a_100000691680_200025704644 [1,1,0,0,0,0|2,0,0]=4 5978 B10R1.176 Cc1nc(ccc1Cl)O[13CH3] 34a_200009863735_200025704644 [1,1,0,0,0,0|2,0,0]=4 5979 B10R1.176 Cc1nc(ccc1O)CO 271570a_203496583355_100010114280 [1,1,0,0,0,0|2,0,0]=4 5980 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_100010233687_200025704644 [1,1,0,0,0,0|1,1,0]=4 5981 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_200025704644_100010233687 [1,1,0,0,0,0|1,1,0]=4 5982 B10R1.176 Cc1ncc(cc1Br)O[13CH3] 34a_100009819603_200025704644 [1,1,0,0,0,0|2,0,0]=4 5983 B10R1.176 Cc1ncc(cc1Br)O[13CH3] 7a_100009819603_200025704644 [1,1,0,0,0,0|2,0,0]=4 5984 B10R1.176 N#Cc1ccc(c(c1)Br)O 271570a_203496583355_100012356348 [1,1,0,0,0,0|1,0,1]=4 5985 B10R1.176 N#Cc1ccc(c(c1)Cl)O 271570a_203496583355_100012349663 [1,1,0,0,0,0|1,0,1]=4 5986 B10R1.176 N#Cc1ccc(c(c1)F)O 271570a_203496583355_100011794375 [1,1,0,0,0,0|1,0,1]=4 5987 B10R1.176 N#Cc1ccc(c(c1)N)O 271570a_203496583355_100012001879 [1,1,0,0,0,0|1,0,1]=4 5988 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000724445 [1,1,0,0,0,0|1,0,1]=4 5989 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000725478 [1,1,0,0,0,0|1,0,1]=4 5990 B10R1.176 NCc1ccc(c(c1)F)O 271570a_203496583355_100000755036 [1,1,0,0,0,0|1,0,0]=3 5991 B10R1.176 NCc1ccc(c(c1)O)F 271570a_203496583355_100015193890 [1,1,0,0,0,0|2,0,0]=4 5992 B10R1.176 NNc1ccc(c(c1)F)O 271570a_203496583355_100016992936 [1,1,0,0,0,0|2,0,0]=4 5993 B10R1.176 Nc1cc(ccc1O)CO 271570a_203496583355_100012347568 [1,1,0,0,0,0|1,0,0]=3 5994 B10R1.176 O=Cc1ccc(c(c1)F)O 271570a_203496583355_100000686674 [1,1,0,0,0,0|1,0,1]=4 5995 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [1,1,0,0,0,0|1,0,1]=4 5996 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [1,1,0,0,0,0|1,0,1]=4 5997 B10R1.176 OCc1ccc(c(c1)Cl)O 271570a_203496583355_100000718186 [1,1,0,0,0,0|1,0,0]=3 5998 B10R1.176 OCc1ccc(c(c1)F)O 271570a_203496583355_100011533735 [1,1,0,0,0,0|1,0,0]=3 5999 B10R1.176 OCc1ccc(c(c1)O)F 271570a_203496583355_100000246287 [1,1,0,0,0,0|2,0,0]=4 6000 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100000049605 [1,1,0,0,0,0|1,0,0]=3 6001 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100011191544 [1,1,0,0,0,0|1,0,0]=3 6002 B10R1.176 OCc1ccc(c(n1)O)O 271570a_203496583355_200000118097 [1,1,0,0,0,0|2,0,0]=4 6003 B10R1.176 OCc1cnc(c(c1)F)O 271570a_203496583355_100010065243 [1,1,0,0,0,0|2,0,0]=4 6004 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 2230a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 6005 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 34a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 6006 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 7a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 6007 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 2230a_100000686031_200025704644 [1,1,0,0,0,0|2,0,0]=4 6008 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 34a_100000686031_200025704644 [1,1,0,0,0,0|2,0,0]=4 6009 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 2230a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 6010 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 34a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 6011 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 7a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 6012 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)I 34a_100000750458_200025704644 [1,1,0,0,0,0|2,0,0]=4 6013 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)O 34a_100011534360_200025704644 [1,1,0,0,0,0|1,0,0]=3 6014 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 2230a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 6015 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 34a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 6016 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 7a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 6017 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_200025704644 [1,1,0,0,0,0|2,0,0]=4 6018 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 34a_100000184108_200025704644 [1,1,0,0,0,0|2,0,0]=4 6019 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 2230a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 6020 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 34a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 6021 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 7a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 6022 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)I 34a_100000761885_200025704644 [1,1,0,0,0,0|2,0,0]=4 6023 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)O 34a_100000744943_200025704644 [1,1,0,0,0,0|1,0,0]=3 6024 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 2230a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 6025 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 34a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 6026 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 7a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 6027 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 2230a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 6028 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 34a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 6029 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 7a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 6030 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 2230a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 6031 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 34a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 6032 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 7a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 6033 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 34a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 6034 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 7a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 6035 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 34a_100011220035_200025704644 [1,1,0,0,0,0|1,0,0]=3 6036 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 7a_100011220035_200025704644 [1,1,0,0,0,0|1,0,0]=3 6037 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Br 34a_100000750459_200025704644 [1,1,0,0,0,0|2,0,0]=4 6038 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Cl 34a_100012360549_200025704644 [1,1,0,0,0,0|2,0,0]=4 6039 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 34a_114828291077_200025704644 [1,1,0,0,0,0|2,0,0]=4 6040 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 7a_114828291077_200025704644 [1,1,0,0,0,0|2,0,0]=4 6041 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [1,1,0,0,0,0|2,0,0]=4 6042 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 34a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 6043 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 7a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 6044 B10R1.176 [13CH3]Nc1ccc(c(c1)O)O 34a_100102946323_200025704644 [1,1,0,0,0,0|1,0,0]=3 6045 B10R1.176 [13CH3]Oc1cc(c(cn1)Br)Cl 34a_100010369989_200025704644 [1,1,0,0,0,0|2,0,0]=4 6046 B10R1.176 [13CH3]Oc1cc(c(cn1)Cl)Cl 34a_200000099200_200025704644 [1,1,0,0,0,0|2,0,0]=4 6047 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 34a_100011933957_200025704644 [1,1,0,0,0,0|1,0,0]=3 6048 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 7a_100011933957_200025704644 [1,1,0,0,0,0|1,0,0]=3 6049 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 34a_100000693481_200025704644 [1,1,0,0,0,0|1,0,0]=3 6050 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 7a_100000693481_200025704644 [1,1,0,0,0,0|1,0,0]=3 6051 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 34a_100000701344_200025704644 [1,1,0,0,0,0|1,0,0]=3 6052 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 7a_100000701344_200025704644 [1,1,0,0,0,0|1,0,0]=3 6053 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 34a_100012001276_200025704644 [1,1,0,0,0,0|1,0,0]=3 6054 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 7a_100012001276_200025704644 [1,1,0,0,0,0|1,0,0]=3 6055 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 34a_100011215161_200025704644 [1,1,0,0,0,0|1,0,0]=3 6056 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 7a_100011215161_200025704644 [1,1,0,0,0,0|1,0,0]=3 6057 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 34a_100000211054_200025704644 [1,1,0,0,0,0|1,0,0]=3 6058 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 7a_100000211054_200025704644 [1,1,0,0,0,0|1,0,0]=3 6059 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 34a_100000211030_200025704644 [1,1,0,0,0,0|1,0,0]=3 6060 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 7a_100000211030_200025704644 [1,1,0,0,0,0|1,0,0]=3 6061 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 34a_100000047559_200025704644 [1,1,0,0,0,0|1,0,0]=3 6062 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 7a_100000047559_200025704644 [1,1,0,0,0,0|1,0,0]=3 6063 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 34a_100011215599_200025704644 [1,1,0,0,0,0|1,0,0]=3 6064 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 7a_100011215599_200025704644 [1,1,0,0,0,0|1,0,0]=3 6065 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 34a_100000755031_200025704644 [1,1,0,0,0,0|1,0,0]=3 6066 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 7a_100000755031_200025704644 [1,1,0,0,0,0|1,0,0]=3 6067 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 34a_100000691581_200025704644 [1,1,0,0,0,0|1,0,0]=3 6068 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 7a_100000691581_200025704644 [1,1,0,0,0,0|1,0,0]=3 6069 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 34a_100000181275_200025704644 [1,1,0,0,0,0|1,0,0]=3 6070 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 7a_100000181275_200025704644 [1,1,0,0,0,0|1,0,0]=3 6071 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 34a_100009990212_200025704644 [1,1,0,0,0,0|1,0,0]=3 6072 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 7a_100009990212_200025704644 [1,1,0,0,0,0|1,0,0]=3 6073 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 34a_100000759473_200025704644 [1,1,0,0,0,0|1,0,0]=3 6074 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 7a_100000759473_200025704644 [1,1,0,0,0,0|1,0,0]=3 6075 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 34a_100012339312_200025704644 [1,1,0,0,0,0|1,0,0]=3 6076 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 7a_100012339312_200025704644 [1,1,0,0,0,0|1,0,0]=3 6077 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 34a_100000049588_200025704644 [1,1,0,0,0,0|1,0,0]=3 6078 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 7a_100000049588_200025704644 [1,1,0,0,0,0|1,0,0]=3 6079 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 34a_100010084370_200025704644 [1,1,0,0,0,0|1,0,0]=3 6080 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 7a_100010084370_200025704644 [1,1,0,0,0,0|1,0,0]=3 6081 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 34a_100011999798_200025704644 [1,1,0,0,0,0|1,0,0]=3 6082 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 7a_100011999798_200025704644 [1,1,0,0,0,0|1,0,0]=3 6083 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Cl 34a_100011934297_200025704644 [1,1,0,0,0,0|1,0,0]=3 6084 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 34a_100012017239_200025704644 [1,1,0,0,0,0|1,0,0]=3 6085 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 7a_100012017239_200025704644 [1,1,0,0,0,0|1,0,0]=3 6086 B10R1.176 [13CH3]Oc1ccc(c(c1)N)N 34a_100025771000_200025704644 [1,1,0,0,0,0|1,0,0]=3 6087 B10R1.176 [13CH3]Oc1ccc(c(n1)F)Br 34a_100009879308_200025704644 [1,1,0,0,0,0|2,0,0]=4 6088 B10R1.176 [13CH3]Oc1cnc(c(c1)Br)Cl 34a_100012356455_200025704644 [1,1,0,0,0,0|2,0,0]=4 6089 B10R1.176 [13CH3]Oc1cnc(c(c1)Br)Cl 7a_100012356455_200025704644 [1,1,0,0,0,0|2,0,0]=4 6090 B10R1.176 [13CH3]Oc1cnc(c(c1)Br)F 34a_100009817267_200025704644 [1,1,0,0,0,0|2,0,0]=4 6091 B10R1.176 [13CH3]Oc1cnc(c(c1)Br)F 7a_100009817267_200025704644 [1,1,0,0,0,0|2,0,0]=4 6092 B10R1.176 [13CH3]Oc1cnc(c(c1)Cl)Br 34a_100010209684_200025704644 [1,1,0,0,0,0|2,0,0]=4 6093 B10R1.176 [13CH3]Oc1cnc(c(c1)Cl)Br 7a_100010209684_200025704644 [1,1,0,0,0,0|2,0,0]=4 6094 B10R1.176 [13CH3]Oc1cnc(c(c1)Cl)Cl 34a_100000094354_200025704644 [1,1,0,0,0,0|2,0,0]=4 6095 B10R1.176 [13CH3]Oc1cnc(c(c1)Cl)Cl 7a_100000094354_200025704644 [1,1,0,0,0,0|2,0,0]=4 6096 B10R1.176 [13CH3]Oc1cnc(c(c1)Cl)F 34a_100000087088_200025704644 [1,1,0,0,0,0|2,0,0]=4 6097 B10R1.176 [13CH3]Oc1cnc(c(c1)Cl)F 7a_100000087088_200025704644 [1,1,0,0,0,0|2,0,0]=4 6098 B10R1.176 [13CH3]Oc1cnc(c(c1)F)Cl 34a_100000063512_200025704644 [1,1,0,0,0,0|2,0,0]=4 6099 B10R1.176 [13CH3]Oc1cnc(c(c1)F)Cl 7a_100000063512_200025704644 [1,1,0,0,0,0|2,0,0]=4 6100 B10R1.176 [13CH3]Sc1cc(c(cn1)O)N 62a_100009819941_200025704644 [1,1,0,0,0,0|1,1,0]=4 6101 B10R1.176 [13CH3]Sc1cc(c(cn1)O)N 62a_200025704644_100009819941 [1,1,0,0,0,0|1,1,0]=4 6102 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_100012356285_200025704644 [1,1,0,0,0,0|1,1,0]=4 6103 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_200025704644_100012356285 [1,1,0,0,0,0|1,1,0]=4 6104 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_100012353702_200025704644 [1,1,0,0,0,0|1,1,0]=4 6105 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_200025704644_100012353702 [1,1,0,0,0,0|1,1,0]=4 6106 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_100012047266_200025704644 [1,1,0,0,0,0|1,1,0]=4 6107 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_200025704644_100012047266 [1,1,0,0,0,0|1,1,0]=4 6108 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_100000750455_200025704644 [1,1,0,0,0,0|1,1,0]=4 6109 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_200025704644_100000750455 [1,1,0,0,0,0|1,1,0]=4 6110 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_100012361655_200025704644 [1,1,0,0,0,0|0,1,0]=3 6111 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_200025704644_100012361655 [1,1,0,0,0,0|0,1,0]=3 6112 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_100012047281_200025704644 [1,1,0,0,0,0|1,1,0]=4 6113 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_200025704644_100012047281 [1,1,0,0,0,0|1,1,0]=4 6114 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_100011214914_200025704644 [1,1,0,0,0,0|1,1,0]=4 6115 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_200025704644_100011214914 [1,1,0,0,0,0|1,1,0]=4 6116 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_100011215976_200025704644 [1,1,0,0,0,0|1,1,0]=4 6117 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_200025704644_100011215976 [1,1,0,0,0,0|1,1,0]=4 6118 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_100011218065_200025704644 [1,1,0,0,0,0|1,1,0]=4 6119 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_200025704644_100011218065 [1,1,0,0,0,0|1,1,0]=4 6120 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_100012360047_200025704644 [1,1,0,0,0,0|0,1,0]=3 6121 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_200025704644_100012360047 [1,1,0,0,0,0|0,1,0]=3 6122 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_100000685389_200025704644 [1,1,0,0,0,0|1,1,0]=4 6123 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_200025704644_100000685389 [1,1,0,0,0,0|1,1,0]=4 6124 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_100011216805_200025704644 [1,1,0,0,0,0|1,1,0]=4 6125 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_200025704644_100011216805 [1,1,0,0,0,0|1,1,0]=4 6126 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_100000703953_200025704644 [1,1,0,0,0,0|1,1,0]=4 6127 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_200025704644_100000703953 [1,1,0,0,0,0|1,1,0]=4 6128 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_100011215594_200025704644 [1,1,0,0,0,0|1,1,0]=4 6129 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_200025704644_100011215594 [1,1,0,0,0,0|1,1,0]=4 6130 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_100000185481_200025704644 [1,1,0,0,0,0|0,1,0]=3 6131 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_200025704644_100000185481 [1,1,0,0,0,0|0,1,0]=3 6132 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_100000750456_200025704644 [1,1,0,0,0,0|1,1,0]=4 6133 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_200025704644_100000750456 [1,1,0,0,0,0|1,1,0]=4 6134 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200000761891_200025704644 [1,1,0,0,0,0|1,1,0]=4 6135 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200025704644_200000761891 [1,1,0,0,0,0|1,1,0]=4 6136 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_100000740924_200025704644 [1,1,0,0,0,0|1,1,0]=4 6137 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_200025704644_100000740924 [1,1,0,0,0,0|1,1,0]=4 6138 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_100000741789_200025704644 [1,1,0,0,0,0|1,1,0]=4 6139 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_200025704644_100011534411 [1,1,0,0,0,0|1,1,0]=4 6140 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [1,1,0,0,0,0|0,1,0]=3 6141 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [1,1,0,0,0,0|0,1,0]=3 6142 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_100012356990_200025704644 [1,1,0,0,0,0|1,1,0]=4 6143 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_200025704644_100012356990 [1,1,0,0,0,0|1,1,0]=4 6144 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [1,1,0,0,0,0|1,1,0]=4 6145 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [1,1,0,0,0,0|1,1,0]=4 6146 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_100000686035_200025704644 [1,1,0,0,0,0|1,1,0]=4 6147 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_200025704644_100000686035 [1,1,0,0,0,0|1,1,0]=4 6148 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_100000739049_200025704644 [1,1,0,0,0,0|1,1,0]=4 6149 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_200025704644_100000739049 [1,1,0,0,0,0|1,1,0]=4 6150 B10R1.176 [13CH3]Sc1ccc(c(c1)O)O 62a_200025704644_100009813601 [1,1,0,0,0,0|0,1,0]=3 6151 B10R1.176 [13CH3]Sc1ccc(c(n1)Br)O 62a_100000725334_200025704644 [1,1,0,0,0,0|1,1,0]=4 6152 B10R1.176 [13CH3]Sc1ccc(c(n1)Br)O 62a_200025704644_100000725334 [1,1,0,0,0,0|1,1,0]=4 6153 B10R1.176 [13CH3]Sc1ccc(c(n1)Cl)O 62a_200025704644_100000721234 [1,1,0,0,0,0|1,1,0]=4 6154 B10R1.176 [13CH3]Sc1ccc(c(n1)F)O 62a_100009819667_200025704644 [1,1,0,0,0,0|1,1,0]=4 6155 B10R1.176 [13CH3]Sc1ccc(c(n1)F)O 62a_200025704644_100009819667 [1,1,0,0,0,0|1,1,0]=4 6156 B10R1.176 [13CH3]Sc1ccc(c(n1)N)O 62a_100000685527_200025704644 [1,1,0,0,0,0|1,1,0]=4 6157 B10R1.176 [13CH3]Sc1ccc(c(n1)N)O 62a_200025704644_100000685527 [1,1,0,0,0,0|1,1,0]=4 6158 B10R1.176 [13CH3]Sc1cnc(c(c1)Cl)O 62a_100010238531_200025704644 [1,1,0,0,0,0|1,1,0]=4 6159 B10R1.176 [13CH3]Sc1cnc(c(c1)Cl)O 62a_200025704644_100010238531 [1,1,0,0,0,0|1,1,0]=4 6160 B10R1.176 [13CH3]Sc1cnc(c(c1)N)O 62a_100000743729_200025704644 [1,1,0,0,0,0|1,1,0]=4 6161 B10R1.176 [13CH3]Sc1cnc(c(c1)N)O 62a_200025704644_100000743729 [1,1,0,0,0,0|1,1,0]=4 6162 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,1,0,0,0,0|1,0,1]=4 6163 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,1,0,0,0,0|1,0,1]=4 6164 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,1,0,0,0,0|1,0,1]=4 6165 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,1,0,0,0,0|1,0,1]=4 6166 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,1,0,0,0,0|1,0,1]=4 6167 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,1,0,0,0,0|1,0,1]=4 6168 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [1,1,0,0,0,0|1,0,0]=3 6169 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [1,1,0,0,0,0|1,0,0]=3 6170 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [1,1,0,0,0,0|1,0,0]=3 6171 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [1,1,0,0,0,0|1,0,0]=3 6172 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [1,1,0,0,0,0|1,0,0]=3 6173 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [1,1,0,0,0,0|1,0,0]=3 6174 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [1,1,0,0,0,0|1,0,0]=3 6175 B10R1.4 CCNc1ccncc1Br 27a_100015525214_100000726257 [1,1,0,0,0,0|2,0,0]=4 6176 B10R1.4 CCNc1ccncc1C 27a_100015525214_100000765111 [1,1,0,0,0,0|2,0,0]=4 6177 B10R1.4 CCNc1ccncc1F 27a_100015525214_100000035921 [1,1,0,0,0,0|2,0,0]=4 6178 B10R1.4 CCNc1ncccc1Br 27a_100015525214_100000696092 [1,1,0,0,0,0|2,0,0]=4 6179 B10R1.4 CCOc1cccc[n+]1[O-] 7a_100000211761_100000210202 [1,1,0,0,0,0|1,0,0]=3 6180 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [1,1,0,0,0,0|0,0,0]=2 6181 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [1,1,0,0,0,0|0,0,0]=2 6182 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [1,1,0,0,0,0|0,0,0]=2 6183 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [1,1,0,0,0,0|0,0,0]=2 6184 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [1,1,0,0,0,0|0,0,0]=2 6185 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [1,1,0,0,0,0|0,0,0]=2 6186 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [1,1,0,0,0,0|0,0,0]=2 6187 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [1,1,0,0,0,0|0,0,0]=2 6188 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [1,1,0,0,0,0|0,0,0]=2 6189 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [1,1,0,0,0,0|0,0,0]=2 6190 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [1,1,0,0,0,0|0,0,0]=2 6191 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [1,1,0,0,0,0|0,0,0]=2 6192 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [1,1,0,0,0,0|0,0,0]=2 6193 B10R1.4 CCOc1cccnc1Br 34a_100000744436_100000210202 [1,1,0,0,0,0|1,0,0]=3 6194 B10R1.4 CCOc1cccnc1Br 7a_100000744436_100000210202 [1,1,0,0,0,0|1,0,0]=3 6195 B10R1.4 CCOc1cccnc1C 34a_100000745507_100000210202 [1,1,0,0,0,0|1,0,0]=3 6196 B10R1.4 CCOc1cccnc1C 7a_100000745507_100000210202 [1,1,0,0,0,0|1,0,0]=3 6197 B10R1.4 CCOc1cccnc1Cl 34a_100000757616_100000210202 [1,1,0,0,0,0|1,0,0]=3 6198 B10R1.4 CCOc1cccnc1Cl 7a_100000757616_100000210202 [1,1,0,0,0,0|1,0,0]=3 6199 B10R1.4 CCOc1cccnc1F 34a_100000061740_100000210202 [1,1,0,0,0,0|1,0,0]=3 6200 B10R1.4 CCOc1cccnc1F 7a_100000061740_100000210202 [1,1,0,0,0,0|1,0,0]=3 6201 B10R1.4 CCOc1cccnc1I 34a_100000034122_100000210202 [1,1,0,0,0,0|1,0,0]=3 6202 B10R1.4 CCOc1cccnc1I 7a_100000034122_100000210202 [1,1,0,0,0,0|1,0,0]=3 6203 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [1,1,0,0,0,0|1,0,0]=3 6204 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [1,1,0,0,0,0|1,0,0]=3 6205 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [1,1,0,0,0,0|1,0,0]=3 6206 B10R1.4 CCOc1cccoc1=O 34a_100000077404_100000210202 [1,1,0,0,0,0|1,0,0]=3 6207 B10R1.4 CCOc1cccoc1=O 7a_100000077404_100000210202 [1,1,0,0,0,0|1,0,0]=3 6208 B10R1.4 CCOc1ccncc1Br 34a_100011996408_100000210202 [1,1,0,0,0,0|1,0,0]=3 6209 B10R1.4 CCOc1ccncc1C 34a_100000694293_100000210202 [1,1,0,0,0,0|1,0,0]=3 6210 B10R1.4 CCOc1ccncc1Cl 34a_100011997054_100000210202 [1,1,0,0,0,0|1,0,0]=3 6211 B10R1.4 CCOc1ccncc1F 34a_200000081243_100000210202 [1,1,0,0,0,0|1,0,0]=3 6212 B10R1.4 CCOc1cnccc1C 34a_100011997053_100000210202 [1,1,0,0,0,0|1,0,0]=3 6213 B10R1.4 CCOc1cnccc1C 7a_100011997053_100000210202 [1,1,0,0,0,0|1,0,0]=3 6214 B10R1.4 CCOc1cnccc1Cl 34a_100011996695_100000210202 [1,1,0,0,0,0|1,0,0]=3 6215 B10R1.4 CCOc1cnccc1I 34a_100000050107_100000210202 [1,1,0,0,0,0|1,0,0]=3 6216 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [1,1,0,0,0,0|1,0,0]=3 6217 B10R1.4 CCOc1cncnc1N 7a_100000112926_100000210202 [1,1,0,0,0,0|2,0,0]=4 6218 B10R1.4 CCOc1coccc1=O 34a_100000060831_100000210202 [1,1,0,0,0,0|1,0,0]=3 6219 B10R1.4 CCOc1ncccc1Cl 34a_100011290957_100000210202 [1,1,0,0,0,0|1,0,0]=3 6220 B10R1.4 CCOc1ncccc1F 34a_100011219419_100000210202 [1,1,0,0,0,0|1,0,0]=3 6221 B10R1.4 CCOc1ncccc1N 34a_100000746358_100000210202 [1,1,0,0,0,0|1,0,0]=3 6222 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [1,1,0,0,0,0|1,0,0]=3 6223 B10R1.4 CCOc1nccnc1C 34a_100000766352_100000210202 [1,1,0,0,0,0|2,0,0]=4 6224 B10R1.4 CCOc1nccnc1O 271570a_203496583355_200010128176 [1,1,0,0,0,0|2,0,0]=4 6225 B10R1.4 CCSc1c[nH]ccc1=O 62a_100000210202_100009998708 [1,1,0,0,0,0|1,1,0]=4 6226 B10R1.4 CCSc1c[nH]ccc1=O 62a_100009998708_100000210202 [1,1,0,0,0,0|1,1,0]=4 6227 B10R1.4 CCSc1c[nH]ccc1=S 62a_100000210202_200012280681 [1,1,0,0,0,0|1,1,0]=4 6228 B10R1.4 CCSc1c[nH]ccc1=S 62a_200012280681_100000210202 [1,1,0,0,0,0|1,1,0]=4 6229 B10R1.4 CCSc1cccc[n+]1C 62a_100000210202_100000212160 [1,1,0,0,0,0|1,1,0]=4 6230 B10R1.4 CCSc1cccc[n+]1[O-] 62a_100000210202_200000042595 [1,1,0,0,0,0|1,1,0]=4 6231 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [1,1,0,0,0,0|0,1,0]=3 6232 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [1,1,0,0,0,0|0,1,0]=3 6233 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [1,1,0,0,0,0|0,1,0]=3 6234 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [1,1,0,0,0,0|0,1,0]=3 6235 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [1,1,0,0,0,0|0,1,0]=3 6236 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [1,1,0,0,0,0|0,1,0]=3 6237 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [1,1,0,0,0,0|0,1,0]=3 6238 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [1,1,0,0,0,0|0,1,0]=3 6239 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [1,1,0,0,0,0|0,1,0]=3 6240 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [1,1,0,0,0,0|0,1,0]=3 6241 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [1,1,0,0,0,0|0,1,0]=3 6242 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [1,1,0,0,0,0|0,1,0]=3 6243 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [1,1,0,0,0,0|0,1,0]=3 6244 B10R1.4 CCSc1cccnc1Br 62a_100000210202_100010202626 [1,1,0,0,0,0|1,1,0]=4 6245 B10R1.4 CCSc1cccnc1Br 62a_100010202626_100000210202 [1,1,0,0,0,0|1,1,0]=4 6246 B10R1.4 CCSc1cccnc1C 62a_100000210202_100000751574 [1,1,0,0,0,0|1,1,0]=4 6247 B10R1.4 CCSc1cccnc1C 62a_100000751574_100000210202 [1,1,0,0,0,0|1,1,0]=4 6248 B10R1.4 CCSc1cccnc1Cl 62a_100000036424_100000210202 [1,1,0,0,0,0|1,1,0]=4 6249 B10R1.4 CCSc1cccnc1Cl 62a_100000210202_100000036424 [1,1,0,0,0,0|1,1,0]=4 6250 B10R1.4 CCSc1cccnc1F 62a_100000210202_100009816115 [1,1,0,0,0,0|1,1,0]=4 6251 B10R1.4 CCSc1cccnc1F 62a_100009816115_100000210202 [1,1,0,0,0,0|1,1,0]=4 6252 B10R1.4 CCSc1cccnc1N 62a_100000045569_100000210202 [1,1,0,0,0,0|1,1,0]=4 6253 B10R1.4 CCSc1cccnc1N 62a_100000210202_100000045569 [1,1,0,0,0,0|1,1,0]=4 6254 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [1,1,0,0,0,0|1,1,0]=4 6255 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [1,1,0,0,0,0|1,1,0]=4 6256 B10R1.4 CCSc1ccncc1Br 62a_100000210202_100000726257 [1,1,0,0,0,0|1,1,0]=4 6257 B10R1.4 CCSc1ccncc1Br 62a_100000726257_100000210202 [1,1,0,0,0,0|1,1,0]=4 6258 B10R1.4 CCSc1ccncc1C 62a_100000210202_100000765111 [1,1,0,0,0,0|1,1,0]=4 6259 B10R1.4 CCSc1ccncc1C 62a_100000765111_100000210202 [1,1,0,0,0,0|1,1,0]=4 6260 B10R1.4 CCSc1ccncc1Cl 62a_100000210202_100000708259 [1,1,0,0,0,0|1,1,0]=4 6261 B10R1.4 CCSc1ccncc1Cl 62a_100000708259_100000210202 [1,1,0,0,0,0|1,1,0]=4 6262 B10R1.4 CCSc1ccncc1F 62a_100000047030_100000210202 [1,1,0,0,0,0|1,1,0]=4 6263 B10R1.4 CCSc1ccncc1F 62a_100000210202_100000047030 [1,1,0,0,0,0|1,1,0]=4 6264 B10R1.4 CCSc1ccncc1N 62a_100000210202_100000756074 [1,1,0,0,0,0|1,1,0]=4 6265 B10R1.4 CCSc1ccncc1N 62a_100000756074_100000210202 [1,1,0,0,0,0|1,1,0]=4 6266 B10R1.4 CCSc1ccncc1O 62a_100000210202_100009817591 [1,1,0,0,0,0|1,1,0]=4 6267 B10R1.4 CCSc1ccncc1O 62a_100009817591_100000210202 [1,1,0,0,0,0|1,1,0]=4 6268 B10R1.4 CCSc1cnccc1Br 62a_100000210202_100010138639 [1,1,0,0,0,0|1,1,0]=4 6269 B10R1.4 CCSc1cnccc1Br 62a_100010138639_100000210202 [1,1,0,0,0,0|1,1,0]=4 6270 B10R1.4 CCSc1cnccc1C 62a_100000210202_100000761580 [1,1,0,0,0,0|1,1,0]=4 6271 B10R1.4 CCSc1cnccc1C 62a_100000761580_100000210202 [1,1,0,0,0,0|1,1,0]=4 6272 B10R1.4 CCSc1cnccc1Cl 62a_100000210202_100009995489 [1,1,0,0,0,0|1,1,0]=4 6273 B10R1.4 CCSc1cnccc1Cl 62a_100009995489_100000210202 [1,1,0,0,0,0|1,1,0]=4 6274 B10R1.4 CCSc1cnccc1F 62a_100000210202_100009820683 [1,1,0,0,0,0|1,1,0]=4 6275 B10R1.4 CCSc1cnccc1F 62a_100009820683_100000210202 [1,1,0,0,0,0|1,1,0]=4 6276 B10R1.4 CCSc1cnccc1N 62a_100000047001_100000210202 [1,1,0,0,0,0|1,1,0]=4 6277 B10R1.4 CCSc1cnccc1N 62a_100000210202_100000047001 [1,1,0,0,0,0|1,1,0]=4 6278 B10R1.4 CCSc1ncccc1Br 62a_100000210202_100000696092 [1,1,0,0,0,0|1,1,0]=4 6279 B10R1.4 CCSc1ncccc1Br 62a_100000696092_100000210202 [1,1,0,0,0,0|1,1,0]=4 6280 B10R1.4 CCSc1ncccc1C 62a_100000210202_100000751373 [1,1,0,0,0,0|1,1,0]=4 6281 B10R1.4 CCSc1ncccc1C 62a_100000751373_100000210202 [1,1,0,0,0,0|1,1,0]=4 6282 B10R1.4 CCSc1ncccc1Cl 62a_100000210202_100011356963 [1,1,0,0,0,0|1,1,0]=4 6283 B10R1.4 CCSc1ncccc1Cl 62a_100011356963_100000210202 [1,1,0,0,0,0|1,1,0]=4 6284 B10R1.4 CCSc1ncccc1F 62a_100000210202_100000685392 [1,1,0,0,0,0|1,1,0]=4 6285 B10R1.4 CCSc1ncccc1F 62a_100000685392_100000210202 [1,1,0,0,0,0|1,1,0]=4 6286 B10R1.4 CCSc1ncccc1N 62a_100000210202_100000688686 [1,1,0,0,0,0|1,1,0]=4 6287 B10R1.4 CCSc1ncccc1N 62a_100000688686_100000210202 [1,1,0,0,0,0|1,1,0]=4 6288 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [1,1,0,0,0,0|1,1,0]=4 6289 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [1,1,0,0,0,0|1,1,0]=4 6290 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [1,1,0,0,0,0|2,0,0]=4 6291 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [1,1,0,0,0,0|2,0,0]=4 6292 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [1,1,0,0,0,0|2,0,0]=4 6293 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [1,1,0,0,0,0|2,0,0]=4 6294 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [1,1,0,0,0,0|2,0,0]=4 6295 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [1,1,0,0,0,0|2,0,0]=4 6296 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [1,1,0,0,0,0|2,0,0]=4 6297 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [1,1,0,0,0,0|2,0,0]=4 6298 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [1,1,0,0,0,0|2,0,0]=4 6299 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [1,1,0,0,0,0|2,0,0]=4 6300 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [1,1,0,0,0,0|2,0,0]=4 6301 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [1,1,0,0,0,0|2,0,0]=4 6302 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [1,1,0,0,0,0|2,0,0]=4 6303 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [1,1,0,0,0,0|2,0,0]=4 6304 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [1,1,0,0,0,0|2,0,0]=4 6305 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [1,1,0,0,0,0|2,0,0]=4 6306 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [1,1,0,0,0,0|2,0,0]=4 6307 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [1,1,0,0,0,0|2,0,0]=4 6308 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [1,1,0,0,0,0|2,0,0]=4 6309 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [1,1,0,0,0,0|2,0,0]=4 6310 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [1,1,0,0,0,0|2,0,0]=4 6311 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [1,1,0,0,0,0|2,0,0]=4 6312 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [1,1,0,0,0,0|2,0,0]=4 6313 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [1,1,0,0,0,0|2,0,0]=4 6314 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [1,1,0,0,0,0|2,0,0]=4 6315 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [1,1,0,0,0,0|2,0,0]=4 6316 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [1,1,0,0,0,0|2,0,0]=4 6317 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [1,1,0,0,0,0|2,0,0]=4 6318 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [1,1,0,0,0,0|2,0,0]=4 6319 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [1,1,0,0,0,0|2,0,0]=4 6320 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [1,1,0,0,0,0|2,0,0]=4 6321 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [1,1,0,0,0,0|2,0,0]=4 6322 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [1,1,0,0,0,0|2,0,0]=4 6323 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [1,1,0,0,0,0|2,0,0]=4 6324 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [1,1,0,0,0,0|2,0,0]=4 6325 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [1,1,0,0,0,0|2,0,0]=4 6326 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [1,1,0,0,0,0|2,0,0]=4 6327 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [1,1,0,0,0,0|2,0,0]=4 6328 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [1,1,0,0,0,0|2,0,0]=4 6329 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [1,1,0,0,0,0|2,0,0]=4 6330 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [1,1,0,0,0,0|2,0,0]=4 6331 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [1,1,0,0,0,0|2,0,0]=4 6332 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [1,1,0,0,0,0|2,0,0]=4 6333 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [1,1,0,0,0,0|2,0,0]=4 6334 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [1,1,0,0,0,0|2,0,0]=4 6335 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [1,1,0,0,0,0|2,0,0]=4 6336 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [1,1,0,0,0,0|2,0,0]=4 6337 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [1,1,0,0,0,0|2,0,0]=4 6338 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [1,1,0,0,0,0|2,0,0]=4 6339 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [1,1,0,0,0,0|2,0,0]=4 6340 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [1,1,0,0,0,0|2,0,0]=4 6341 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [1,1,0,0,0,0|2,0,0]=4 6342 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [1,1,0,0,0,0|2,0,0]=4 6343 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [1,1,0,0,0,0|2,0,0]=4 6344 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [1,1,0,0,0,0|2,0,0]=4 6345 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [1,1,0,0,0,0|2,0,0]=4 6346 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [1,1,0,0,0,0|2,0,0]=4 6347 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [1,1,0,0,0,0|2,0,0]=4 6348 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [1,1,0,0,0,0|2,0,0]=4 6349 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [1,1,0,0,0,0|2,0,0]=4 6350 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [1,1,0,0,0,0|2,0,0]=4 6351 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [1,1,0,0,0,0|2,0,0]=4 6352 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [1,1,0,0,0,0|2,0,0]=4 6353 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [1,1,0,0,0,0|2,0,0]=4 6354 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [1,1,0,0,0,0|2,0,0]=4 6355 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [1,1,0,0,0,0|2,0,0]=4 6356 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [1,1,0,0,0,0|2,0,0]=4 6357 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [1,1,0,0,0,0|2,0,0]=4 6358 B10R1.4 Cc1ccccc1NCF 34a_100015192222_100015361967 [1,1,0,0,0,0|2,0,0]=4 6359 B10R1.4 Cc1ccccc1OCF 34a_100000210338_100015361967 [1,1,0,0,0,0|1,0,0]=3 6360 B10R1.4 Cc1ccccc1OCF 7a_100000210338_100015361967 [1,1,0,0,0,0|1,0,0]=3 6361 B10R1.4 Cc1ccccc1SCF 62a_100000210755_100015361967 [1,1,0,0,0,0|1,1,0]=4 6362 B10R1.4 Cc1ccccc1SCF 62a_100015361967_100000210755 [1,1,0,0,0,0|1,1,0]=4 6363 B10R1.4 Cc1ccncc1OCF 34a_100011997053_100015361967 [1,1,0,0,0,0|2,0,0]=4 6364 B10R1.4 Cc1ccncc1OCF 7a_100011997053_100015361967 [1,1,0,0,0,0|2,0,0]=4 6365 B10R1.4 Cc1cnccc1OCF 34a_100000694293_100015361967 [1,1,0,0,0,0|2,0,0]=4 6366 B10R1.4 Cc1ncccc1OCF 34a_100000745507_100015361967 [1,1,0,0,0,0|2,0,0]=4 6367 B10R1.4 Cc1ncccc1OCF 7a_100000745507_100015361967 [1,1,0,0,0,0|2,0,0]=4 6368 B10R1.4 FCNc1ccccc1Br 34a_100000210017_100015361967 [1,1,0,0,0,0|2,0,0]=4 6369 B10R1.4 FCNc1ccccc1Cl 34a_100000185783_100015361967 [1,1,0,0,0,0|2,0,0]=4 6370 B10R1.4 FCNc1ccccc1F 34a_100000210422_100015361967 [1,1,0,0,0,0|2,0,0]=4 6371 B10R1.4 FCNc1ccccc1I 34a_100000210053_100015361967 [1,1,0,0,0,0|2,0,0]=4 6372 B10R1.4 FCOc1ccccc1Br 34a_100000181306_100015361967 [1,1,0,0,0,0|1,0,0]=3 6373 B10R1.4 FCOc1ccccc1Br 7a_100000181306_100015361967 [1,1,0,0,0,0|1,0,0]=3 6374 B10R1.4 FCOc1ccccc1Cl 34a_100000210172_100015361967 [1,1,0,0,0,0|1,0,0]=3 6375 B10R1.4 FCOc1ccccc1Cl 7a_100000210172_100015361967 [1,1,0,0,0,0|1,0,0]=3 6376 B10R1.4 FCOc1ccccc1F 34a_100000210171_100015361967 [1,1,0,0,0,0|1,0,0]=3 6377 B10R1.4 FCOc1ccccc1F 7a_100000210171_100015361967 [1,1,0,0,0,0|1,0,0]=3 6378 B10R1.4 FCOc1ccccc1I 34a_100000739446_100015361967 [1,1,0,0,0,0|1,0,0]=3 6379 B10R1.4 FCOc1ccccc1I 7a_100000739446_100015361967 [1,1,0,0,0,0|1,0,0]=3 6380 B10R1.4 FCOc1cccnc1Br 34a_100000744436_100015361967 [1,1,0,0,0,0|2,0,0]=4 6381 B10R1.4 FCOc1cccnc1Br 7a_100000744436_100015361967 [1,1,0,0,0,0|2,0,0]=4 6382 B10R1.4 FCOc1cccnc1Cl 34a_100000757616_100015361967 [1,1,0,0,0,0|2,0,0]=4 6383 B10R1.4 FCOc1cccnc1Cl 7a_100000757616_100015361967 [1,1,0,0,0,0|2,0,0]=4 6384 B10R1.4 FCOc1cccnc1F 34a_100000061740_100015361967 [1,1,0,0,0,0|2,0,0]=4 6385 B10R1.4 FCOc1cccnc1F 7a_100000061740_100015361967 [1,1,0,0,0,0|2,0,0]=4 6386 B10R1.4 FCOc1cccnc1I 34a_100000034122_100015361967 [1,1,0,0,0,0|2,0,0]=4 6387 B10R1.4 FCOc1cccnc1I 7a_100000034122_100015361967 [1,1,0,0,0,0|2,0,0]=4 6388 B10R1.4 FCOc1ccncc1Br 34a_100011996408_100015361967 [1,1,0,0,0,0|2,0,0]=4 6389 B10R1.4 FCOc1ccncc1Cl 34a_100011997054_100015361967 [1,1,0,0,0,0|2,0,0]=4 6390 B10R1.4 FCOc1ccncc1F 34a_200000081243_100015361967 [1,1,0,0,0,0|2,0,0]=4 6391 B10R1.4 FCOc1cnccc1Cl 34a_100011996695_100015361967 [1,1,0,0,0,0|2,0,0]=4 6392 B10R1.4 FCOc1cnccc1I 34a_100000050107_100015361967 [1,1,0,0,0,0|2,0,0]=4 6393 B10R1.4 FCOc1ncccc1Cl 34a_100011290957_100015361967 [1,1,0,0,0,0|2,0,0]=4 6394 B10R1.4 FCOc1ncccc1F 34a_100011219419_100015361967 [1,1,0,0,0,0|2,0,0]=4 6395 B10R1.4 FCSc1ccccc1Br 62a_100000695589_100015361967 [1,1,0,0,0,0|1,1,0]=4 6396 B10R1.4 FCSc1ccccc1Br 62a_100015361967_100000695589 [1,1,0,0,0,0|1,1,0]=4 6397 B10R1.4 FCSc1ccccc1Cl 62a_100000764095_100015361967 [1,1,0,0,0,0|1,1,0]=4 6398 B10R1.4 FCSc1ccccc1Cl 62a_100015361967_100000764095 [1,1,0,0,0,0|1,1,0]=4 6399 B10R1.4 FCSc1ccccc1F 62a_100011215700_100015361967 [1,1,0,0,0,0|1,1,0]=4 6400 B10R1.4 FCSc1ccccc1F 62a_100015361967_100011215700 [1,1,0,0,0,0|1,1,0]=4 6401 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [1,1,0,0,0,0|2,0,0]=4 6402 B10R1.4 Nc1ccccc1OCF 34a_100000185747_100015361967 [1,1,0,0,0,0|1,0,0]=3 6403 B10R1.4 Nc1ccccc1OCF 7a_100000185747_100015361967 [1,1,0,0,0,0|1,0,0]=3 6404 B10R1.4 Nc1ccccc1SCF 62a_100000210017_100015361967 [1,1,0,0,0,0|1,1,0]=4 6405 B10R1.4 Nc1ccccc1SCF 62a_100015361967_100000210017 [1,1,0,0,0,0|1,1,0]=4 6406 B10R1.4 Nc1cccnc1OCF 34a_100000746358_100015361967 [1,1,0,0,0,0|2,0,0]=4 6407 B10R1.4 Nc1ccncc1OCF 34a_100000753702_100015361967 [1,1,0,0,0,0|2,0,0]=4 6408 B10R1.4 Nc1ncccc1OCF 34a_100000211975_100015361967 [1,1,0,0,0,0|2,0,0]=4 6409 B10R1.4 Nc1ncccc1OCF 7a_100000211975_100015361967 [1,1,0,0,0,0|2,0,0]=4 6410 B10R1.4 O=c1ccocc1OCF 34a_100000060831_100015361967 [1,1,0,0,0,0|2,0,0]=4 6411 B10R1.4 O=c1occcc1OCF 34a_100000077404_100015361967 [1,1,0,0,0,0|2,0,0]=4 6412 B10R1.4 O=c1occcc1OCF 7a_100000077404_100015361967 [1,1,0,0,0,0|2,0,0]=4 6413 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [1,1,0,0,0,0|2,0,0]=4 6414 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [1,1,0,0,0,0|2,0,0]=4 6415 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [1,1,0,0,0,0|1,1,0]=4 6416 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [1,1,0,0,0,0|1,1,0]=4 6417 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [1,1,0,0,0,0|2,0,0]=4 6418 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [1,1,0,0,0,0|2,0,0]=4 6419 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [1,1,0,0,0,0|2,0,0]=4 6420 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [1,1,0,0,0,0|2,0,0]=4 6421 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [1,1,0,0,0,0|2,0,0]=4 6422 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [1,1,0,0,0,0|2,0,0]=4 6423 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [1,1,0,0,0,0|2,0,0]=4 6424 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [1,1,0,0,0,0|2,0,0]=4 6425 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [1,1,0,0,0,0|2,0,0]=4 6426 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [1,1,0,0,0,0|2,0,0]=4 6427 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [1,1,0,0,0,0|2,0,0]=4 6428 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [1,1,0,0,0,0|2,0,0]=4 6429 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [1,1,0,0,0,0|2,0,0]=4 6430 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [1,1,0,0,0,0|2,0,0]=4 6431 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [1,1,0,0,0,0|2,0,0]=4 6432 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [1,1,0,0,0,0|2,0,0]=4 6433 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [1,1,0,0,0,0|2,0,0]=4 6434 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [1,1,0,0,0,0|2,0,0]=4 6435 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [1,1,0,0,0,0|2,0,0]=4 6436 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [1,1,0,0,0,0|2,0,0]=4 6437 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [1,1,0,0,0,0|2,0,0]=4 6438 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [1,1,0,0,0,0|2,0,0]=4 6439 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [1,1,0,0,0,0|2,0,0]=4 6440 B10R1.4 [O-][n+]1ccccc1OCF 7a_100000211761_100015361967 [1,1,0,0,0,0|2,0,0]=4 6441 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,1,0,0,0,0|1,0,1]=4 6442 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,1,0,0,0,0|1,0,1]=4 6443 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,1,0,0,0,0|1,0,1]=4 6444 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,1,0,0,0,0|1,0,1]=4 6445 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,1,0,0,0,0|1,0,1]=4 6446 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,1,0,0,0,0|1,0,1]=4 6447 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,1,0,0,0,0|1,0,1]=4 6448 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,1,0,0,0,0|1,0,1]=4 6449 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,1,0,0,0,0|1,0,0]=3 6450 B10R1.10 CCNc1cc(ccn1)F 27a_100015525214_100000764206 [1,1,0,0,0,0|2,0,0]=4 6451 B10R1.10 CCNc1cc[nH]c(=O)c1 27a_100015525214_100000061649 [1,1,0,0,0,0|2,0,0]=4 6452 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,1,0,0,0,0|1,0,0]=3 6453 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,1,0,0,0,0|1,0,0]=3 6454 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,1,0,0,0,0|1,0,0]=3 6455 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,1,0,0,0,0|1,0,0]=3 6456 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,1,0,0,0,0|1,0,0]=3 6457 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,1,0,0,0,0|1,0,0]=3 6458 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,1,0,0,0,0|1,0,0]=3 6459 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,0]=3 6460 B10R1.10 CCNc1cccc(n1)F 27a_100015525214_100009815982 [1,1,0,0,0,0|2,0,0]=4 6461 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [1,1,0,0,0,0|2,0,0]=4 6462 B10R1.10 CCNc1ccnc(c1)C 27a_100015525214_100000758586 [1,1,0,0,0,0|2,0,0]=4 6463 B10R1.10 CCNc1ccnc(c1)F 27a_100015525214_100009816116 [1,1,0,0,0,0|2,0,0]=4 6464 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [1,1,0,0,0,0|1,0,0]=3 6465 B10R1.10 CCOc1cc(cnn1)C 34a_100000766097_100000210202 [1,1,0,0,0,0|2,0,0]=4 6466 B10R1.10 CCOc1cc(ncn1)O 271570a_203496583355_100000765465 [1,1,0,0,0,0|2,0,0]=4 6467 B10R1.10 CCOc1cc[nH]c(=O)c1 34a_100000032262_100000210202 [1,1,0,0,0,0|1,0,0]=3 6468 B10R1.10 CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000210202 [1,1,0,0,0,0|1,0,0]=3 6469 B10R1.10 CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000210202 [1,1,0,0,0,0|1,0,0]=3 6470 B10R1.10 CCOc1cccc(=O)[nH]1 34a_100000033347_100000210202 [1,1,0,0,0,0|1,0,0]=3 6471 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,1,0,0,0,0|0,0,0]=2 6472 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,1,0,0,0,0|0,0,0]=2 6473 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,1,0,0,0,0|0,0,0]=2 6474 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,1,0,0,0,0|0,0,0]=2 6475 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,1,0,0,0,0|0,0,0]=2 6476 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,1,0,0,0,0|0,0,0]=2 6477 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,1,0,0,0,0|0,0,0]=2 6478 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,1,0,0,0,0|0,0,0]=2 6479 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,1,0,0,0,0|0,0,0]=2 6480 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,1,0,0,0,0|0,0,0]=2 6481 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,1,0,0,0,0|0,0,0]=2 6482 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,1,0,0,0,0|0,0,0]=2 6483 B10R1.10 CCOc1cccc(n1)F 34a_100011432558_100000210202 [1,1,0,0,0,0|1,0,0]=3 6484 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [1,1,0,0,0,0|1,0,0]=3 6485 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [1,1,0,0,0,0|1,0,0]=3 6486 B10R1.10 CCOc1ccnc(c1)Cl 34a_100000762945_100000210202 [1,1,0,0,0,0|1,0,0]=3 6487 B10R1.10 CCOc1ccnc(c1)F 34a_100000732698_100000210202 [1,1,0,0,0,0|1,0,0]=3 6488 B10R1.10 CCOc1ccnc(c1)N 34a_100011834064_100000210202 [1,1,0,0,0,0|1,0,0]=3 6489 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [1,1,0,0,0,0|1,0,0]=3 6490 B10R1.10 CCOc1ccnc(n1)O 271570a_203496583355_100011649779 [1,1,0,0,0,0|2,0,0]=4 6491 B10R1.10 CCOc1cncc(c1)Br 34a_100000754920_100000210202 [1,1,0,0,0,0|1,0,0]=3 6492 B10R1.10 CCOc1cncc(c1)Br 7a_100000754920_100000210202 [1,1,0,0,0,0|1,0,0]=3 6493 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [1,1,0,0,0,0|1,0,0]=3 6494 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [1,1,0,0,0,0|1,0,0]=3 6495 B10R1.10 CCOc1cncc(c1)Cl 7a_100000032511_100000210202 [1,1,0,0,0,0|1,0,0]=3 6496 B10R1.10 CCOc1cncc(c1)F 34a_100011830296_100000210202 [1,1,0,0,0,0|1,0,0]=3 6497 B10R1.10 CCOc1cncc(c1)F 7a_100011830296_100000210202 [1,1,0,0,0,0|1,0,0]=3 6498 B10R1.10 CCOc1cncc(c1)N 34a_100011997051_100000210202 [1,1,0,0,0,0|1,0,0]=3 6499 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [1,1,0,0,0,0|1,0,0]=3 6500 B10R1.10 CCOc1cncc(n1)O 271570a_203496583355_100000757043 [1,1,0,0,0,0|2,0,0]=4 6501 B10R1.10 CCOc1cnnc(c1)Cl 34a_200010734679_100000210202 [1,1,0,0,0,0|2,0,0]=4 6502 B10R1.10 CCOc1cnnc(c1)N 34a_200015193112_100000210202 [1,1,0,0,0,0|2,0,0]=4 6503 B10R1.10 CCSc1cc(=O)cc[nH]1 62a_100009817434_100000210202 [1,1,0,0,0,0|1,1,0]=4 6504 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [1,1,0,0,0,0|1,1,0]=4 6505 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [1,1,0,0,0,0|1,1,0]=4 6506 B10R1.10 CCSc1cc(ccn1)Cl 62a_100000210202_100010167805 [1,1,0,0,0,0|1,1,0]=4 6507 B10R1.10 CCSc1cc(ccn1)Cl 62a_100010167805_100000210202 [1,1,0,0,0,0|1,1,0]=4 6508 B10R1.10 CCSc1cc(ccn1)F 62a_100000210202_100000764206 [1,1,0,0,0,0|1,1,0]=4 6509 B10R1.10 CCSc1cc(ccn1)F 62a_100000764206_100000210202 [1,1,0,0,0,0|1,1,0]=4 6510 B10R1.10 CCSc1cc(ccn1)N 62a_100000210202_100009814236 [1,1,0,0,0,0|1,1,0]=4 6511 B10R1.10 CCSc1cc(ccn1)N 62a_100009814236_100000210202 [1,1,0,0,0,0|1,1,0]=4 6512 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [1,1,0,0,0,0|1,1,0]=4 6513 B10R1.10 CCSc1cc[nH]c(=O)c1 62a_100000210202_100009816521 [1,1,0,0,0,0|1,1,0]=4 6514 B10R1.10 CCSc1cc[nH]c(=O)c1 62a_100009816521_100000210202 [1,1,0,0,0,0|1,1,0]=4 6515 B10R1.10 CCSc1ccc[n+](c1)C 62a_100000210202_100009996589 [1,1,0,0,0,0|1,1,0]=4 6516 B10R1.10 CCSc1ccc[n+](c1)C 62a_100009996589_100000210202 [1,1,0,0,0,0|1,1,0]=4 6517 B10R1.10 CCSc1ccc[n+](c1)[O-] 62a_100000210202_100009815978 [1,1,0,0,0,0|1,1,0]=4 6518 B10R1.10 CCSc1cccc(=O)[nH]1 62a_100000210202_100000752884 [1,1,0,0,0,0|1,1,0]=4 6519 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,1,0,0,0,0|0,1,0]=3 6520 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,1,0,0,0,0|0,1,0]=3 6521 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,1,0,0,0,0|0,1,0]=3 6522 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,1,0,0,0,0|0,1,0]=3 6523 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,1,0,0,0,0|0,1,0]=3 6524 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,1,0,0,0,0|0,1,0]=3 6525 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,1,0,0,0,0|0,1,0]=3 6526 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,1,0,0,0,0|0,1,0]=3 6527 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,1,0,0,0,0|0,1,0]=3 6528 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,1,0,0,0,0|0,1,0]=3 6529 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,1,0,0,0,0|0,1,0]=3 6530 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,1,0,0,0,0|0,1,0]=3 6531 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,1,0,0,0,0|0,1,0]=3 6532 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,1,0,0,0,0|0,1,0]=3 6533 B10R1.10 CCSc1cccc(n1)Br 62a_100000210202_100000684672 [1,1,0,0,0,0|1,1,0]=4 6534 B10R1.10 CCSc1cccc(n1)Br 62a_100000684672_100000210202 [1,1,0,0,0,0|1,1,0]=4 6535 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [1,1,0,0,0,0|1,1,0]=4 6536 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [1,1,0,0,0,0|1,1,0]=4 6537 B10R1.10 CCSc1cccc(n1)Cl 62a_100000051397_100000210202 [1,1,0,0,0,0|1,1,0]=4 6538 B10R1.10 CCSc1cccc(n1)Cl 62a_100000210202_100000051397 [1,1,0,0,0,0|1,1,0]=4 6539 B10R1.10 CCSc1cccc(n1)F 62a_100000210202_100009815982 [1,1,0,0,0,0|1,1,0]=4 6540 B10R1.10 CCSc1cccc(n1)F 62a_100009815982_100000210202 [1,1,0,0,0,0|1,1,0]=4 6541 B10R1.10 CCSc1cccc(n1)N 62a_100000210202_100000740741 [1,1,0,0,0,0|1,1,0]=4 6542 B10R1.10 CCSc1cccc(n1)N 62a_100000740741_100000210202 [1,1,0,0,0,0|1,1,0]=4 6543 B10R1.10 CCSc1ccnc(c1)Br 62a_100000210202_100009814637 [1,1,0,0,0,0|1,1,0]=4 6544 B10R1.10 CCSc1ccnc(c1)Br 62a_100009814637_100000210202 [1,1,0,0,0,0|1,1,0]=4 6545 B10R1.10 CCSc1ccnc(c1)C 62a_100000210202_100000758586 [1,1,0,0,0,0|1,1,0]=4 6546 B10R1.10 CCSc1ccnc(c1)C 62a_100000758586_100000210202 [1,1,0,0,0,0|1,1,0]=4 6547 B10R1.10 CCSc1ccnc(c1)Cl 62a_100000035001_100000210202 [1,1,0,0,0,0|1,1,0]=4 6548 B10R1.10 CCSc1ccnc(c1)Cl 62a_100000210202_100000035001 [1,1,0,0,0,0|1,1,0]=4 6549 B10R1.10 CCSc1ccnc(c1)F 62a_100000210202_100009816116 [1,1,0,0,0,0|1,1,0]=4 6550 B10R1.10 CCSc1ccnc(c1)F 62a_100009816116_100000210202 [1,1,0,0,0,0|1,1,0]=4 6551 B10R1.10 CCSc1ccnc(c1)N 62a_100000049665_100000210202 [1,1,0,0,0,0|1,1,0]=4 6552 B10R1.10 CCSc1ccnc(c1)N 62a_100000210202_100000049665 [1,1,0,0,0,0|1,1,0]=4 6553 B10R1.10 CCSc1cncc(c1)Br 62a_100000210202_100000728054 [1,1,0,0,0,0|1,1,0]=4 6554 B10R1.10 CCSc1cncc(c1)Br 62a_100000728054_100000210202 [1,1,0,0,0,0|1,1,0]=4 6555 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [1,1,0,0,0,0|1,1,0]=4 6556 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [1,1,0,0,0,0|1,1,0]=4 6557 B10R1.10 CCSc1cncc(c1)Cl 62a_100000049639_100000210202 [1,1,0,0,0,0|1,1,0]=4 6558 B10R1.10 CCSc1cncc(c1)Cl 62a_100000210202_100000049639 [1,1,0,0,0,0|1,1,0]=4 6559 B10R1.10 CCSc1cncc(c1)F 62a_100000210202_100000744099 [1,1,0,0,0,0|1,1,0]=4 6560 B10R1.10 CCSc1cncc(c1)F 62a_100000744099_100000210202 [1,1,0,0,0,0|1,1,0]=4 6561 B10R1.10 CCSc1cncc(c1)N 62a_100000210202_100000687067 [1,1,0,0,0,0|1,1,0]=4 6562 B10R1.10 CCSc1cncc(c1)N 62a_100000687067_100000210202 [1,1,0,0,0,0|1,1,0]=4 6563 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [1,1,0,0,0,0|1,1,0]=4 6564 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [1,1,0,0,0,0|1,1,0]=4 6565 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,1,0,0,0,0|2,0,0]=4 6566 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,1,0,0,0,0|2,0,0]=4 6567 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,1,0,0,0,0|2,0,0]=4 6568 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,1,0,0,0,0|2,0,0]=4 6569 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,1,0,0,0,0|2,0,0]=4 6570 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,1,0,0,0,0|2,0,0]=4 6571 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,1,0,0,0,0|2,0,0]=4 6572 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,1,0,0,0,0|2,0,0]=4 6573 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,1,0,0,0,0|2,0,0]=4 6574 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,1,0,0,0,0|2,0,0]=4 6575 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,1,0,0,0,0|2,0,0]=4 6576 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,1,0,0,0,0|2,0,0]=4 6577 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,1,0,0,0,0|2,0,0]=4 6578 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,1,0,0,0,0|2,0,0]=4 6579 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,1,0,0,0,0|2,0,0]=4 6580 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,1,0,0,0,0|2,0,0]=4 6581 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,1,0,0,0,0|2,0,0]=4 6582 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,1,0,0,0,0|2,0,0]=4 6583 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,1,0,0,0,0|2,0,0]=4 6584 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,1,0,0,0,0|2,0,0]=4 6585 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,1,0,0,0,0|2,0,0]=4 6586 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,1,0,0,0,0|2,0,0]=4 6587 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,1,0,0,0,0|2,0,0]=4 6588 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,1,0,0,0,0|2,0,0]=4 6589 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,1,0,0,0,0|2,0,0]=4 6590 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,1,0,0,0,0|2,0,0]=4 6591 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,1,0,0,0,0|2,0,0]=4 6592 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,1,0,0,0,0|2,0,0]=4 6593 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,1,0,0,0,0|2,0,0]=4 6594 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,1,0,0,0,0|2,0,0]=4 6595 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,1,0,0,0,0|2,0,0]=4 6596 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,1,0,0,0,0|2,0,0]=4 6597 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,1,0,0,0,0|2,0,0]=4 6598 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,1,0,0,0,0|2,0,0]=4 6599 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,1,0,0,0,0|2,0,0]=4 6600 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,1,0,0,0,0|2,0,0]=4 6601 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,1,0,0,0,0|2,0,0]=4 6602 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,1,0,0,0,0|2,0,0]=4 6603 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,1,0,0,0,0|2,0,0]=4 6604 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,1,0,0,0,0|2,0,0]=4 6605 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,1,0,0,0,0|2,0,0]=4 6606 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,1,0,0,0,0|2,0,0]=4 6607 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,1,0,0,0,0|2,0,0]=4 6608 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,1,0,0,0,0|2,0,0]=4 6609 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,1,0,0,0,0|2,0,0]=4 6610 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,1,0,0,0,0|2,0,0]=4 6611 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,1,0,0,0,0|2,0,0]=4 6612 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,1,0,0,0,0|2,0,0]=4 6613 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,1,0,0,0,0|2,0,0]=4 6614 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,1,0,0,0,0|2,0,0]=4 6615 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,1,0,0,0,0|2,0,0]=4 6616 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,1,0,0,0,0|2,0,0]=4 6617 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,1,0,0,0,0|2,0,0]=4 6618 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,1,0,0,0,0|2,0,0]=4 6619 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,1,0,0,0,0|2,0,0]=4 6620 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,1,0,0,0,0|2,0,0]=4 6621 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,1,0,0,0,0|2,0,0]=4 6622 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,1,0,0,0,0|2,0,0]=4 6623 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,1,0,0,0,0|2,0,0]=4 6624 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,1,0,0,0,0|2,0,0]=4 6625 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,1,0,0,0,0|2,0,0]=4 6626 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,1,0,0,0,0|2,0,0]=4 6627 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,1,0,0,0,0|2,0,0]=4 6628 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,1,0,0,0,0|2,0,0]=4 6629 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,1,0,0,0,0|2,0,0]=4 6630 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,1,0,0,0,0|2,0,0]=4 6631 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,1,0,0,0,0|2,0,0]=4 6632 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,1,0,0,0,0|2,0,0]=4 6633 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,1,0,0,0,0|2,0,0]=4 6634 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,1,0,0,0,0|2,0,0]=4 6635 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,1,0,0,0,0|2,0,0]=4 6636 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,1,0,0,0,0|2,0,0]=4 6637 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,1,0,0,0,0|2,0,0]=4 6638 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,1,0,0,0,0|2,0,0]=4 6639 B10R1.10 Cc1cc(ccn1)OCF 34a_100000688365_100015361967 [1,1,0,0,0,0|2,0,0]=4 6640 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,1,0,0,0,0|2,0,0]=4 6641 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,1,0,0,0,0|2,0,0]=4 6642 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,1,0,0,0,0|2,0,0]=4 6643 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,1,0,0,0,0|2,0,0]=4 6644 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,1,0,0,0,0|2,0,0]=4 6645 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,1,0,0,0,0|2,0,0]=4 6646 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [1,1,0,0,0,0|2,0,0]=4 6647 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [1,1,0,0,0,0|1,0,0]=3 6648 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [1,1,0,0,0,0|1,0,0]=3 6649 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [1,1,0,0,0,0|1,1,0]=4 6650 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [1,1,0,0,0,0|1,1,0]=4 6651 B10R1.10 Cc1cncc(c1)OCF 34a_100011830280_100015361967 [1,1,0,0,0,0|2,0,0]=4 6652 B10R1.10 Cc1cncc(c1)OCF 7a_100011830280_100015361967 [1,1,0,0,0,0|2,0,0]=4 6653 B10R1.10 FCNc1cccc(c1)Br 34a_100000210019_100015361967 [1,1,0,0,0,0|2,0,0]=4 6654 B10R1.10 FCNc1cccc(c1)Cl 34a_100000185859_100015361967 [1,1,0,0,0,0|2,0,0]=4 6655 B10R1.10 FCNc1cccc(c1)F 34a_100000210047_100015361967 [1,1,0,0,0,0|2,0,0]=4 6656 B10R1.10 FCNc1cccc(c1)I 34a_100000211102_100015361967 [1,1,0,0,0,0|2,0,0]=4 6657 B10R1.10 FCOc1cccc(c1)Br 34a_100000210342_100015361967 [1,1,0,0,0,0|1,0,0]=3 6658 B10R1.10 FCOc1cccc(c1)Br 7a_100000210342_100015361967 [1,1,0,0,0,0|1,0,0]=3 6659 B10R1.10 FCOc1cccc(c1)Cl 34a_100000210295_100015361967 [1,1,0,0,0,0|1,0,0]=3 6660 B10R1.10 FCOc1cccc(c1)Cl 7a_100000210295_100015361967 [1,1,0,0,0,0|1,0,0]=3 6661 B10R1.10 FCOc1cccc(c1)F 34a_100000210426_100015361967 [1,1,0,0,0,0|1,0,0]=3 6662 B10R1.10 FCOc1cccc(c1)F 7a_100000210426_100015361967 [1,1,0,0,0,0|1,0,0]=3 6663 B10R1.10 FCOc1cccc(c1)I 34a_100000211634_100015361967 [1,1,0,0,0,0|1,0,0]=3 6664 B10R1.10 FCOc1cccc(c1)I 7a_100000211634_100015361967 [1,1,0,0,0,0|1,0,0]=3 6665 B10R1.10 FCOc1cccc(n1)F 34a_100011432558_100015361967 [1,1,0,0,0,0|2,0,0]=4 6666 B10R1.10 FCOc1ccnc(c1)Cl 34a_100000762945_100015361967 [1,1,0,0,0,0|2,0,0]=4 6667 B10R1.10 FCOc1ccnc(c1)F 34a_100000732698_100015361967 [1,1,0,0,0,0|2,0,0]=4 6668 B10R1.10 FCOc1cncc(c1)Br 34a_100000754920_100015361967 [1,1,0,0,0,0|2,0,0]=4 6669 B10R1.10 FCOc1cncc(c1)Br 7a_100000754920_100015361967 [1,1,0,0,0,0|2,0,0]=4 6670 B10R1.10 FCOc1cncc(c1)Cl 7a_100000032511_100015361967 [1,1,0,0,0,0|2,0,0]=4 6671 B10R1.10 FCOc1cncc(c1)F 34a_100011830296_100015361967 [1,1,0,0,0,0|2,0,0]=4 6672 B10R1.10 FCOc1cncc(c1)F 7a_100011830296_100015361967 [1,1,0,0,0,0|2,0,0]=4 6673 B10R1.10 FCSc1cccc(c1)Br 62a_100000691529_100015361967 [1,1,0,0,0,0|1,1,0]=4 6674 B10R1.10 FCSc1cccc(c1)Br 62a_100015361967_100000691529 [1,1,0,0,0,0|1,1,0]=4 6675 B10R1.10 FCSc1cccc(c1)Cl 62a_100000699651_100015361967 [1,1,0,0,0,0|1,1,0]=4 6676 B10R1.10 FCSc1cccc(c1)Cl 62a_100015361967_100000699651 [1,1,0,0,0,0|1,1,0]=4 6677 B10R1.10 FCSc1cccc(c1)F 62a_100000685547_100015361967 [1,1,0,0,0,0|1,1,0]=4 6678 B10R1.10 FCSc1cccc(c1)F 62a_100015361967_100000685547 [1,1,0,0,0,0|1,1,0]=4 6679 B10R1.10 FCSc1cccc(c1)[S] 62a_100015361967_114929384022 [1,1,0,0,0,0|1,1,0]=4 6680 B10R1.10 FCSc1cccc(c1)[S] 62a_114929384022_100015361967 [1,1,0,0,0,0|1,1,0]=4 6681 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,1,0,0,0,0|2,0,0]=4 6682 B10R1.10 Nc1cc(ccn1)OCF 34a_100011834064_100015361967 [1,1,0,0,0,0|2,0,0]=4 6683 B10R1.10 Nc1cccc(c1)OCF 34a_100000210217_100015361967 [1,1,0,0,0,0|1,0,0]=3 6684 B10R1.10 Nc1cccc(c1)SCF 62a_100000210019_100015361967 [1,1,0,0,0,0|1,1,0]=4 6685 B10R1.10 Nc1cccc(c1)SCF 62a_100015361967_100000210019 [1,1,0,0,0,0|1,1,0]=4 6686 B10R1.10 Nc1cncc(c1)OCF 34a_100011997051_100015361967 [1,1,0,0,0,0|2,0,0]=4 6687 B10R1.10 O=c1cc(cc[nH]1)OCF 34a_100000032262_100015361967 [1,1,0,0,0,0|2,0,0]=4 6688 B10R1.10 O=c1cccc([nH]1)OCF 34a_100000033347_100015361967 [1,1,0,0,0,0|2,0,0]=4 6689 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,1,0,0,0,0|2,0,0]=4 6690 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [1,1,0,0,0,0|2,0,0]=4 6691 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [1,1,0,0,0,0|1,1,0]=4 6692 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,1,0,0,0,0|2,0,0]=4 6693 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,1,0,0,0,0|2,0,0]=4 6694 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,1,0,0,0,0|2,0,0]=4 6695 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,1,0,0,0,0|2,0,0]=4 6696 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,1,0,0,0,0|2,0,0]=4 6697 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,1,0,0,0,0|2,0,0]=4 6698 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,1,0,0,0,0|2,0,0]=4 6699 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,1,0,0,0,0|2,0,0]=4 6700 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,1,0,0,0,0|2,0,0]=4 6701 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,1,0,0,0,0|2,0,0]=4 6702 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,1,0,0,0,0|2,0,0]=4 6703 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,1,0,0,0,0|2,0,0]=4 6704 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,1,0,0,0,0|2,0,0]=4 6705 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,1,0,0,0,0|2,0,0]=4 6706 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,1,0,0,0,0|2,0,0]=4 6707 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,1,0,0,0,0|2,0,0]=4 6708 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,1,0,0,0,0|2,0,0]=4 6709 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,1,0,0,0,0|2,0,0]=4 6710 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,1,0,0,0,0|2,0,0]=4 6711 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,1,0,0,0,0|2,0,0]=4 6712 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,1,0,0,0,0|2,0,0]=4 6713 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,1,0,0,0,0|2,0,0]=4 6714 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,1,0,0,0,0|2,0,0]=4 6715 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,1,0,0,0,0|2,0,0]=4 6716 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,1,0,0,0,0|2,0,0]=4 6717 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,1,0,0,0,0|2,0,0]=4 6718 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,1,0,0,0,0|2,0,0]=4 6719 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,1,0,0,0,0|2,0,0]=4 6720 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,1,0,0,0,0|2,0,0]=4 6721 B10R1.10 [O-][n+]1cccc(c1)OCF 34a_100000039713_100015361967 [1,1,0,0,0,0|2,0,0]=4 6722 B10R1.10 [O-][n+]1cccc(c1)OCF 7a_100000039713_100015361967 [1,1,0,0,0,0|2,0,0]=4 6723 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|2,0,0]=4 6724 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|2,0,0]=4 6725 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,1,0,0,0,0|1,0,0]=3 6726 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,1,0,0,0,0|1,0,0]=3 6727 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,1,0,0,0,0|1,0,0]=3 6728 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,1,0,0,0,0|1,0,0]=3 6729 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,1,0,0,0,0|1,0,0]=3 6730 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,1,0,0,0,0|1,0,0]=3 6731 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,1,0,0,0,0|1,0,0]=3 6732 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,1,0,0,0,0|1,0,0]=3 6733 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,1,0,0,0,0|1,0,0]=3 6734 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,1,0,0,0,0|1,0,0]=3 6735 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 6736 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 6737 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,1,0,0,0,0|2,0,0]=4 6738 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,1,0,0,0,0|2,0,0]=4 6739 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,1,0,0,0,0|2,0,0]=4 6740 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,1,0,0,0,0|2,0,0]=4 6741 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|2,0,0]=4 6742 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|2,0,0]=4 6743 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|2,0,0]=4 6744 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|2,0,0]=4 6745 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|2,0,0]=4 6746 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|2,0,0]=4 6747 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|2,0,0]=4 6748 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|2,0,0]=4 6749 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|2,0,0]=4 6750 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|2,0,0]=4 6751 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|2,0,0]=4 6752 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|2,0,0]=4 6753 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|2,0,0]=4 6754 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,1,0,0,0,0|2,0,0]=4 6755 B10R1.17 C#CCNc1ccccc1 34a_100000106764_100000184674 [1,1,0,0,0,0|1,0,1]=4 6756 B10R1.17 C#CCOc1ccccc1 34a_100000210340_100000184674 [1,1,0,0,0,0|0,0,1]=3 6757 B10R1.17 C#CCOc1ccccc1 7a_100000210340_100000038162 [1,1,0,0,0,0|0,0,1]=3 6758 B10R1.17 C#CCOc1cccnc1 34a_100000210849_100000184674 [1,1,0,0,0,0|1,0,1]=4 6759 B10R1.17 C#CCOc1cccnc1 7a_100000210849_100000038162 [1,1,0,0,0,0|1,0,1]=4 6760 B10R1.17 C#CCOc1ccncc1 34a_100000212176_100000184674 [1,1,0,0,0,0|1,0,1]=4 6761 B10R1.17 C#CCSc1ccccc1 62a_100000038162_100000041952 [1,1,0,0,0,0|0,1,1]=4 6762 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,1,0,0,0,0|1,0,1]=4 6763 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,1,0,0,0,0|0,0,1]=3 6764 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,1,0,0,0,0|0,0,1]=3 6765 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [1,1,0,0,0,0|1,0,1]=4 6766 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [1,1,0,0,0,0|1,0,1]=4 6767 B10R1.17 C=CCOc1ccncc1 34a_100000212176_100015514636 [1,1,0,0,0,0|1,0,1]=4 6768 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,1,0,0,0,0|0,1,1]=4 6769 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,1,0,0,0,0|0,1,1]=4 6770 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [1,1,0,0,0,0|1,0,1]=4 6771 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [1,1,0,0,0,0|1,0,0]=3 6772 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [1,1,0,0,0,0|2,0,0]=4 6773 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [1,1,0,0,0,0|2,0,0]=4 6774 B10R1.17 CCCCc1ccncc1 271570a_100020621405_100000035832 [1,1,0,0,0,0|2,0,0]=4 6775 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [1,1,0,0,0,0|1,0,0]=3 6776 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [1,1,0,0,0,0|0,0,0]=2 6777 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [1,1,0,0,0,0|0,0,0]=2 6778 B10R1.17 CCCOc1cccnc1 34a_100000210849_100000210303 [1,1,0,0,0,0|1,0,0]=3 6779 B10R1.17 CCCOc1cccnc1 7a_100000210849_100000210303 [1,1,0,0,0,0|1,0,0]=3 6780 B10R1.17 CCCOc1ccncc1 34a_100000212176_100000210303 [1,1,0,0,0,0|1,0,0]=3 6781 B10R1.17 CCCOc1ccnnc1 34a_100015204005_100000210303 [1,1,0,0,0,0|2,0,0]=4 6782 B10R1.17 CCCOc1cncnc1 7a_100000754086_100000210303 [1,1,0,0,0,0|2,0,0]=4 6783 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [1,1,0,0,0,0|0,1,0]=3 6784 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [1,1,0,0,0,0|0,1,0]=3 6785 B10R1.17 CCCSc1ccccn1 62a_100000210303_100011216584 [1,1,0,0,0,0|1,1,0]=4 6786 B10R1.17 CCCSc1ccccn1 62a_100011216584_100000210303 [1,1,0,0,0,0|1,1,0]=4 6787 B10R1.17 CCCSc1cccnc1 62a_100000210063_100000210303 [1,1,0,0,0,0|1,1,0]=4 6788 B10R1.17 CCCSc1cccnc1 62a_100000210303_100000210063 [1,1,0,0,0,0|1,1,0]=4 6789 B10R1.17 CCCSc1ccncc1 62a_100000210303_100000728582 [1,1,0,0,0,0|1,1,0]=4 6790 B10R1.17 CCCSc1ccncc1 62a_100000728582_100000210303 [1,1,0,0,0,0|1,1,0]=4 6791 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [1,1,0,0,0,0|1,0,0]=3 6792 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [1,1,0,0,0,0|1,0,0]=3 6793 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [1,1,0,0,0,0|1,0,0]=3 6794 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [1,1,0,0,0,0|1,0,0]=3 6795 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [1,1,0,0,0,0|1,0,0]=3 6796 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [1,1,0,0,0,0|2,0,0]=4 6797 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [1,1,0,0,0,0|2,0,0]=4 6798 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [1,1,0,0,0,0|2,0,0]=4 6799 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [1,1,0,0,0,0|2,0,0]=4 6800 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [1,1,0,0,0,0|2,0,0]=4 6801 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [1,1,0,0,0,0|2,0,0]=4 6802 B10R1.17 CCNCc1ccncc1 207a_100015525214_100000186114 [1,1,0,0,0,0|2,0,0]=4 6803 B10R1.17 CCNCc1ccncc1 2230a_100015525214_100015193705 [1,1,0,0,0,0|2,0,0]=4 6804 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [1,1,0,0,0,0|0,0,0]=2 6805 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [1,1,0,0,0,0|0,0,0]=2 6806 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [1,1,0,0,0,0|0,0,0]=2 6807 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [1,1,0,0,0,0|1,0,0]=3 6808 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [1,1,0,0,0,0|1,0,0]=3 6809 B10R1.17 CCOCc1cccnn1 34a_100121572206_100016990269 [1,1,0,0,0,0|2,0,0]=4 6810 B10R1.17 CCOCc1cnccn1 34a_100121572206_100016995436 [1,1,0,0,0,0|2,0,0]=4 6811 B10R1.17 CCOCc1cncnc1 34a_100121572206_100015196519 [1,1,0,0,0,0|2,0,0]=4 6812 B10R1.17 CCOCc1ncccn1 34a_100121572206_100000703007 [1,1,0,0,0,0|2,0,0]=4 6813 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [1,1,0,0,0,0|0,1,0]=3 6814 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [1,1,0,0,0,0|0,1,0]=3 6815 B10R1.17 CCSCc1ccccn1 62a_100000210202_100000721315 [1,1,0,0,0,0|1,1,0]=4 6816 B10R1.17 CCSCc1ccccn1 62a_100000721315_100000210202 [1,1,0,0,0,0|1,1,0]=4 6817 B10R1.17 CCSCc1cccnc1 62a_100000210202_100000741622 [1,1,0,0,0,0|1,1,0]=4 6818 B10R1.17 CCSCc1cccnc1 62a_100000741622_100000210202 [1,1,0,0,0,0|1,1,0]=4 6819 B10R1.17 CCSCc1ccncc1 62a_100000210202_100015193705 [1,1,0,0,0,0|1,1,0]=4 6820 B10R1.17 CCSCc1ccncc1 62a_100015193705_100000210202 [1,1,0,0,0,0|1,1,0]=4 6821 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [1,1,0,0,0,0|1,0,0]=3 6822 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [1,1,0,0,0,0|1,0,0]=3 6823 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [1,1,0,0,0,0|1,0,0]=3 6824 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [1,1,0,0,0,0|1,0,0]=3 6825 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [1,1,0,0,0,0|1,0,0]=3 6826 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [1,1,0,0,0,0|2,0,0]=4 6827 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [1,1,0,0,0,0|2,0,0]=4 6828 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [1,1,0,0,0,0|2,0,0]=4 6829 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [1,1,0,0,0,0|2,0,0]=4 6830 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [1,1,0,0,0,0|2,0,0]=4 6831 B10R1.17 CNCCc1ccncc1 2230a_106832991635_100000723409 [1,1,0,0,0,0|2,0,0]=4 6832 B10R1.17 CNCCc1ccncc1 7a_106832991635_100000723409 [1,1,0,0,0,0|2,0,0]=4 6833 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [1,1,0,0,0,0|0,1,0]=3 6834 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [1,1,0,0,0,0|1,0,0]=3 6835 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [1,1,0,0,0,0|1,0,0]=3 6836 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [1,1,0,0,0,0|1,0,0]=3 6837 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [1,1,0,0,0,0|2,0,0]=4 6838 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [1,1,0,0,0,0|2,0,0]=4 6839 B10R1.17 COCCc1ccncc1 34a_100011216225_200000210301 [1,1,0,0,0,0|2,0,0]=4 6840 B10R1.17 COCSc1ccccc1 62a_100000719477_100000766300 [1,1,0,0,0,0|0,1,0]=3 6841 B10R1.17 COCSc1ccccc1 62a_100000766300_100000041952 [1,1,0,0,0,0|0,1,0]=3 6842 B10R1.17 COCSc1ccccn1 62a_100000766300_100011216584 [1,1,0,0,0,0|1,1,0]=4 6843 B10R1.17 COCSc1ccccn1 62a_100011216584_100000766300 [1,1,0,0,0,0|1,1,0]=4 6844 B10R1.17 COCSc1cccnc1 62a_100000210063_100000766300 [1,1,0,0,0,0|1,1,0]=4 6845 B10R1.17 COCSc1cccnc1 62a_100000766300_100000210063 [1,1,0,0,0,0|1,1,0]=4 6846 B10R1.17 COCSc1ccncc1 62a_100000728582_100000766300 [1,1,0,0,0,0|1,1,0]=4 6847 B10R1.17 COCSc1ccncc1 62a_100000766300_100000728582 [1,1,0,0,0,0|1,1,0]=4 6848 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [1,1,0,0,0,0|1,0,0]=3 6849 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [1,1,0,0,0,0|1,0,0]=3 6850 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [1,1,0,0,0,0|2,0,0]=4 6851 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [1,1,0,0,0,0|2,0,0]=4 6852 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [1,1,0,0,0,0|2,0,0]=4 6853 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [1,1,0,0,0,0|2,0,0]=4 6854 B10R1.17 CSCCc1ccncc1 62a_100000723409_200000210301 [1,1,0,0,0,0|2,0,0]=4 6855 B10R1.17 CSCCc1ccncc1 62a_200000210301_100000723409 [1,1,0,0,0,0|2,0,0]=4 6856 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [1,1,0,0,0,0|1,0,0]=3 6857 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [1,1,0,0,0,0|0,0,0]=2 6858 B10R1.17 CSCOc1cccnc1 34a_100000210849_100011218213 [1,1,0,0,0,0|1,0,0]=3 6859 B10R1.17 CSCOc1ccncc1 34a_100000212176_100011218213 [1,1,0,0,0,0|1,0,0]=3 6860 B10R1.17 CSCOc1ccnnc1 34a_100015204005_100011218213 [1,1,0,0,0,0|2,0,0]=4 6861 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [1,1,0,0,0,0|0,1,0]=3 6862 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [1,1,0,0,0,0|0,1,0]=3 6863 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [1,1,0,0,0,0|0,1,0]=3 6864 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [1,1,0,0,0,0|0,1,0]=3 6865 B10R1.17 CSCSc1ccccn1 62a_100011216584_100011218213 [1,1,0,0,0,0|1,1,0]=4 6866 B10R1.17 CSCSc1ccccn1 62a_100011218213_100011216584 [1,1,0,0,0,0|1,1,0]=4 6867 B10R1.17 CSCSc1cccnc1 62a_100000210063_100011218213 [1,1,0,0,0,0|1,1,0]=4 6868 B10R1.17 CSCSc1cccnc1 62a_100011218213_100000210063 [1,1,0,0,0,0|1,1,0]=4 6869 B10R1.17 CSCSc1ccncc1 62a_100000728582_100011218213 [1,1,0,0,0,0|1,1,0]=4 6870 B10R1.17 CSCSc1ccncc1 62a_100011218213_100000728582 [1,1,0,0,0,0|1,1,0]=4 6871 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [1,1,0,0,0,0|1,0,0]=3 6872 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [1,1,0,0,0,0|0,0,0]=2 6873 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [1,1,0,0,0,0|0,0,0]=2 6874 B10R1.17 FCCOc1cccnc1 34a_100000210849_100011217306 [1,1,0,0,0,0|1,0,0]=3 6875 B10R1.17 FCCOc1cccnc1 7a_100000210849_100011217306 [1,1,0,0,0,0|1,0,0]=3 6876 B10R1.17 FCCOc1ccncc1 34a_100000212176_100011217306 [1,1,0,0,0,0|1,0,0]=3 6877 B10R1.17 FCCOc1ccnnc1 34a_100015204005_100011217306 [1,1,0,0,0,0|2,0,0]=4 6878 B10R1.17 FCCOc1cncnc1 7a_100000754086_100011217306 [1,1,0,0,0,0|2,0,0]=4 6879 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [1,1,0,0,0,0|0,1,0]=3 6880 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [1,1,0,0,0,0|0,1,0]=3 6881 B10R1.17 FCCSc1ccccn1 62a_100011216584_100011217306 [1,1,0,0,0,0|1,1,0]=4 6882 B10R1.17 FCCSc1ccccn1 62a_100011217306_100011216584 [1,1,0,0,0,0|1,1,0]=4 6883 B10R1.17 FCCSc1cccnc1 62a_100000210063_100011217306 [1,1,0,0,0,0|1,1,0]=4 6884 B10R1.17 FCCSc1cccnc1 62a_100011217306_100000210063 [1,1,0,0,0,0|1,1,0]=4 6885 B10R1.17 FCCSc1ccncc1 62a_100000728582_100011217306 [1,1,0,0,0,0|1,1,0]=4 6886 B10R1.17 FCCSc1ccncc1 62a_100011217306_100000728582 [1,1,0,0,0,0|1,1,0]=4 6887 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [1,1,0,0,0,0|2,0,0]=4 6888 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [1,1,0,0,0,0|1,0,0]=3 6889 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [1,1,0,0,0,0|1,0,0]=3 6890 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [1,1,0,0,0,0|1,1,0]=4 6891 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [1,1,0,0,0,0|1,1,0]=4 6892 B10R1.17 N#CCOc1ccccc1 7a_100000210340_100011215382 [1,1,0,0,0,0|0,0,1]=3 6893 B10R1.17 N#CCOc1cccnc1 7a_100000210849_100011215382 [1,1,0,0,0,0|1,0,1]=4 6894 B10R1.17 N#CCSc1ccccc1 62a_100000719477_100011215382 [1,1,0,0,0,0|0,1,1]=4 6895 B10R1.17 N#CCSc1ccccc1 62a_100011215382_100000041952 [1,1,0,0,0,0|0,1,1]=4 6896 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [1,1,0,0,0,0|1,0,1]=4 6897 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [1,1,0,0,0,0|0,0,1]=3 6898 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [1,1,0,0,0,0|0,0,1]=3 6899 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [1,1,0,0,0,0|1,0,1]=4 6900 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [1,1,0,0,0,0|1,0,1]=4 6901 B10R1.17 O=CCOc1ccncc1 34a_100000212176_200009817547 [1,1,0,0,0,0|1,0,1]=4 6902 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [1,1,0,0,0,0|0,1,1]=4 6903 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [1,1,0,0,0,0|0,1,1]=4 6904 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [1,1,0,0,0,0|1,0,0]=3 6905 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [1,1,0,0,0,0|0,0,0]=2 6906 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [1,1,0,0,0,0|0,0,0]=2 6907 B10R1.17 OCCOc1cccnc1 34a_100000210849_100000211926 [1,1,0,0,0,0|1,0,0]=3 6908 B10R1.17 OCCOc1cccnc1 7a_100000210849_100000211926 [1,1,0,0,0,0|1,0,0]=3 6909 B10R1.17 OCCOc1ccncc1 34a_100000212176_100000211926 [1,1,0,0,0,0|1,0,0]=3 6910 B10R1.17 OCCOc1ccnnc1 34a_100015204005_100000211926 [1,1,0,0,0,0|2,0,0]=4 6911 B10R1.17 OCCOc1cncnc1 7a_100000754086_100000211926 [1,1,0,0,0,0|2,0,0]=4 6912 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [1,1,0,0,0,0|0,1,0]=3 6913 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [1,1,0,0,0,0|0,1,0]=3 6914 B10R1.17 OCCSc1ccccn1 62a_100000211926_100011216584 [1,1,0,0,0,0|1,1,0]=4 6915 B10R1.17 OCCSc1ccccn1 62a_100011216584_100000211926 [1,1,0,0,0,0|1,1,0]=4 6916 B10R1.17 OCCSc1cccnc1 62a_100000210063_100000211926 [1,1,0,0,0,0|1,1,0]=4 6917 B10R1.17 OCCSc1cccnc1 62a_100000211926_100000210063 [1,1,0,0,0,0|1,1,0]=4 6918 B10R1.17 OCCSc1ccncc1 62a_100000211926_100000728582 [1,1,0,0,0,0|1,1,0]=4 6919 B10R1.17 OCCSc1ccncc1 62a_100000728582_100000211926 [1,1,0,0,0,0|1,1,0]=4 6920 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [1,1,0,0,0,0|1,0,0]=3 6921 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [1,1,0,0,0,0|1,0,0]=3 6922 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [1,1,0,0,0,0|2,0,0]=4 6923 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [1,1,0,0,0,0|1,0,0]=3 6924 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [1,1,0,0,0,0|1,0,0]=3 6925 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [1,1,0,0,0,0|2,0,0]=4 6926 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [1,1,0,0,0,0|2,0,0]=4 6927 B10R1.17 [13CH3]OCCc1ccncc1 34a_100011216225_200025704644 [1,1,0,0,0,0|2,0,0]=4 6928 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [1,1,0,0,0,0|1,0,0]=3 6929 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [1,1,0,0,0,0|1,0,0]=3 6930 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [1,1,0,0,0,0|2,0,0]=4 6931 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [1,1,0,0,0,0|2,0,0]=4 6932 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [1,1,0,0,0,0|2,0,0]=4 6933 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [1,1,0,0,0,0|2,0,0]=4 6934 B10R1.17 [13CH3]SCCc1ccncc1 62a_100000723409_200025704644 [1,1,0,0,0,0|2,0,0]=4 6935 B10R1.17 [13CH3]SCCc1ccncc1 62a_200025704644_100000723409 [1,1,0,0,0,0|2,0,0]=4 6936 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [1,1,0,0,0,0|0,1,0]=3 6937 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [1,1,0,0,0,0|0,1,0]=3 6938 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,1,0,0,0,0|1,0,1]=4 6939 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,1,0,0,0,0|1,0,1]=4 6940 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,1,0,0,0,0|1,0,1]=4 6941 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,1,0,0,0,0|1,0,1]=4 6942 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,1,0,0,0,0|1,0,1]=4 6943 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,1,0,0,0,0|1,0,1]=4 6944 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,1,0,0,0,0|1,0,0]=3 6945 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,1,0,0,0,0|0,0,0]=2 6946 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,1,0,0,0,0|0,0,0]=2 6947 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [1,1,0,0,0,0|1,0,0]=3 6948 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [1,1,0,0,0,0|1,0,0]=3 6949 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [1,1,0,0,0,0|1,0,0]=3 6950 B10R1.18 CC(C)Oc1ccnnc1 34a_100015204005_100000210206 [1,1,0,0,0,0|2,0,0]=4 6951 B10R1.18 CC(C)Oc1cncnc1 7a_100000754086_100000210206 [1,1,0,0,0,0|2,0,0]=4 6952 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,1,0,0,0,0|0,1,0]=3 6953 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,1,0,0,0,0|0,1,0]=3 6954 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [1,1,0,0,0,0|1,1,0]=4 6955 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [1,1,0,0,0,0|1,1,0]=4 6956 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [1,1,0,0,0,0|1,1,0]=4 6957 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [1,1,0,0,0,0|1,1,0]=4 6958 B10R1.18 CC(C)Sc1ccncc1 62a_100000210206_100000728582 [1,1,0,0,0,0|1,1,0]=4 6959 B10R1.18 CC(C)Sc1ccncc1 62a_100000728582_100000210206 [1,1,0,0,0,0|1,1,0]=4 6960 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,1,0,0,0,0|2,0,0]=4 6961 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,1,0,0,0,0|2,0,0]=4 6962 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,1,0,0,0,0|2,0,0]=4 6963 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,1,0,0,0,0|2,0,0]=4 6964 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,1,0,0,0,0|2,0,0]=4 6965 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,1,0,0,0,0|2,0,0]=4 6966 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,1,0,0,0,0|2,0,0]=4 6967 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,1,0,0,1,0|2,0,0]=4 6968 B10R1.16 CCOCc1cc(cs1)Br 34a_100000238369_100000210202 [0,1,0,0,1,0|2,0,0]=4 6969 B10R1.16 CCOCc1cc(cs1)Br 34a_100121572206_100000746031 [0,1,0,0,1,0|2,0,0]=4 6970 B10R1.16 CCOCc1cc(cs1)Br 7a_100000238369_100000210202 [0,1,0,0,1,0|2,0,0]=4 6971 B10R1.16 CCOCc1cc(cs1)C 34a_200000068372_100000210202 [0,1,0,0,1,0|2,0,0]=4 6972 B10R1.16 CCOCc1cc(cs1)C 7a_200000068372_100000210202 [0,1,0,0,1,0|2,0,0]=4 6973 B10R1.16 CCOCc1cc(cs1)O 271570a_203496583355_100011542529 [0,1,0,0,1,0|1,0,0]=3 6974 B10R1.16 CCOCc1ccc(o1)Br 34a_100000246276_100000210202 [0,1,0,0,1,0|2,0,0]=4 6975 B10R1.16 CCOCc1ccc(o1)Br 7a_100000246276_100000210202 [0,1,0,0,1,0|2,0,0]=4 6976 B10R1.16 CCOCc1ccc(o1)C 34a_100011232665_100000210202 [0,1,0,0,1,0|2,0,0]=4 6977 B10R1.16 CCOCc1ccc(o1)C 7a_100011232665_100000210202 [0,1,0,0,1,0|2,0,0]=4 6978 B10R1.16 CCOCc1ccc(s1)Br 34a_100121572206_100000708592 [0,1,0,0,1,0|2,0,0]=4 6979 B10R1.16 CCOCc1ccc(s1)C 34a_100000238367_100000210202 [0,1,0,0,1,0|2,0,0]=4 6980 B10R1.16 CCOCc1ccc(s1)Cl 34a_100121572206_100000185097 [0,1,0,0,1,0|2,0,0]=4 6981 B10R1.16 CCOCc1csc(c1)Cl 34a_100009863405_100000210202 [0,1,0,0,1,0|2,0,0]=4 6982 B10R1.16 CCOCc1csc(c1)Cl 7a_100009863405_100000210202 [0,1,0,0,1,0|2,0,0]=4 6983 B10R1.54 CC(C)Oc1ncc(s1)O 271570a_203496583355_100010238083 [0,1,0,0,1,0|2,0,0]=4 6984 B10R1.96 CCSc1ccc(o1)CO 62a_100000210202_100000246276 [0,1,0,0,1,0|1,1,0]=4 6985 B10R1.96 CCSc1ccc(o1)CO 62a_100000246276_100000210202 [0,1,0,0,1,0|1,1,0]=4 6986 B10R1.96 CCSc1ccc(s1)CO 62a_100000210202_100000246291 [0,1,0,0,1,0|1,1,0]=4 6987 B10R1.96 CCSc1ccc(s1)CO 62a_100000246291_100000210202 [0,1,0,0,1,0|1,1,0]=4 6988 B10R1.96 CCSc1csc(c1)CO 62a_100000210202_100000238369 [0,1,0,0,1,0|1,1,0]=4 6989 B10R1.96 CCSc1csc(c1)CO 62a_100000238369_100000210202 [0,1,0,0,1,0|1,1,0]=4 6990 B12R1.1 BrCCOCc1ccc(cc1)Br 34a_100000211926_100000189115 [0,2,0,0,0,0|1,0,0]=3 6991 B12R1.1 BrCCOCc1ccc(cc1)I 34a_100000211926_100000189116 [0,2,0,0,0,0|1,0,0]=3 6992 B12R1.1 BrCCOCc1ccc(cn1)Br 34a_100000211926_100000702658 [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.1 BrCCOCc1ccc(nc1)Br 34a_100000211926_100009831999 [0,2,0,0,0,0|2,0,0]=4 6994 B12R1.1 C#CCCNc1ccc(cc1)Br 2230a_100000210018_100000688953 [0,2,0,0,0,0|2,0,0]=4 6995 B12R1.1 C#CCCNc1ccc(cc1)Br 34a_100000210018_100000688953 [0,2,0,0,0,0|2,0,0]=4 6996 B12R1.1 C#CCCNc1ccc(cc1)C 34a_100000124888_100000688953 [0,2,0,0,0,0|2,0,0]=4 6997 B12R1.1 C#CCCNc1ccc(cc1)Cl 2230a_100000210052_100000688953 [0,2,0,0,0,0|2,0,0]=4 6998 B12R1.1 C#CCCNc1ccc(cc1)Cl 34a_100000210052_100000688953 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.1 C#CCCNc1ccc(cc1)F 34a_100000185862_100000688953 [0,2,0,0,0,0|2,0,0]=4 7000 B12R1.1 C#CCCNc1ccc(cc1)I 34a_100000185761_100000688953 [0,2,0,0,0,0|2,0,0]=4 7001 B12R1.1 C#CCCNc1ccc(cc1)O 34a_100000185829_100000688953 [0,2,0,0,0,0|1,0,0]=3 7002 B12R1.1 C#CCCOc1ccc(=O)[nH]c1 34a_100000075641_100000688953 [0,2,0,0,0,0|1,0,1]=4 7003 B12R1.1 C#CCCOc1ccc(cc1)Br 34a_100000185759_100000688953 [0,2,0,0,0,0|1,0,0]=3 7004 B12R1.1 C#CCCOc1ccc(cc1)Br 7a_100000185759_100000688953 [0,2,0,0,0,0|1,0,0]=3 7005 B12R1.1 C#CCCOc1ccc(cc1)C 34a_100000210336_100000688953 [0,2,0,0,0,0|1,0,0]=3 7006 B12R1.1 C#CCCOc1ccc(cc1)C 7a_100000210336_100000688953 [0,2,0,0,0,0|1,0,0]=3 7007 B12R1.1 C#CCCOc1ccc(cc1)Cl 34a_100000210216_100000688953 [0,2,0,0,0,0|1,0,0]=3 7008 B12R1.1 C#CCCOc1ccc(cc1)Cl 7a_100000210216_100000688953 [0,2,0,0,0,0|1,0,0]=3 7009 B12R1.1 C#CCCOc1ccc(cc1)F 34a_100000210339_100000688953 [0,2,0,0,0,0|1,0,0]=3 7010 B12R1.1 C#CCCOc1ccc(cc1)I 34a_100000212066_100000688953 [0,2,0,0,0,0|1,0,0]=3 7011 B12R1.1 C#CCCOc1ccc(cc1)I 7a_100000212066_100000688953 [0,2,0,0,0,0|1,0,0]=3 7012 B12R1.1 C#CCCOc1ccc(cc1)N 34a_100000185829_100000688953 [0,2,0,0,0,0|1,0,0]=3 7013 B12R1.1 C#CCCOc1ccc(cn1)C 34a_100000759353_100000688953 [0,2,0,0,0,0|2,0,0]=4 7014 B12R1.1 C#CCCOc1ccc(cn1)Cl 34a_100011215309_100000688953 [0,2,0,0,0,0|2,0,0]=4 7015 B12R1.1 C#CCCOc1ccc(cn1)F 34a_100000742473_100000688953 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.1 C#CCCOc1ccc(cn1)N 34a_100000729260_100000688953 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.1 C#CCCOc1ccc(nc1)Br 34a_100000685995_100000688953 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.1 C#CCCOc1ccc(nc1)Br 7a_100000685995_100000688953 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.1 C#CCCOc1ccc(nc1)C 34a_100000745506_100000688953 [0,2,0,0,0,0|2,0,0]=4 7020 B12R1.1 C#CCCOc1ccc(nc1)C 7a_100000745506_100000688953 [0,2,0,0,0,0|2,0,0]=4 7021 B12R1.1 C#CCCOc1ccc(nc1)Cl 34a_100000744096_100000688953 [0,2,0,0,0,0|2,0,0]=4 7022 B12R1.1 C#CCCOc1ccc(nc1)Cl 7a_100000744096_100000688953 [0,2,0,0,0,0|2,0,0]=4 7023 B12R1.1 C#CCCOc1ccc(nc1)F 34a_100000688820_100000688953 [0,2,0,0,0,0|2,0,0]=4 7024 B12R1.1 C#CCCOc1ccc(nc1)F 7a_100000688820_100000688953 [0,2,0,0,0,0|2,0,0]=4 7025 B12R1.1 C#CCCOc1ccc(nc1)I 34a_100000687607_100000688953 [0,2,0,0,0,0|2,0,0]=4 7026 B12R1.1 C#CCCOc1ccc(nc1)I 7a_100000687607_100000688953 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.1 C#CCCOc1ccc(nc1)N 34a_100015188713_100000688953 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.1 C#CCCOc1ccc(nc1)N 7a_100015188713_100000688953 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.1 C#CCCSc1ccc(cc1)Br 62a_100000688953_100000752885 [0,2,0,0,0,0|1,1,0]=4 7030 B12R1.1 C#CCCSc1ccc(cc1)Br 62a_100000752885_100000688953 [0,2,0,0,0,0|1,1,0]=4 7031 B12R1.1 C#CCCSc1ccc(cc1)C 62a_100000186775_100000688953 [0,2,0,0,0,0|1,1,0]=4 7032 B12R1.1 C#CCCSc1ccc(cc1)C 62a_100000688953_100000186775 [0,2,0,0,0,0|1,1,0]=4 7033 B12R1.1 C#CCCSc1ccc(cc1)Cl 62a_100000688953_100000755918 [0,2,0,0,0,0|1,1,0]=4 7034 B12R1.1 C#CCCSc1ccc(cc1)Cl 62a_100000755918_100000688953 [0,2,0,0,0,0|1,1,0]=4 7035 B12R1.1 C#CCCSc1ccc(cc1)F 62a_100000211213_100000688953 [0,2,0,0,0,0|1,1,0]=4 7036 B12R1.1 C#CCCSc1ccc(cc1)F 62a_100000688953_100000211213 [0,2,0,0,0,0|1,1,0]=4 7037 B12R1.1 C#CCCSc1ccc(cc1)N 62a_100000185761_100000688953 [0,2,0,0,0,0|1,1,0]=4 7038 B12R1.1 C#CCCSc1ccc(cc1)N 62a_100000688953_100000185761 [0,2,0,0,0,0|1,1,0]=4 7039 B12R1.1 C#CCCSc1ccc(cc1)O 62a_100000688953_100000185759 [0,2,0,0,0,0|0,1,0]=3 7040 B12R1.1 C#CCCSc1ccc(cn1)O 62a_100000685995_100000688953 [0,2,0,0,0,0|1,1,0]=4 7041 B12R1.1 C#CCCSc1ccc(cn1)O 62a_100000688953_100000744096 [0,2,0,0,0,0|1,1,0]=4 7042 B12R1.1 C#CCNCc1ccc(cc1)O 34a_100000185549_100000184674 [0,2,0,0,0,0|1,0,1]=4 7043 B12R1.1 C#CCOCc1ccc(cc1)Br 34a_100000210247_100000189115 [0,2,0,0,0,0|1,0,1]=4 7044 B12R1.1 C#CCOCc1ccc(cc1)Br 34a_100000695286_100000184674 [0,2,0,0,0,0|1,0,1]=4 7045 B12R1.1 C#CCOCc1ccc(cc1)C 34a_100000210247_100000210814 [0,2,0,0,0,0|1,0,1]=4 7046 B12R1.1 C#CCOCc1ccc(cc1)C 34a_100011215236_100000184674 [0,2,0,0,0,0|1,0,1]=4 7047 B12R1.1 C#CCOCc1ccc(cc1)C 7a_100011215236_100000038162 [0,2,0,0,0,0|1,0,1]=4 7048 B12R1.1 C#CCOCc1ccc(cc1)Cl 34a_100000210247_100000694040 [0,2,0,0,0,0|1,0,1]=4 7049 B12R1.1 C#CCOCc1ccc(cc1)Cl 34a_100000211118_100000184674 [0,2,0,0,0,0|1,0,1]=4 7050 B12R1.1 C#CCOCc1ccc(cc1)Cl 7a_100000211118_100000038162 [0,2,0,0,0,0|1,0,1]=4 7051 B12R1.1 C#CCOCc1ccc(cc1)F 34a_100000210247_100000198546 [0,2,0,0,0,0|1,0,1]=4 7052 B12R1.1 C#CCOCc1ccc(cc1)F 34a_100000210977_100000184674 [0,2,0,0,0,0|1,0,1]=4 7053 B12R1.1 C#CCOCc1ccc(cc1)F 7a_100000210977_100000038162 [0,2,0,0,0,0|1,0,1]=4 7054 B12R1.1 C#CCOCc1ccc(cc1)I 34a_100000210247_100000189116 [0,2,0,0,0,0|1,0,1]=4 7055 B12R1.1 C#CCOCc1ccc(cc1)I 34a_100000690907_100000184674 [0,2,0,0,0,0|1,0,1]=4 7056 B12R1.1 C#CCOCc1ccc(cc1)I 7a_100000690907_100000038162 [0,2,0,0,0,0|1,0,1]=4 7057 B12R1.1 C#CCOCc1ccc(cc1)N 34a_100011215238_100000184674 [0,2,0,0,0,0|1,0,1]=4 7058 B12R1.1 C/C=C/CNc1ccc(cc1)Br 34a_100000210018_100102629194 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.1 C/C=C/CNc1ccc(cc1)C 34a_100000124888_100102629194 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.1 C/C=C/CNc1ccc(cc1)Cl 34a_100000210052_100102629194 [0,2,0,0,0,0|2,0,0]=4 7061 B12R1.1 C/C=C/CNc1ccc(cc1)F 34a_100000185862_100102629194 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.1 C/C=C/CNc1ccc(cc1)I 34a_100000185761_100102629194 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.1 C/C=C/CNc1ccc(cc1)O 34a_100000185829_100102629194 [0,2,0,0,0,0|1,0,0]=3 7064 B12R1.1 C/C=C/COc1ccc(=O)[nH]c1 34a_100000075641_100102629194 [0,2,0,0,0,0|1,0,1]=4 7065 B12R1.1 C/C=C/COc1ccc(cc1)Br 34a_100000185759_100102629194 [0,2,0,0,0,0|1,0,0]=3 7066 B12R1.1 C/C=C/COc1ccc(cc1)Br 7a_100000185759_100102629194 [0,2,0,0,0,0|1,0,0]=3 7067 B12R1.1 C/C=C/COc1ccc(cc1)C 34a_100000210336_100102629194 [0,2,0,0,0,0|1,0,0]=3 7068 B12R1.1 C/C=C/COc1ccc(cc1)C 7a_100000210336_100102629194 [0,2,0,0,0,0|1,0,0]=3 7069 B12R1.1 C/C=C/COc1ccc(cc1)Cl 34a_100000210216_100102629194 [0,2,0,0,0,0|1,0,0]=3 7070 B12R1.1 C/C=C/COc1ccc(cc1)Cl 7a_100000210216_100102629194 [0,2,0,0,0,0|1,0,0]=3 7071 B12R1.1 C/C=C/COc1ccc(cc1)F 34a_100000210339_100102629194 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.1 C/C=C/COc1ccc(cc1)I 34a_100000212066_100102629194 [0,2,0,0,0,0|1,0,0]=3 7073 B12R1.1 C/C=C/COc1ccc(cc1)I 7a_100000212066_100102629194 [0,2,0,0,0,0|1,0,0]=3 7074 B12R1.1 C/C=C/COc1ccc(cc1)N 34a_100000185829_100102629194 [0,2,0,0,0,0|1,0,0]=3 7075 B12R1.1 C/C=C/COc1ccc(cn1)C 34a_100000759353_100102629194 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.1 C/C=C/COc1ccc(cn1)Cl 34a_100011215309_100102629194 [0,2,0,0,0,0|2,0,0]=4 7077 B12R1.1 C/C=C/COc1ccc(cn1)F 34a_100000742473_100102629194 [0,2,0,0,0,0|2,0,0]=4 7078 B12R1.1 C/C=C/COc1ccc(cn1)N 34a_100000729260_100102629194 [0,2,0,0,0,0|2,0,0]=4 7079 B12R1.1 C/C=C/COc1ccc(nc1)Br 34a_100000685995_100102629194 [0,2,0,0,0,0|2,0,0]=4 7080 B12R1.1 C/C=C/COc1ccc(nc1)Br 7a_100000685995_100102629194 [0,2,0,0,0,0|2,0,0]=4 7081 B12R1.1 C/C=C/COc1ccc(nc1)C 34a_100000745506_100102629194 [0,2,0,0,0,0|2,0,0]=4 7082 B12R1.1 C/C=C/COc1ccc(nc1)C 7a_100000745506_100102629194 [0,2,0,0,0,0|2,0,0]=4 7083 B12R1.1 C/C=C/COc1ccc(nc1)Cl 34a_100000744096_100102629194 [0,2,0,0,0,0|2,0,0]=4 7084 B12R1.1 C/C=C/COc1ccc(nc1)Cl 7a_100000744096_100102629194 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.1 C/C=C/COc1ccc(nc1)F 34a_100000688820_100102629194 [0,2,0,0,0,0|2,0,0]=4 7086 B12R1.1 C/C=C/COc1ccc(nc1)F 7a_100000688820_100102629194 [0,2,0,0,0,0|2,0,0]=4 7087 B12R1.1 C/C=C/COc1ccc(nc1)I 34a_100000687607_100102629194 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.1 C/C=C/COc1ccc(nc1)I 7a_100000687607_100102629194 [0,2,0,0,0,0|2,0,0]=4 7089 B12R1.1 C/C=C/COc1ccc(nc1)N 34a_100015188713_100102629194 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.1 C/C=C/COc1ccc(nc1)N 7a_100015188713_100102629194 [0,2,0,0,0,0|2,0,0]=4 7091 B12R1.1 C/C=C/CSc1ccc(cc1)Br 62a_100000752885_100102629194 [0,2,0,0,0,0|1,1,0]=4 7092 B12R1.1 C/C=C/CSc1ccc(cc1)Br 62a_100102629194_100000752885 [0,2,0,0,0,0|1,1,0]=4 7093 B12R1.1 C/C=C/CSc1ccc(cc1)C 62a_100000186775_100102629194 [0,2,0,0,0,0|1,1,0]=4 7094 B12R1.1 C/C=C/CSc1ccc(cc1)C 62a_100102629194_100000186775 [0,2,0,0,0,0|1,1,0]=4 7095 B12R1.1 C/C=C/CSc1ccc(cc1)Cl 62a_100000755918_100102629194 [0,2,0,0,0,0|1,1,0]=4 7096 B12R1.1 C/C=C/CSc1ccc(cc1)Cl 62a_100102629194_100000755918 [0,2,0,0,0,0|1,1,0]=4 7097 B12R1.1 C/C=C/CSc1ccc(cc1)F 62a_100000211213_100102629194 [0,2,0,0,0,0|1,1,0]=4 7098 B12R1.1 C/C=C/CSc1ccc(cc1)F 62a_100102629194_100000211213 [0,2,0,0,0,0|1,1,0]=4 7099 B12R1.1 C/C=C/CSc1ccc(cc1)N 62a_100000185761_100102629194 [0,2,0,0,0,0|1,1,0]=4 7100 B12R1.1 C/C=C/CSc1ccc(cc1)N 62a_100102629194_100000185761 [0,2,0,0,0,0|1,1,0]=4 7101 B12R1.1 C/C=C/CSc1ccc(cc1)O 62a_100102629194_100000185759 [0,2,0,0,0,0|0,1,0]=3 7102 B12R1.1 C/C=C/CSc1ccc(cn1)O 62a_100000685995_100102629194 [0,2,0,0,0,0|1,1,0]=4 7103 B12R1.1 C/C=C/CSc1ccc(cn1)O 62a_100102629194_100000744096 [0,2,0,0,0,0|1,1,0]=4 7104 B12R1.1 C=CCCNc1ccc(cc1)Br 2230a_100000210018_100000754431 [0,2,0,0,0,0|2,0,0]=4 7105 B12R1.1 C=CCCNc1ccc(cc1)Br 34a_100000210018_100000754431 [0,2,0,0,0,0|2,0,0]=4 7106 B12R1.1 C=CCCNc1ccc(cc1)C 34a_100000124888_100000754431 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.1 C=CCCNc1ccc(cc1)Cl 2230a_100000210052_100000754431 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.1 C=CCCNc1ccc(cc1)Cl 34a_100000210052_100000754431 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.1 C=CCCNc1ccc(cc1)F 34a_100000185862_100000754431 [0,2,0,0,0,0|2,0,0]=4 7110 B12R1.1 C=CCCNc1ccc(cc1)I 34a_100000185761_100000754431 [0,2,0,0,0,0|2,0,0]=4 7111 B12R1.1 C=CCCNc1ccc(cc1)O 34a_100000185829_100000754431 [0,2,0,0,0,0|1,0,0]=3 7112 B12R1.1 C=CCCOc1ccc(=O)[nH]c1 34a_100000075641_100000754431 [0,2,0,0,0,0|1,0,1]=4 7113 B12R1.1 C=CCCOc1ccc(cc1)Br 34a_100000185759_100000754431 [0,2,0,0,0,0|1,0,0]=3 7114 B12R1.1 C=CCCOc1ccc(cc1)Br 7a_100000185759_100000754431 [0,2,0,0,0,0|1,0,0]=3 7115 B12R1.1 C=CCCOc1ccc(cc1)C 34a_100000210336_100000754431 [0,2,0,0,0,0|1,0,0]=3 7116 B12R1.1 C=CCCOc1ccc(cc1)C 7a_100000210336_100000754431 [0,2,0,0,0,0|1,0,0]=3 7117 B12R1.1 C=CCCOc1ccc(cc1)Cl 34a_100000210216_100000754431 [0,2,0,0,0,0|1,0,0]=3 7118 B12R1.1 C=CCCOc1ccc(cc1)Cl 7a_100000210216_100000754431 [0,2,0,0,0,0|1,0,0]=3 7119 B12R1.1 C=CCCOc1ccc(cc1)F 34a_100000210339_100000754431 [0,2,0,0,0,0|1,0,0]=3 7120 B12R1.1 C=CCCOc1ccc(cc1)I 34a_100000212066_100000754431 [0,2,0,0,0,0|1,0,0]=3 7121 B12R1.1 C=CCCOc1ccc(cc1)I 7a_100000212066_100000754431 [0,2,0,0,0,0|1,0,0]=3 7122 B12R1.1 C=CCCOc1ccc(cc1)N 34a_100000185829_100000754431 [0,2,0,0,0,0|1,0,0]=3 7123 B12R1.1 C=CCCOc1ccc(cc1)O 271570a_203496583355_100012049633 [0,2,0,0,0,0|0,0,0]=2 7124 B12R1.1 C=CCCOc1ccc(cn1)C 34a_100000759353_100000754431 [0,2,0,0,0,0|2,0,0]=4 7125 B12R1.1 C=CCCOc1ccc(cn1)Cl 34a_100011215309_100000754431 [0,2,0,0,0,0|2,0,0]=4 7126 B12R1.1 C=CCCOc1ccc(cn1)F 34a_100000742473_100000754431 [0,2,0,0,0,0|2,0,0]=4 7127 B12R1.1 C=CCCOc1ccc(cn1)N 34a_100000729260_100000754431 [0,2,0,0,0,0|2,0,0]=4 7128 B12R1.1 C=CCCOc1ccc(nc1)Br 34a_100000685995_100000754431 [0,2,0,0,0,0|2,0,0]=4 7129 B12R1.1 C=CCCOc1ccc(nc1)Br 7a_100000685995_100000754431 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.1 C=CCCOc1ccc(nc1)C 34a_100000745506_100000754431 [0,2,0,0,0,0|2,0,0]=4 7131 B12R1.1 C=CCCOc1ccc(nc1)C 7a_100000745506_100000754431 [0,2,0,0,0,0|2,0,0]=4 7132 B12R1.1 C=CCCOc1ccc(nc1)Cl 34a_100000744096_100000754431 [0,2,0,0,0,0|2,0,0]=4 7133 B12R1.1 C=CCCOc1ccc(nc1)Cl 7a_100000744096_100000754431 [0,2,0,0,0,0|2,0,0]=4 7134 B12R1.1 C=CCCOc1ccc(nc1)F 34a_100000688820_100000754431 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.1 C=CCCOc1ccc(nc1)F 7a_100000688820_100000754431 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.1 C=CCCOc1ccc(nc1)I 34a_100000687607_100000754431 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.1 C=CCCOc1ccc(nc1)I 7a_100000687607_100000754431 [0,2,0,0,0,0|2,0,0]=4 7138 B12R1.1 C=CCCOc1ccc(nc1)N 34a_100015188713_100000754431 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.1 C=CCCOc1ccc(nc1)N 7a_100015188713_100000754431 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.1 C=CCCSc1ccc(cc1)Br 62a_100000752885_100000754431 [0,2,0,0,0,0|1,1,0]=4 7141 B12R1.1 C=CCCSc1ccc(cc1)Br 62a_100000754431_100000752885 [0,2,0,0,0,0|1,1,0]=4 7142 B12R1.1 C=CCCSc1ccc(cc1)C 62a_100000186775_100000754431 [0,2,0,0,0,0|1,1,0]=4 7143 B12R1.1 C=CCCSc1ccc(cc1)C 62a_100000754431_100000186775 [0,2,0,0,0,0|1,1,0]=4 7144 B12R1.1 C=CCCSc1ccc(cc1)Cl 62a_100000754431_100000755918 [0,2,0,0,0,0|1,1,0]=4 7145 B12R1.1 C=CCCSc1ccc(cc1)Cl 62a_100000755918_100000754431 [0,2,0,0,0,0|1,1,0]=4 7146 B12R1.1 C=CCCSc1ccc(cc1)F 62a_100000211213_100000754431 [0,2,0,0,0,0|1,1,0]=4 7147 B12R1.1 C=CCCSc1ccc(cc1)F 62a_100000754431_100000211213 [0,2,0,0,0,0|1,1,0]=4 7148 B12R1.1 C=CCCSc1ccc(cc1)N 62a_100000185761_100000754431 [0,2,0,0,0,0|1,1,0]=4 7149 B12R1.1 C=CCCSc1ccc(cc1)N 62a_100000754431_100000185761 [0,2,0,0,0,0|1,1,0]=4 7150 B12R1.1 C=CCCSc1ccc(cc1)O 62a_100000754431_100000185759 [0,2,0,0,0,0|0,1,0]=3 7151 B12R1.1 C=CCCSc1ccc(cn1)O 62a_100000685995_100000754431 [0,2,0,0,0,0|1,1,0]=4 7152 B12R1.1 C=CCCSc1ccc(cn1)O 62a_100000754431_100000744096 [0,2,0,0,0,0|1,1,0]=4 7153 B12R1.1 C=CCNCc1ccc(cc1)O 34a_100000185549_100015514636 [0,2,0,0,0,0|1,0,1]=4 7154 B12R1.1 C=CCOCc1ccc(cc1)Br 34a_100000695286_100015514636 [0,2,0,0,0,0|1,0,1]=4 7155 B12R1.1 C=CCOCc1ccc(cc1)Br 34a_200000210373_100000189115 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.1 C=CCOCc1ccc(cc1)C 34a_100011215236_100015514636 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.1 C=CCOCc1ccc(cc1)C 34a_200000210373_100000210814 [0,2,0,0,0,0|1,0,1]=4 7158 B12R1.1 C=CCOCc1ccc(cc1)C 7a_100011215236_100015514636 [0,2,0,0,0,0|1,0,1]=4 7159 B12R1.1 C=CCOCc1ccc(cc1)Cl 34a_100000211118_100015514636 [0,2,0,0,0,0|1,0,1]=4 7160 B12R1.1 C=CCOCc1ccc(cc1)Cl 34a_200000210373_100000694040 [0,2,0,0,0,0|1,0,1]=4 7161 B12R1.1 C=CCOCc1ccc(cc1)Cl 7a_100000211118_100015514636 [0,2,0,0,0,0|1,0,1]=4 7162 B12R1.1 C=CCOCc1ccc(cc1)F 34a_100000210977_100015514636 [0,2,0,0,0,0|1,0,1]=4 7163 B12R1.1 C=CCOCc1ccc(cc1)F 34a_200000210373_100000198546 [0,2,0,0,0,0|1,0,1]=4 7164 B12R1.1 C=CCOCc1ccc(cc1)F 7a_100000210977_100015514636 [0,2,0,0,0,0|1,0,1]=4 7165 B12R1.1 C=CCOCc1ccc(cc1)I 34a_100000690907_100015514636 [0,2,0,0,0,0|1,0,1]=4 7166 B12R1.1 C=CCOCc1ccc(cc1)I 34a_200000210373_100000189116 [0,2,0,0,0,0|1,0,1]=4 7167 B12R1.1 C=CCOCc1ccc(cc1)I 7a_100000690907_100015514636 [0,2,0,0,0,0|1,0,1]=4 7168 B12R1.1 C=CCOCc1ccc(cc1)N 34a_100011215238_100015514636 [0,2,0,0,0,0|1,0,1]=4 7169 B12R1.1 CC#CCNc1ccc(cc1)Br 2230a_100000210018_100000748600 [0,2,0,0,0,0|2,0,0]=4 7170 B12R1.1 CC#CCNc1ccc(cc1)Br 34a_100000210018_100000748600 [0,2,0,0,0,0|2,0,0]=4 7171 B12R1.1 CC#CCNc1ccc(cc1)C 34a_100000124888_100000748600 [0,2,0,0,0,0|2,0,0]=4 7172 B12R1.1 CC#CCNc1ccc(cc1)Cl 2230a_100000210052_100000748600 [0,2,0,0,0,0|2,0,0]=4 7173 B12R1.1 CC#CCNc1ccc(cc1)Cl 34a_100000210052_100000748600 [0,2,0,0,0,0|2,0,0]=4 7174 B12R1.1 CC#CCNc1ccc(cc1)F 34a_100000185862_100000748600 [0,2,0,0,0,0|2,0,0]=4 7175 B12R1.1 CC#CCNc1ccc(cc1)I 34a_100000185761_100000748600 [0,2,0,0,0,0|2,0,0]=4 7176 B12R1.1 CC#CCNc1ccc(cc1)O 34a_100000185829_100000748600 [0,2,0,0,0,0|1,0,0]=3 7177 B12R1.1 CC#CCOc1ccc(=O)[nH]c1 34a_100000075641_100000748600 [0,2,0,0,0,0|1,0,1]=4 7178 B12R1.1 CC#CCOc1ccc(cc1)Br 34a_100000185759_100000748600 [0,2,0,0,0,0|1,0,0]=3 7179 B12R1.1 CC#CCOc1ccc(cc1)Br 7a_100000185759_100000748600 [0,2,0,0,0,0|1,0,0]=3 7180 B12R1.1 CC#CCOc1ccc(cc1)C 34a_100000210336_100000748600 [0,2,0,0,0,0|1,0,0]=3 7181 B12R1.1 CC#CCOc1ccc(cc1)C 7a_100000210336_100000748600 [0,2,0,0,0,0|1,0,0]=3 7182 B12R1.1 CC#CCOc1ccc(cc1)Cl 34a_100000210216_100000748600 [0,2,0,0,0,0|1,0,0]=3 7183 B12R1.1 CC#CCOc1ccc(cc1)Cl 7a_100000210216_100000748600 [0,2,0,0,0,0|1,0,0]=3 7184 B12R1.1 CC#CCOc1ccc(cc1)F 34a_100000210339_100000748600 [0,2,0,0,0,0|1,0,0]=3 7185 B12R1.1 CC#CCOc1ccc(cc1)I 34a_100000212066_100000748600 [0,2,0,0,0,0|1,0,0]=3 7186 B12R1.1 CC#CCOc1ccc(cc1)I 7a_100000212066_100000748600 [0,2,0,0,0,0|1,0,0]=3 7187 B12R1.1 CC#CCOc1ccc(cc1)N 34a_100000185829_100000748600 [0,2,0,0,0,0|1,0,0]=3 7188 B12R1.1 CC#CCOc1ccc(cn1)C 34a_100000759353_100000748600 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.1 CC#CCOc1ccc(cn1)Cl 34a_100011215309_100000748600 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.1 CC#CCOc1ccc(cn1)F 34a_100000742473_100000748600 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.1 CC#CCOc1ccc(cn1)N 34a_100000729260_100000748600 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.1 CC#CCOc1ccc(nc1)Br 34a_100000685995_100000748600 [0,2,0,0,0,0|2,0,0]=4 7193 B12R1.1 CC#CCOc1ccc(nc1)Br 7a_100000685995_100000748600 [0,2,0,0,0,0|2,0,0]=4 7194 B12R1.1 CC#CCOc1ccc(nc1)C 34a_100000745506_100000748600 [0,2,0,0,0,0|2,0,0]=4 7195 B12R1.1 CC#CCOc1ccc(nc1)C 7a_100000745506_100000748600 [0,2,0,0,0,0|2,0,0]=4 7196 B12R1.1 CC#CCOc1ccc(nc1)Cl 34a_100000744096_100000748600 [0,2,0,0,0,0|2,0,0]=4 7197 B12R1.1 CC#CCOc1ccc(nc1)Cl 7a_100000744096_100000748600 [0,2,0,0,0,0|2,0,0]=4 7198 B12R1.1 CC#CCOc1ccc(nc1)F 34a_100000688820_100000748600 [0,2,0,0,0,0|2,0,0]=4 7199 B12R1.1 CC#CCOc1ccc(nc1)F 7a_100000688820_100000748600 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.1 CC#CCOc1ccc(nc1)I 34a_100000687607_100000748600 [0,2,0,0,0,0|2,0,0]=4 7201 B12R1.1 CC#CCOc1ccc(nc1)I 7a_100000687607_100000748600 [0,2,0,0,0,0|2,0,0]=4 7202 B12R1.1 CC#CCOc1ccc(nc1)N 34a_100015188713_100000748600 [0,2,0,0,0,0|2,0,0]=4 7203 B12R1.1 CC#CCOc1ccc(nc1)N 7a_100015188713_100000748600 [0,2,0,0,0,0|2,0,0]=4 7204 B12R1.1 CC#CCSc1ccc(cc1)Br 62a_100000748600_100000752885 [0,2,0,0,0,0|1,1,0]=4 7205 B12R1.1 CC#CCSc1ccc(cc1)Br 62a_100000752885_100000748600 [0,2,0,0,0,0|1,1,0]=4 7206 B12R1.1 CC#CCSc1ccc(cc1)C 62a_100000186775_100000748600 [0,2,0,0,0,0|1,1,0]=4 7207 B12R1.1 CC#CCSc1ccc(cc1)C 62a_100000748600_100000186775 [0,2,0,0,0,0|1,1,0]=4 7208 B12R1.1 CC#CCSc1ccc(cc1)Cl 62a_100000748600_100000755918 [0,2,0,0,0,0|1,1,0]=4 7209 B12R1.1 CC#CCSc1ccc(cc1)Cl 62a_100000755918_100000748600 [0,2,0,0,0,0|1,1,0]=4 7210 B12R1.1 CC#CCSc1ccc(cc1)F 62a_100000211213_100000748600 [0,2,0,0,0,0|1,1,0]=4 7211 B12R1.1 CC#CCSc1ccc(cc1)F 62a_100000748600_100000211213 [0,2,0,0,0,0|1,1,0]=4 7212 B12R1.1 CC#CCSc1ccc(cc1)N 62a_100000185761_100000748600 [0,2,0,0,0,0|1,1,0]=4 7213 B12R1.1 CC#CCSc1ccc(cc1)N 62a_100000748600_100000185761 [0,2,0,0,0,0|1,1,0]=4 7214 B12R1.1 CC#CCSc1ccc(cc1)O 62a_100000748600_100000185759 [0,2,0,0,0,0|0,1,0]=3 7215 B12R1.1 CC#CCSc1ccc(cn1)O 62a_100000685995_100000748600 [0,2,0,0,0,0|1,1,0]=4 7216 B12R1.1 CC#CCSc1ccc(cn1)O 62a_100000748600_100000744096 [0,2,0,0,0,0|1,1,0]=4 7217 B12R1.1 CC=CCNc1ccc(cc1)Br 2230a_100000210018_100000070051 [0,2,0,0,0,0|2,0,0]=4 7218 B12R1.1 CC=CCNc1ccc(cc1)Br 34a_100000210018_100000070051 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.1 CC=CCNc1ccc(cc1)C 34a_100000124888_100000070051 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.1 CC=CCNc1ccc(cc1)Cl 2230a_100000210052_100000070051 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.1 CC=CCNc1ccc(cc1)Cl 34a_100000210052_100000070051 [0,2,0,0,0,0|2,0,0]=4 7222 B12R1.1 CC=CCNc1ccc(cc1)F 34a_100000185862_100000070051 [0,2,0,0,0,0|2,0,0]=4 7223 B12R1.1 CC=CCNc1ccc(cc1)I 34a_100000185761_100000070051 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.1 CC=CCNc1ccc(cc1)O 34a_100000185829_100000070051 [0,2,0,0,0,0|1,0,0]=3 7225 B12R1.1 CC=CCOc1ccc(=O)[nH]c1 34a_100000075641_100000070051 [0,2,0,0,0,0|1,0,1]=4 7226 B12R1.1 CC=CCOc1ccc(cc1)Br 34a_100000185759_100000070051 [0,2,0,0,0,0|1,0,0]=3 7227 B12R1.1 CC=CCOc1ccc(cc1)Br 7a_100000185759_100000070051 [0,2,0,0,0,0|1,0,0]=3 7228 B12R1.1 CC=CCOc1ccc(cc1)C 34a_100000210336_100000070051 [0,2,0,0,0,0|1,0,0]=3 7229 B12R1.1 CC=CCOc1ccc(cc1)C 7a_100000210336_100000070051 [0,2,0,0,0,0|1,0,0]=3 7230 B12R1.1 CC=CCOc1ccc(cc1)Cl 34a_100000210216_100000070051 [0,2,0,0,0,0|1,0,0]=3 7231 B12R1.1 CC=CCOc1ccc(cc1)Cl 7a_100000210216_100000070051 [0,2,0,0,0,0|1,0,0]=3 7232 B12R1.1 CC=CCOc1ccc(cc1)F 34a_100000210339_100000070051 [0,2,0,0,0,0|1,0,0]=3 7233 B12R1.1 CC=CCOc1ccc(cc1)I 34a_100000212066_100000070051 [0,2,0,0,0,0|1,0,0]=3 7234 B12R1.1 CC=CCOc1ccc(cc1)I 7a_100000212066_100000070051 [0,2,0,0,0,0|1,0,0]=3 7235 B12R1.1 CC=CCOc1ccc(cc1)N 34a_100000185829_100000070051 [0,2,0,0,0,0|1,0,0]=3 7236 B12R1.1 CC=CCOc1ccc(cn1)C 34a_100000759353_100000070051 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.1 CC=CCOc1ccc(cn1)Cl 34a_100011215309_100000070051 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.1 CC=CCOc1ccc(cn1)F 34a_100000742473_100000070051 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.1 CC=CCOc1ccc(cn1)N 34a_100000729260_100000070051 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.1 CC=CCOc1ccc(nc1)Br 34a_100000685995_100000070051 [0,2,0,0,0,0|2,0,0]=4 7241 B12R1.1 CC=CCOc1ccc(nc1)Br 7a_100000685995_100000070051 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.1 CC=CCOc1ccc(nc1)C 34a_100000745506_100000070051 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.1 CC=CCOc1ccc(nc1)C 7a_100000745506_100000070051 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.1 CC=CCOc1ccc(nc1)Cl 34a_100000744096_100000070051 [0,2,0,0,0,0|2,0,0]=4 7245 B12R1.1 CC=CCOc1ccc(nc1)Cl 7a_100000744096_100000070051 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.1 CC=CCOc1ccc(nc1)F 34a_100000688820_100000070051 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.1 CC=CCOc1ccc(nc1)F 7a_100000688820_100000070051 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.1 CC=CCOc1ccc(nc1)I 34a_100000687607_100000070051 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.1 CC=CCOc1ccc(nc1)I 7a_100000687607_100000070051 [0,2,0,0,0,0|2,0,0]=4 7250 B12R1.1 CC=CCOc1ccc(nc1)N 34a_100015188713_100000070051 [0,2,0,0,0,0|2,0,0]=4 7251 B12R1.1 CC=CCOc1ccc(nc1)N 7a_100015188713_100000070051 [0,2,0,0,0,0|2,0,0]=4 7252 B12R1.1 CC=CCSc1ccc(cc1)Br 62a_100000070051_100000752885 [0,2,0,0,0,0|1,1,0]=4 7253 B12R1.1 CC=CCSc1ccc(cc1)Br 62a_100000752885_100000070051 [0,2,0,0,0,0|1,1,0]=4 7254 B12R1.1 CC=CCSc1ccc(cc1)C 62a_100000070051_100000186775 [0,2,0,0,0,0|1,1,0]=4 7255 B12R1.1 CC=CCSc1ccc(cc1)C 62a_100000186775_100000070051 [0,2,0,0,0,0|1,1,0]=4 7256 B12R1.1 CC=CCSc1ccc(cc1)Cl 62a_100000070051_100000755918 [0,2,0,0,0,0|1,1,0]=4 7257 B12R1.1 CC=CCSc1ccc(cc1)Cl 62a_100000755918_100000070051 [0,2,0,0,0,0|1,1,0]=4 7258 B12R1.1 CC=CCSc1ccc(cc1)F 62a_100000070051_100000211213 [0,2,0,0,0,0|1,1,0]=4 7259 B12R1.1 CC=CCSc1ccc(cc1)F 62a_100000211213_100000070051 [0,2,0,0,0,0|1,1,0]=4 7260 B12R1.1 CC=CCSc1ccc(cc1)N 62a_100000070051_100000185761 [0,2,0,0,0,0|1,1,0]=4 7261 B12R1.1 CC=CCSc1ccc(cc1)N 62a_100000185761_100000070051 [0,2,0,0,0,0|1,1,0]=4 7262 B12R1.1 CC=CCSc1ccc(cc1)O 62a_100000070051_100000185759 [0,2,0,0,0,0|0,1,0]=3 7263 B12R1.1 CC=CCSc1ccc(cn1)O 62a_100000070051_100000744096 [0,2,0,0,0,0|1,1,0]=4 7264 B12R1.1 CC=CCSc1ccc(cn1)O 62a_100000685995_100000070051 [0,2,0,0,0,0|1,1,0]=4 7265 B12R1.1 CCC=NNc1ccc(cc1)Br 4a_100000735608_100000210100 [0,2,0,0,0,0|2,0,0]=4 7266 B12R1.1 CCC=NNc1ccc(cc1)C 4a_100000683527_100000210100 [0,2,0,0,0,0|2,0,0]=4 7267 B12R1.1 CCC=NNc1ccc(cc1)Cl 4a_100000683521_100000210100 [0,2,0,0,0,0|2,0,0]=4 7268 B12R1.1 CCC=NNc1ccc(cc1)F 4a_100000728448_100000210100 [0,2,0,0,0,0|2,0,0]=4 7269 B12R1.1 CCC=NNc1ccc(cc1)I 4a_100016988836_100000210100 [0,2,0,0,0,0|2,0,0]=4 7270 B12R1.1 CCCC=Cc1ccc(cc1)Br 271570a_100016258520_100000752885 [0,2,0,0,0,0|2,0,0]=4 7271 B12R1.1 CCCC=Cc1ccc(cc1)C 271570a_100016258520_100000186775 [0,2,0,0,0,0|2,0,0]=4 7272 B12R1.1 CCCC=Cc1ccc(cc1)Cl 271570a_100016258520_100000755918 [0,2,0,0,0,0|2,0,0]=4 7273 B12R1.1 CCCC=Cc1ccc(cc1)F 271570a_100016258520_100000211213 [0,2,0,0,0,0|2,0,0]=4 7274 B12R1.1 CCCC=Cc1ccc(cc1)N 271570a_100016258520_100000185761 [0,2,0,0,0,0|2,0,0]=4 7275 B12R1.1 CCCC=Cc1ccc(cc1)O 271570a_100016258520_100000185759 [0,2,0,0,0,0|1,0,0]=3 7276 B12R1.1 CCCC=Cc1ccc(cn1)O 271570a_100016258520_100000685995 [0,2,0,0,0,0|2,0,0]=4 7277 B12R1.1 CCCCCc1ccc(cc1)O 271570a_203496583355_100009813665 [0,2,0,0,0,0|1,0,0]=3 7278 B12R1.1 CCCCNc1ccc(cc1)Br 2230a_100000210018_100000210211 [0,2,0,0,0,0|2,0,0]=4 7279 B12R1.1 CCCCNc1ccc(cc1)Br 34a_100000210018_100000210210 [0,2,0,0,0,0|2,0,0]=4 7280 B12R1.1 CCCCNc1ccc(cc1)C 34a_100000124888_100000210210 [0,2,0,0,0,0|2,0,0]=4 7281 B12R1.1 CCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210211 [0,2,0,0,0,0|2,0,0]=4 7282 B12R1.1 CCCCNc1ccc(cc1)Cl 34a_100000210052_100000210210 [0,2,0,0,0,0|2,0,0]=4 7283 B12R1.1 CCCCNc1ccc(cc1)F 34a_100000185862_100000210210 [0,2,0,0,0,0|2,0,0]=4 7284 B12R1.1 CCCCNc1ccc(cc1)I 34a_100000185761_100000210210 [0,2,0,0,0,0|2,0,0]=4 7285 B12R1.1 CCCCNc1ccc(cc1)O 34a_100000185829_100000210210 [0,2,0,0,0,0|1,0,0]=3 7286 B12R1.1 CCCCNc1ccc(cn1)O 271570a_203496583355_200011243049 [0,2,0,0,0,0|2,0,0]=4 7287 B12R1.1 CCCCOc1ccc(=O)[nH]c1 34a_100000075641_100000210210 [0,2,0,0,0,0|1,0,1]=4 7288 B12R1.1 CCCCOc1ccc(cc1)Br 34a_100000185759_100000210210 [0,2,0,0,0,0|1,0,0]=3 7289 B12R1.1 CCCCOc1ccc(cc1)Br 7a_100000185759_100000210211 [0,2,0,0,0,0|1,0,0]=3 7290 B12R1.1 CCCCOc1ccc(cc1)C 34a_100000210336_100000210210 [0,2,0,0,0,0|1,0,0]=3 7291 B12R1.1 CCCCOc1ccc(cc1)C 7a_100000210336_100000210211 [0,2,0,0,0,0|1,0,0]=3 7292 B12R1.1 CCCCOc1ccc(cc1)Cl 34a_100000210216_100000210210 [0,2,0,0,0,0|1,0,0]=3 7293 B12R1.1 CCCCOc1ccc(cc1)Cl 7a_100000210216_100000210211 [0,2,0,0,0,0|1,0,0]=3 7294 B12R1.1 CCCCOc1ccc(cc1)F 34a_100000210339_100000210210 [0,2,0,0,0,0|1,0,0]=3 7295 B12R1.1 CCCCOc1ccc(cc1)I 34a_100000212066_100000210210 [0,2,0,0,0,0|1,0,0]=3 7296 B12R1.1 CCCCOc1ccc(cc1)I 7a_100000212066_100000210211 [0,2,0,0,0,0|1,0,0]=3 7297 B12R1.1 CCCCOc1ccc(cc1)N 34a_100000185829_100000210210 [0,2,0,0,0,0|1,0,0]=3 7298 B12R1.1 CCCCOc1ccc(cc1)O 271570a_203496583355_100000230682 [0,2,0,0,0,0|0,0,0]=2 7299 B12R1.1 CCCCOc1ccc(cn1)C 34a_100000759353_100000210210 [0,2,0,0,0,0|2,0,0]=4 7300 B12R1.1 CCCCOc1ccc(cn1)Cl 34a_100011215309_100000210210 [0,2,0,0,0,0|2,0,0]=4 7301 B12R1.1 CCCCOc1ccc(cn1)F 34a_100000742473_100000210210 [0,2,0,0,0,0|2,0,0]=4 7302 B12R1.1 CCCCOc1ccc(cn1)N 34a_100000729260_100000210210 [0,2,0,0,0,0|2,0,0]=4 7303 B12R1.1 CCCCOc1ccc(nc1)Br 34a_100000685995_100000210210 [0,2,0,0,0,0|2,0,0]=4 7304 B12R1.1 CCCCOc1ccc(nc1)Br 7a_100000685995_100000210211 [0,2,0,0,0,0|2,0,0]=4 7305 B12R1.1 CCCCOc1ccc(nc1)C 34a_100000745506_100000210210 [0,2,0,0,0,0|2,0,0]=4 7306 B12R1.1 CCCCOc1ccc(nc1)C 7a_100000745506_100000210211 [0,2,0,0,0,0|2,0,0]=4 7307 B12R1.1 CCCCOc1ccc(nc1)Cl 34a_100000744096_100000210210 [0,2,0,0,0,0|2,0,0]=4 7308 B12R1.1 CCCCOc1ccc(nc1)Cl 7a_100000744096_100000210211 [0,2,0,0,0,0|2,0,0]=4 7309 B12R1.1 CCCCOc1ccc(nc1)F 34a_100000688820_100000210210 [0,2,0,0,0,0|2,0,0]=4 7310 B12R1.1 CCCCOc1ccc(nc1)F 7a_100000688820_100000210211 [0,2,0,0,0,0|2,0,0]=4 7311 B12R1.1 CCCCOc1ccc(nc1)I 34a_100000687607_100000210210 [0,2,0,0,0,0|2,0,0]=4 7312 B12R1.1 CCCCOc1ccc(nc1)I 7a_100000687607_100000210211 [0,2,0,0,0,0|2,0,0]=4 7313 B12R1.1 CCCCOc1ccc(nc1)N 34a_100015188713_100000210210 [0,2,0,0,0,0|2,0,0]=4 7314 B12R1.1 CCCCOc1ccc(nc1)N 7a_100015188713_100000210211 [0,2,0,0,0,0|2,0,0]=4 7315 B12R1.1 CCCCSc1ccc(cc1)Br 62a_100000210211_100000752885 [0,2,0,0,0,0|1,1,0]=4 7316 B12R1.1 CCCCSc1ccc(cc1)Br 62a_100000752885_100000210210 [0,2,0,0,0,0|1,1,0]=4 7317 B12R1.1 CCCCSc1ccc(cc1)C 62a_100000186775_100000210210 [0,2,0,0,0,0|1,1,0]=4 7318 B12R1.1 CCCCSc1ccc(cc1)C 62a_100000210211_100000186775 [0,2,0,0,0,0|1,1,0]=4 7319 B12R1.1 CCCCSc1ccc(cc1)Cl 62a_100000210211_100000755918 [0,2,0,0,0,0|1,1,0]=4 7320 B12R1.1 CCCCSc1ccc(cc1)Cl 62a_100000755918_100000210210 [0,2,0,0,0,0|1,1,0]=4 7321 B12R1.1 CCCCSc1ccc(cc1)F 62a_100000210211_100000211213 [0,2,0,0,0,0|1,1,0]=4 7322 B12R1.1 CCCCSc1ccc(cc1)F 62a_100000211213_100000210210 [0,2,0,0,0,0|1,1,0]=4 7323 B12R1.1 CCCCSc1ccc(cc1)N 62a_100000185761_100000210210 [0,2,0,0,0,0|1,1,0]=4 7324 B12R1.1 CCCCSc1ccc(cc1)N 62a_100000210211_100000185761 [0,2,0,0,0,0|1,1,0]=4 7325 B12R1.1 CCCCSc1ccc(cc1)O 62a_100000210211_100000185759 [0,2,0,0,0,0|0,1,0]=3 7326 B12R1.1 CCCCSc1ccc(cn1)O 62a_100000210211_100000744096 [0,2,0,0,0,0|1,1,0]=4 7327 B12R1.1 CCCCSc1ccc(cn1)O 62a_100000685995_100000210210 [0,2,0,0,0,0|1,1,0]=4 7328 B12R1.1 CCCNCc1ccc(cc1)Br 207a_100020643023_100000186029 [0,2,0,0,0,0|2,0,0]=4 7329 B12R1.1 CCCNCc1ccc(cc1)Br 2230a_100000174875_100000210303 [0,2,0,0,0,0|2,0,0]=4 7330 B12R1.1 CCCNCc1ccc(cc1)Br 270004a_100020643023_100000186029 [0,2,0,0,0,0|2,0,0]=4 7331 B12R1.1 CCCNCc1ccc(cc1)Br 34a_100000174875_100000210303 [0,2,0,0,0,0|2,0,0]=4 7332 B12R1.1 CCCNCc1ccc(cc1)C 207a_100020643023_100000211033 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.1 CCCNCc1ccc(cc1)C 2230a_100000174908_100000210303 [0,2,0,0,0,0|2,0,0]=4 7334 B12R1.1 CCCNCc1ccc(cc1)C 270004a_100020643023_100000211033 [0,2,0,0,0,0|2,0,0]=4 7335 B12R1.1 CCCNCc1ccc(cc1)C 34a_100000174908_100000210303 [0,2,0,0,0,0|2,0,0]=4 7336 B12R1.1 CCCNCc1ccc(cc1)Cl 207a_100020643023_100000189385 [0,2,0,0,0,0|2,0,0]=4 7337 B12R1.1 CCCNCc1ccc(cc1)Cl 2230a_100000174871_100000210303 [0,2,0,0,0,0|2,0,0]=4 7338 B12R1.1 CCCNCc1ccc(cc1)Cl 270004a_100020643023_100000189385 [0,2,0,0,0,0|2,0,0]=4 7339 B12R1.1 CCCNCc1ccc(cc1)Cl 34a_100000174871_100000210303 [0,2,0,0,0,0|2,0,0]=4 7340 B12R1.1 CCCNCc1ccc(cc1)F 207a_100020643023_100000210084 [0,2,0,0,0,0|2,0,0]=4 7341 B12R1.1 CCCNCc1ccc(cc1)F 2230a_100000174882_100000210303 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.1 CCCNCc1ccc(cc1)F 270004a_100020643023_100000210084 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.1 CCCNCc1ccc(cc1)F 34a_100000174882_100000210303 [0,2,0,0,0,0|2,0,0]=4 7344 B12R1.1 CCCNCc1ccc(cc1)I 207a_100020643023_100000188517 [0,2,0,0,0,0|2,0,0]=4 7345 B12R1.1 CCCNCc1ccc(cc1)I 2230a_100016989417_100000210303 [0,2,0,0,0,0|2,0,0]=4 7346 B12R1.1 CCCNCc1ccc(cc1)I 34a_100016989417_100000210303 [0,2,0,0,0,0|2,0,0]=4 7347 B12R1.1 CCCNCc1ccc(cc1)O 34a_100000185549_100000210303 [0,2,0,0,0,0|1,0,0]=3 7348 B12R1.1 CCCNCc1ccc(nc1)O 207a_100020643023_100011361521 [0,2,0,0,0,0|2,0,0]=4 7349 B12R1.1 CCCNCc1ccc(nc1)O 2230a_100000757128_100000210303 [0,2,0,0,0,0|2,0,0]=4 7350 B12R1.1 CCCOCc1cc[n+](cc1)C 34a_100009831711_100000210303 [0,2,0,0,0,0|2,0,0]=4 7351 B12R1.1 CCCOCc1cc[n+](cc1)[O-] 34a_100000031831_100000210303 [0,2,0,0,0,0|1,0,1]=4 7352 B12R1.1 CCCOCc1cc[n+](cc1)[O-] 7a_100000031831_100000210303 [0,2,0,0,0,0|1,0,1]=4 7353 B12R1.1 CCCOCc1ccc(=O)[nH]c1 34a_100011999846_100000210303 [0,2,0,0,0,0|1,0,1]=4 7354 B12R1.1 CCCOCc1ccc(cc1)Br 34a_100000210258_100000189115 [0,2,0,0,0,0|1,0,0]=3 7355 B12R1.1 CCCOCc1ccc(cc1)Br 34a_100000695286_100000210303 [0,2,0,0,0,0|1,0,0]=3 7356 B12R1.1 CCCOCc1ccc(cc1)C 34a_100000210258_100000210814 [0,2,0,0,0,0|1,0,0]=3 7357 B12R1.1 CCCOCc1ccc(cc1)C 34a_100011215236_100000210303 [0,2,0,0,0,0|1,0,0]=3 7358 B12R1.1 CCCOCc1ccc(cc1)C 7a_100011215236_100000210303 [0,2,0,0,0,0|1,0,0]=3 7359 B12R1.1 CCCOCc1ccc(cc1)Cl 34a_100000210258_100000694040 [0,2,0,0,0,0|1,0,0]=3 7360 B12R1.1 CCCOCc1ccc(cc1)Cl 34a_100000211118_100000210303 [0,2,0,0,0,0|1,0,0]=3 7361 B12R1.1 CCCOCc1ccc(cc1)Cl 7a_100000211118_100000210303 [0,2,0,0,0,0|1,0,0]=3 7362 B12R1.1 CCCOCc1ccc(cc1)F 34a_100000210258_100000198546 [0,2,0,0,0,0|1,0,0]=3 7363 B12R1.1 CCCOCc1ccc(cc1)F 34a_100000210977_100000210303 [0,2,0,0,0,0|1,0,0]=3 7364 B12R1.1 CCCOCc1ccc(cc1)F 7a_100000210977_100000210303 [0,2,0,0,0,0|1,0,0]=3 7365 B12R1.1 CCCOCc1ccc(cc1)I 34a_100000210258_100000189116 [0,2,0,0,0,0|1,0,0]=3 7366 B12R1.1 CCCOCc1ccc(cc1)I 34a_100000690907_100000210303 [0,2,0,0,0,0|1,0,0]=3 7367 B12R1.1 CCCOCc1ccc(cc1)I 7a_100000690907_100000210303 [0,2,0,0,0,0|1,0,0]=3 7368 B12R1.1 CCCOCc1ccc(cc1)N 34a_100011215238_100000210303 [0,2,0,0,0,0|1,0,0]=3 7369 B12R1.1 CCCOCc1ccc(cn1)Br 34a_100000210258_100000702658 [0,2,0,0,0,0|2,0,0]=4 7370 B12R1.1 CCCOCc1ccc(cn1)Br 34a_100000754261_100000210303 [0,2,0,0,0,0|2,0,0]=4 7371 B12R1.1 CCCOCc1ccc(cn1)C 34a_100000210258_100000691093 [0,2,0,0,0,0|2,0,0]=4 7372 B12R1.1 CCCOCc1ccc(cn1)C 34a_100012001401_100000210303 [0,2,0,0,0,0|2,0,0]=4 7373 B12R1.1 CCCOCc1ccc(cn1)Cl 34a_100000210258_100012066911 [0,2,0,0,0,0|2,0,0]=4 7374 B12R1.1 CCCOCc1ccc(cn1)Cl 34a_100000703999_100000210303 [0,2,0,0,0,0|2,0,0]=4 7375 B12R1.1 CCCOCc1ccc(cn1)F 34a_100000210258_100000703193 [0,2,0,0,0,0|2,0,0]=4 7376 B12R1.1 CCCOCc1ccc(cn1)F 34a_100011999454_100000210303 [0,2,0,0,0,0|2,0,0]=4 7377 B12R1.1 CCCOCc1ccc(cn1)N 34a_100011998161_100000210303 [0,2,0,0,0,0|2,0,0]=4 7378 B12R1.1 CCCOCc1ccc(nc1)Br 34a_100000210258_100009831999 [0,2,0,0,0,0|2,0,0]=4 7379 B12R1.1 CCCOCc1ccc(nc1)Br 34a_100009816760_100000210303 [0,2,0,0,0,0|2,0,0]=4 7380 B12R1.1 CCCOCc1ccc(nc1)Br 7a_100009816760_100000210303 [0,2,0,0,0,0|2,0,0]=4 7381 B12R1.1 CCCOCc1ccc(nc1)C 34a_100000210258_100016987292 [0,2,0,0,0,0|2,0,0]=4 7382 B12R1.1 CCCOCc1ccc(nc1)C 34a_100011248133_100000210303 [0,2,0,0,0,0|2,0,0]=4 7383 B12R1.1 CCCOCc1ccc(nc1)Cl 34a_100000210258_100000735431 [0,2,0,0,0,0|2,0,0]=4 7384 B12R1.1 CCCOCc1ccc(nc1)Cl 34a_100000755211_100000210303 [0,2,0,0,0,0|2,0,0]=4 7385 B12R1.1 CCCOCc1ccc(nc1)Cl 7a_100000755211_100000210303 [0,2,0,0,0,0|2,0,0]=4 7386 B12R1.1 CCCOCc1ccc(nc1)F 34a_100000079959_100000210303 [0,2,0,0,0,0|2,0,0]=4 7387 B12R1.1 CCCOCc1ccc(nc1)F 34a_100000210258_100000099788 [0,2,0,0,0,0|2,0,0]=4 7388 B12R1.1 CCCOCc1ccc(nc1)N 34a_100000704267_100000210303 [0,2,0,0,0,0|2,0,0]=4 7389 B12R1.1 CCCSCc1ccc(cc1)Br 62a_100000189115_100000210303 [0,2,0,0,0,0|1,1,0]=4 7390 B12R1.1 CCCSCc1ccc(cc1)Br 62a_100000210303_100000189115 [0,2,0,0,0,0|1,1,0]=4 7391 B12R1.1 CCCSCc1ccc(cc1)C 62a_100000210303_100000210814 [0,2,0,0,0,0|1,1,0]=4 7392 B12R1.1 CCCSCc1ccc(cc1)C 62a_100000210814_100000210303 [0,2,0,0,0,0|1,1,0]=4 7393 B12R1.1 CCCSCc1ccc(cc1)Cl 62a_100000187161_100000210303 [0,2,0,0,0,0|1,1,0]=4 7394 B12R1.1 CCCSCc1ccc(cc1)Cl 62a_100000210303_100000187161 [0,2,0,0,0,0|1,1,0]=4 7395 B12R1.1 CCCSCc1ccc(cc1)F 62a_100000198546_100000210303 [0,2,0,0,0,0|1,1,0]=4 7396 B12R1.1 CCCSCc1ccc(cc1)F 62a_100000210303_100000187164 [0,2,0,0,0,0|1,1,0]=4 7397 B12R1.1 CCCSCc1ccc(cc1)I 62a_100000189116_100000210303 [0,2,0,0,0,0|1,1,0]=4 7398 B12R1.1 CCCSCc1ccc(cc1)I 62a_100000210303_100000189116 [0,2,0,0,0,0|1,1,0]=4 7399 B12R1.1 CCNCCc1ccc(cc1)Br 2230a_100000755846_100000210202 [0,2,0,0,0,0|2,0,0]=4 7400 B12R1.1 CCNCCc1ccc(cc1)Br 2230a_100015525214_100011740612 [0,2,0,0,0,0|2,0,0]=4 7401 B12R1.1 CCNCCc1ccc(cc1)Br 34a_100000755846_100000210202 [0,2,0,0,0,0|2,0,0]=4 7402 B12R1.1 CCNCCc1ccc(cc1)C 2230a_100000705350_100000210202 [0,2,0,0,0,0|2,0,0]=4 7403 B12R1.1 CCNCCc1ccc(cc1)C 2230a_100015525214_100011713686 [0,2,0,0,0,0|2,0,0]=4 7404 B12R1.1 CCNCCc1ccc(cc1)C 34a_100000705350_100000210202 [0,2,0,0,0,0|2,0,0]=4 7405 B12R1.1 CCNCCc1ccc(cc1)Cl 2230a_100000185265_100000210202 [0,2,0,0,0,0|2,0,0]=4 7406 B12R1.1 CCNCCc1ccc(cc1)Cl 2230a_100015525214_100011713675 [0,2,0,0,0,0|2,0,0]=4 7407 B12R1.1 CCNCCc1ccc(cc1)Cl 34a_100000185265_100000210202 [0,2,0,0,0,0|2,0,0]=4 7408 B12R1.1 CCNCCc1ccc(cc1)F 2230a_100000199005_100000210202 [0,2,0,0,0,0|2,0,0]=4 7409 B12R1.1 CCNCCc1ccc(cc1)F 2230a_100015525214_100011217392 [0,2,0,0,0,0|2,0,0]=4 7410 B12R1.1 CCNCCc1ccc(cc1)F 34a_100000199005_100000210202 [0,2,0,0,0,0|2,0,0]=4 7411 B12R1.1 CCNCCc1ccc(cc1)O 2230a_100015525214_100009816426 [0,2,0,0,0,0|1,0,0]=3 7412 B12R1.1 CCNCCc1ccc(cc1)O 34a_100000743037_100000210202 [0,2,0,0,0,0|1,0,0]=3 7413 B12R1.1 CCNN=Cc1ccc(cc1)Br 4a_100000756455_100000186029 [0,2,0,0,0,0|2,0,0]=4 7414 B12R1.1 CCNN=Cc1ccc(cc1)C 4a_100000756455_100000211033 [0,2,0,0,0,0|2,0,0]=4 7415 B12R1.1 CCNN=Cc1ccc(cc1)Cl 4a_100000756455_100000189385 [0,2,0,0,0,0|2,0,0]=4 7416 B12R1.1 CCNN=Cc1ccc(cc1)F 4a_100000756455_100000210084 [0,2,0,0,0,0|2,0,0]=4 7417 B12R1.1 CCNN=Cc1ccc(cc1)I 4a_100000756455_100000188517 [0,2,0,0,0,0|2,0,0]=4 7418 B12R1.1 CCNN=Cc1ccc(cc1)O 4a_100000756455_100000185832 [0,2,0,0,0,0|1,0,0]=3 7419 B12R1.1 CCNN=Cc1ccc(cn1)O 4a_100000756455_100000059846 [0,2,0,0,0,0|2,0,0]=4 7420 B12R1.1 CCNN=Cc1ccc(nc1)O 4a_100000756455_100011361521 [0,2,0,0,0,0|2,0,0]=4 7421 B12R1.1 CCOC=Cc1cc[n+](cc1)[O-] 271570a_100016256518_100000039755 [0,2,0,0,0,0|1,0,1]=4 7422 B12R1.1 CCOC=Cc1ccc(=O)[nH]c1 271570a_100016256518_100000212171 [0,2,0,0,0,0|1,0,1]=4 7423 B12R1.1 CCOC=Cc1ccc(cc1)Br 271570a_100016256518_100000752885 [0,2,0,0,0,0|1,0,0]=3 7424 B12R1.1 CCOC=Cc1ccc(cc1)C 271570a_100016256518_100000186775 [0,2,0,0,0,0|1,0,0]=3 7425 B12R1.1 CCOC=Cc1ccc(cc1)Cl 271570a_100016256518_100000755918 [0,2,0,0,0,0|1,0,0]=3 7426 B12R1.1 CCOC=Cc1ccc(cc1)F 271570a_100016256518_100000211213 [0,2,0,0,0,0|1,0,0]=3 7427 B12R1.1 CCOC=Cc1ccc(cc1)N 271570a_100016256518_100000185761 [0,2,0,0,0,0|1,0,0]=3 7428 B12R1.1 CCOC=Cc1ccc(cc1)O 271570a_100016256518_100000185759 [0,2,0,0,0,0|0,0,0]=2 7429 B12R1.1 CCOC=Cc1ccc(cn1)Br 271570a_100016256518_100000686858 [0,2,0,0,0,0|2,0,0]=4 7430 B12R1.1 CCOC=Cc1ccc(cn1)C 271570a_100016256518_100000754016 [0,2,0,0,0,0|2,0,0]=4 7431 B12R1.1 CCOC=Cc1ccc(cn1)Cl 271570a_100016256518_100011356976 [0,2,0,0,0,0|2,0,0]=4 7432 B12R1.1 CCOC=Cc1ccc(cn1)F 271570a_100016256518_100000744514 [0,2,0,0,0,0|2,0,0]=4 7433 B12R1.1 CCOC=Cc1ccc(cn1)N 271570a_100016256518_100000744251 [0,2,0,0,0,0|2,0,0]=4 7434 B12R1.1 CCOC=Cc1ccc(cn1)O 271570a_100016256518_100000685995 [0,2,0,0,0,0|1,0,0]=3 7435 B12R1.1 CCOC=Cc1ccc(nc1)Br 271570a_100016256518_100009814638 [0,2,0,0,0,0|2,0,0]=4 7436 B12R1.1 CCOC=Cc1ccc(nc1)C 271570a_100016256518_100000751577 [0,2,0,0,0,0|2,0,0]=4 7437 B12R1.1 CCOC=Cc1ccc(nc1)Cl 271570a_100016256518_100000034144 [0,2,0,0,0,0|2,0,0]=4 7438 B12R1.1 CCOC=Cc1ccc(nc1)F 271570a_100016256518_100000748661 [0,2,0,0,0,0|2,0,0]=4 7439 B12R1.1 CCOC=Cc1ccc(nc1)N 271570a_100016256518_100000187370 [0,2,0,0,0,0|2,0,0]=4 7440 B12R1.1 CCOC=Cc1ncc(cn1)O 271570a_100016256518_100000730009 [0,2,0,0,0,0|2,0,0]=4 7441 B12R1.1 CCOCCc1ccc(cc1)Br 34a_100000766406_100000210202 [0,2,0,0,0,0|1,0,0]=3 7442 B12R1.1 CCOCCc1ccc(cc1)Br 34a_100121572206_100011740612 [0,2,0,0,0,0|1,0,0]=3 7443 B12R1.1 CCOCCc1ccc(cc1)Br 7a_100000766406_100000210202 [0,2,0,0,0,0|1,0,0]=3 7444 B12R1.1 CCOCCc1ccc(cc1)C 34a_100000756670_100000210202 [0,2,0,0,0,0|1,0,0]=3 7445 B12R1.1 CCOCCc1ccc(cc1)C 34a_100121572206_100011713686 [0,2,0,0,0,0|1,0,0]=3 7446 B12R1.1 CCOCCc1ccc(cc1)C 7a_100000756670_100000210202 [0,2,0,0,0,0|1,0,0]=3 7447 B12R1.1 CCOCCc1ccc(cc1)Cl 34a_100011219627_100000210202 [0,2,0,0,0,0|1,0,0]=3 7448 B12R1.1 CCOCCc1ccc(cc1)Cl 34a_100121572206_100011713675 [0,2,0,0,0,0|1,0,0]=3 7449 B12R1.1 CCOCCc1ccc(cc1)Cl 7a_100011219627_100000210202 [0,2,0,0,0,0|1,0,0]=3 7450 B12R1.1 CCOCCc1ccc(cc1)F 34a_100000754732_100000210202 [0,2,0,0,0,0|1,0,0]=3 7451 B12R1.1 CCOCCc1ccc(cc1)F 34a_100121572206_100011217392 [0,2,0,0,0,0|1,0,0]=3 7452 B12R1.1 CCOCCc1ccc(cc1)F 7a_100000754732_100000210202 [0,2,0,0,0,0|1,0,0]=3 7453 B12R1.1 CCOCCc1ccc(cc1)I 34a_100012291149_100000210202 [0,2,0,0,0,0|1,0,0]=3 7454 B12R1.1 CCOCCc1ccc(cc1)I 7a_100012291149_100000210202 [0,2,0,0,0,0|1,0,0]=3 7455 B12R1.1 CCOCCc1ccc(cc1)N 34a_100011204434_100000210202 [0,2,0,0,0,0|1,0,0]=3 7456 B12R1.1 CCOCCc1ccc(cn1)Br 34a_100012357577_100000210202 [0,2,0,0,0,0|2,0,0]=4 7457 B12R1.1 CCOCCc1ccc(nc1)C 34a_100011815783_100000210202 [0,2,0,0,0,0|2,0,0]=4 7458 B12R1.1 CCOCCc1ccc(nc1)Cl 34a_100009880866_100000210202 [0,2,0,0,0,0|2,0,0]=4 7459 B12R1.1 CCOCCc1ccc(nc1)Cl 7a_100009880866_100000210202 [0,2,0,0,0,0|2,0,0]=4 7460 B12R1.1 CCOCSc1cc[n+](cc1)[O-] 62a_100000739092_100000039755 [0,2,0,0,0,0|1,0,1]=4 7461 B12R1.1 CCOCSc1ccc(=O)[nH]c1 62a_100000212171_100000739092 [0,2,0,0,0,0|1,0,1]=4 7462 B12R1.1 CCOCSc1ccc(=O)[nH]c1 62a_100000739092_100000212171 [0,2,0,0,0,0|1,0,1]=4 7463 B12R1.1 CCOCSc1ccc(cc1)Br 62a_100000739092_100000752885 [0,2,0,0,0,0|1,0,0]=3 7464 B12R1.1 CCOCSc1ccc(cc1)Br 62a_100000752885_100000739092 [0,2,0,0,0,0|1,0,0]=3 7465 B12R1.1 CCOCSc1ccc(cc1)C 62a_100000186775_100000739092 [0,2,0,0,0,0|1,0,0]=3 7466 B12R1.1 CCOCSc1ccc(cc1)C 62a_100000739092_100000186775 [0,2,0,0,0,0|1,0,0]=3 7467 B12R1.1 CCOCSc1ccc(cc1)Cl 62a_100000739092_100000755918 [0,2,0,0,0,0|1,0,0]=3 7468 B12R1.1 CCOCSc1ccc(cc1)Cl 62a_100000755918_100000739092 [0,2,0,0,0,0|1,0,0]=3 7469 B12R1.1 CCOCSc1ccc(cc1)F 62a_100000211213_100000739092 [0,2,0,0,0,0|1,0,0]=3 7470 B12R1.1 CCOCSc1ccc(cc1)F 62a_100000739092_100000211213 [0,2,0,0,0,0|1,0,0]=3 7471 B12R1.1 CCOCSc1ccc(cc1)N 62a_100000185761_100000739092 [0,2,0,0,0,0|1,0,0]=3 7472 B12R1.1 CCOCSc1ccc(cc1)N 62a_100000739092_100000185761 [0,2,0,0,0,0|1,0,0]=3 7473 B12R1.1 CCOCSc1ccc(cc1)O 62a_100000739092_100000185759 [0,2,0,0,0,0|0,0,0]=2 7474 B12R1.1 CCOCSc1ccc(cn1)Br 62a_100000686858_100000739092 [0,2,0,0,0,0|2,0,0]=4 7475 B12R1.1 CCOCSc1ccc(cn1)Br 62a_100000739092_100000686858 [0,2,0,0,0,0|2,0,0]=4 7476 B12R1.1 CCOCSc1ccc(cn1)C 62a_100000739092_100000754016 [0,2,0,0,0,0|2,0,0]=4 7477 B12R1.1 CCOCSc1ccc(cn1)C 62a_100011192072_100000739092 [0,2,0,0,0,0|2,0,0]=4 7478 B12R1.1 CCOCSc1ccc(cn1)Cl 62a_100000739092_100011356976 [0,2,0,0,0,0|2,0,0]=4 7479 B12R1.1 CCOCSc1ccc(cn1)Cl 62a_100011356976_100000739092 [0,2,0,0,0,0|2,0,0]=4 7480 B12R1.1 CCOCSc1ccc(cn1)F 62a_100000739092_100000744514 [0,2,0,0,0,0|2,0,0]=4 7481 B12R1.1 CCOCSc1ccc(cn1)F 62a_100000744514_100000739092 [0,2,0,0,0,0|2,0,0]=4 7482 B12R1.1 CCOCSc1ccc(cn1)N 62a_100000737798_100000739092 [0,2,0,0,0,0|2,0,0]=4 7483 B12R1.1 CCOCSc1ccc(cn1)N 62a_100000739092_100000737798 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.1 CCOCSc1ccc(cn1)O 62a_100000685995_100000739092 [0,2,0,0,0,0|1,0,0]=3 7485 B12R1.1 CCOCSc1ccc(cn1)O 62a_100000739092_100000744096 [0,2,0,0,0,0|1,0,0]=3 7486 B12R1.1 CCOCSc1ccc(nc1)Br 62a_100000739092_100009814638 [0,2,0,0,0,0|2,0,0]=4 7487 B12R1.1 CCOCSc1ccc(nc1)Br 62a_100009814638_100000739092 [0,2,0,0,0,0|2,0,0]=4 7488 B12R1.1 CCOCSc1ccc(nc1)C 62a_100000739092_100000751577 [0,2,0,0,0,0|2,0,0]=4 7489 B12R1.1 CCOCSc1ccc(nc1)C 62a_100000751577_100000739092 [0,2,0,0,0,0|2,0,0]=4 7490 B12R1.1 CCOCSc1ccc(nc1)Cl 62a_100000034144_100000739092 [0,2,0,0,0,0|2,0,0]=4 7491 B12R1.1 CCOCSc1ccc(nc1)Cl 62a_100000739092_100000034144 [0,2,0,0,0,0|2,0,0]=4 7492 B12R1.1 CCOCSc1ccc(nc1)F 62a_100000042367_100000739092 [0,2,0,0,0,0|2,0,0]=4 7493 B12R1.1 CCOCSc1ccc(nc1)F 62a_100000739092_100000042367 [0,2,0,0,0,0|2,0,0]=4 7494 B12R1.1 CCOCSc1ccc(nc1)N 62a_100000187370_100000739092 [0,2,0,0,0,0|2,0,0]=4 7495 B12R1.1 CCOCSc1ccc(nc1)N 62a_100000739092_100000187370 [0,2,0,0,0,0|2,0,0]=4 7496 B12R1.1 CCOCSc1cnc(cn1)O 62a_100000739092_100015839800 [0,2,0,0,0,0|2,0,0]=4 7497 B12R1.1 CCOCSc1cnc(cn1)O 62a_100011934580_100000739092 [0,2,0,0,0,0|2,0,0]=4 7498 B12R1.1 CCOCSc1ncc(cn1)O 62a_100000730009_100000739092 [0,2,0,0,0,0|2,0,0]=4 7499 B12R1.1 CCOCSc1ncc(cn1)O 62a_100000739092_100000092845 [0,2,0,0,0,0|2,0,0]=4 7500 B12R1.1 CCSCCc1ccc(cc1)Br 62a_100000210202_100011740612 [0,2,0,0,0,0|1,1,0]=4 7501 B12R1.1 CCSCCc1ccc(cc1)Br 62a_100011740612_100000210202 [0,2,0,0,0,0|1,1,0]=4 7502 B12R1.1 CCSCCc1ccc(cc1)C 62a_100000210202_100011713686 [0,2,0,0,0,0|1,1,0]=4 7503 B12R1.1 CCSCCc1ccc(cc1)C 62a_100011713686_100000210202 [0,2,0,0,0,0|1,1,0]=4 7504 B12R1.1 CCSCCc1ccc(cc1)Cl 62a_100000210202_100011713675 [0,2,0,0,0,0|1,1,0]=4 7505 B12R1.1 CCSCCc1ccc(cc1)Cl 62a_100011713675_100000210202 [0,2,0,0,0,0|1,1,0]=4 7506 B12R1.1 CCSCCc1ccc(cc1)F 62a_100000210202_100011217392 [0,2,0,0,0,0|1,1,0]=4 7507 B12R1.1 CCSCCc1ccc(cc1)F 62a_100011217392_100000210202 [0,2,0,0,0,0|1,1,0]=4 7508 B12R1.1 CCSCCc1ccc(cc1)O 62a_100000210202_100009816426 [0,2,0,0,0,0|0,1,0]=3 7509 B12R1.1 CCSCCc1ccc(cc1)O 62a_100009816426_100000210202 [0,2,0,0,0,0|0,1,0]=3 7510 B12R1.1 CNCC#Cc1ccc(cc1)Br 2230a_106832991635_100010706785 [0,2,0,0,0,0|2,0,0]=4 7511 B12R1.1 CNCC#Cc1ccc(cc1)Br 34a_100102657272_100010706785 [0,2,0,0,0,0|2,0,0]=4 7512 B12R1.1 CNCC#Cc1ccc(cc1)Br 7a_106832991635_100010706785 [0,2,0,0,0,0|2,0,0]=4 7513 B12R1.1 CNCC#Cc1ccc(cc1)Cl 2230a_100011352944_200000210301 [0,2,0,0,0,0|2,0,0]=4 7514 B12R1.1 CNCC#Cc1ccc(cc1)Cl 34a_100011352944_200000210301 [0,2,0,0,0,0|2,0,0]=4 7515 B12R1.1 CNCC#Cc1ccc(cc1)F 2230a_106832991635_100010402171 [0,2,0,0,0,0|2,0,0]=4 7516 B12R1.1 CNCC#Cc1ccc(cc1)F 34a_100102657272_100010402171 [0,2,0,0,0,0|2,0,0]=4 7517 B12R1.1 CNCC#Cc1ccc(cc1)F 7a_106832991635_100010402171 [0,2,0,0,0,0|2,0,0]=4 7518 B12R1.1 CNCC=Cc1ccc(cc1)Br 270004a_106832991635_100016291818 [0,2,0,0,0,0|2,0,0]=4 7519 B12R1.1 CNCC=Cc1ccc(cc1)C 270004a_106832991635_100016257026 [0,2,0,0,0,0|2,0,0]=4 7520 B12R1.1 CNCC=Cc1ccc(cc1)Cl 270004a_106832991635_100102525842 [0,2,0,0,0,0|2,0,0]=4 7521 B12R1.1 CNCC=Cc1ccc(cc1)F 270004a_106832991635_100016272083 [0,2,0,0,0,0|2,0,0]=4 7522 B12R1.1 CNCCCc1ccc(cc1)Br 2230a_100011297623_200000210301 [0,2,0,0,0,0|2,0,0]=4 7523 B12R1.1 CNCCCc1ccc(cc1)Br 2230a_106832991635_100011713682 [0,2,0,0,0,0|2,0,0]=4 7524 B12R1.1 CNCCCc1ccc(cc1)Br 34a_100011297623_200000210301 [0,2,0,0,0,0|2,0,0]=4 7525 B12R1.1 CNCCCc1ccc(cc1)Br 34a_100102657272_100011713682 [0,2,0,0,0,0|2,0,0]=4 7526 B12R1.1 CNCCCc1ccc(cc1)Br 7a_106832991635_100011713682 [0,2,0,0,0,0|2,0,0]=4 7527 B12R1.1 CNCCCc1ccc(cc1)C 2230a_100011236272_200000210301 [0,2,0,0,0,0|2,0,0]=4 7528 B12R1.1 CNCCCc1ccc(cc1)C 34a_100011236272_200000210301 [0,2,0,0,0,0|2,0,0]=4 7529 B12R1.1 CNCCCc1ccc(cc1)Cl 2230a_100000748451_200000210301 [0,2,0,0,0,0|2,0,0]=4 7530 B12R1.1 CNCCCc1ccc(cc1)Cl 2230a_106832991635_100000759440 [0,2,0,0,0,0|2,0,0]=4 7531 B12R1.1 CNCCCc1ccc(cc1)Cl 34a_100000748451_200000210301 [0,2,0,0,0,0|2,0,0]=4 7532 B12R1.1 CNCCCc1ccc(cc1)Cl 34a_100102657272_100000759440 [0,2,0,0,0,0|2,0,0]=4 7533 B12R1.1 CNCCCc1ccc(cc1)Cl 7a_106832991635_100000759440 [0,2,0,0,0,0|2,0,0]=4 7534 B12R1.1 CNCCCc1ccc(cc1)F 2230a_100025745824_200000210301 [0,2,0,0,0,0|2,0,0]=4 7535 B12R1.1 CNCCCc1ccc(cc1)F 2230a_106832991635_200011713563 [0,2,0,0,0,0|2,0,0]=4 7536 B12R1.1 CNCCCc1ccc(cc1)F 34a_100025745824_200000210301 [0,2,0,0,0,0|2,0,0]=4 7537 B12R1.1 CNCCCc1ccc(cc1)F 34a_100102657272_200011713563 [0,2,0,0,0,0|2,0,0]=4 7538 B12R1.1 CNCCCc1ccc(cc1)F 7a_106832991635_200011713563 [0,2,0,0,0,0|2,0,0]=4 7539 B12R1.1 CNCCOc1ccc(cc1)Br 2230a_100000746992_200000210301 [0,2,0,0,0,0|1,0,0]=3 7540 B12R1.1 CNCCOc1ccc(cc1)Br 2230a_106832991635_100000183278 [0,2,0,0,0,0|1,0,0]=3 7541 B12R1.1 CNCCOc1ccc(cc1)Br 34a_100000746992_200000210301 [0,2,0,0,0,0|1,0,0]=3 7542 B12R1.1 CNCCOc1ccc(cc1)Br 34a_100102657272_100000183278 [0,2,0,0,0,0|1,0,0]=3 7543 B12R1.1 CNCCOc1ccc(cc1)Br 7a_106832991635_100000183278 [0,2,0,0,0,0|1,0,0]=3 7544 B12R1.1 CNCCOc1ccc(cc1)C 2230a_100020666663_200000210301 [0,2,0,0,0,0|1,0,0]=3 7545 B12R1.1 CNCCOc1ccc(cc1)C 2230a_106832991635_100000183172 [0,2,0,0,0,0|1,0,0]=3 7546 B12R1.1 CNCCOc1ccc(cc1)C 34a_100020666663_200000210301 [0,2,0,0,0,0|1,0,0]=3 7547 B12R1.1 CNCCOc1ccc(cc1)C 34a_100102657272_100000183172 [0,2,0,0,0,0|1,0,0]=3 7548 B12R1.1 CNCCOc1ccc(cc1)C 7a_106832991635_100000183172 [0,2,0,0,0,0|1,0,0]=3 7549 B12R1.1 CNCCOc1ccc(cc1)Cl 2230a_100000697975_200000210301 [0,2,0,0,0,0|1,0,0]=3 7550 B12R1.1 CNCCOc1ccc(cc1)Cl 2230a_106832991635_100000184122 [0,2,0,0,0,0|1,0,0]=3 7551 B12R1.1 CNCCOc1ccc(cc1)Cl 34a_100000697975_200000210301 [0,2,0,0,0,0|1,0,0]=3 7552 B12R1.1 CNCCOc1ccc(cc1)Cl 34a_100102657272_100000184122 [0,2,0,0,0,0|1,0,0]=3 7553 B12R1.1 CNCCOc1ccc(cc1)Cl 7a_106832991635_100000184122 [0,2,0,0,0,0|1,0,0]=3 7554 B12R1.1 CNCCOc1ccc(cc1)F 2230a_100000737420_200000210301 [0,2,0,0,0,0|1,0,0]=3 7555 B12R1.1 CNCCOc1ccc(cc1)F 2230a_106832991635_100000184936 [0,2,0,0,0,0|1,0,0]=3 7556 B12R1.1 CNCCOc1ccc(cc1)F 34a_100000737420_200000210301 [0,2,0,0,0,0|1,0,0]=3 7557 B12R1.1 CNCCOc1ccc(cc1)F 34a_100102657272_100000184936 [0,2,0,0,0,0|1,0,0]=3 7558 B12R1.1 CNCCOc1ccc(cc1)F 7a_106832991635_100000184936 [0,2,0,0,0,0|1,0,0]=3 7559 B12R1.1 CNCCSc1ccc(cc1)Br 2230a_100000184645_200000210301 [0,2,0,0,0,0|1,1,0]=4 7560 B12R1.1 CNCCSc1ccc(cc1)C 2230a_100000739754_200000210301 [0,2,0,0,0,0|1,1,0]=4 7561 B12R1.1 CNCCSc1ccc(cc1)Cl 2230a_100000174974_200000210301 [0,2,0,0,0,0|1,1,0]=4 7562 B12R1.1 COCC#Cc1ccc(cc1)Br 34a_100009814260_200000210301 [0,2,0,0,0,0|2,0,0]=4 7563 B12R1.1 COCC#Cc1ccc(cc1)Br 34a_100138415774_100010706785 [0,2,0,0,0,0|2,0,0]=4 7564 B12R1.1 COCC#Cc1ccc(cc1)Br 7a_100009814260_200000210301 [0,2,0,0,0,0|2,0,0]=4 7565 B12R1.1 COCC#Cc1ccc(cc1)C 34a_100000696136_200000210301 [0,2,0,0,0,0|2,0,0]=4 7566 B12R1.1 COCC#Cc1ccc(cc1)C 7a_100000696136_200000210301 [0,2,0,0,0,0|2,0,0]=4 7567 B12R1.1 COCC#Cc1ccc(cc1)F 34a_100011219116_200000210301 [0,2,0,0,0,0|2,0,0]=4 7568 B12R1.1 COCC#Cc1ccc(cc1)F 34a_100138415774_100010402171 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.1 COCC#Cc1ccc(cc1)F 7a_100011219116_200000210301 [0,2,0,0,0,0|2,0,0]=4 7570 B12R1.1 COCC=Cc1ccc(cc1)Br 271570a_100016286323_100000752885 [0,2,0,0,0,0|2,0,0]=4 7571 B12R1.1 COCC=Cc1ccc(cc1)C 271570a_100016286323_100000186775 [0,2,0,0,0,0|2,0,0]=4 7572 B12R1.1 COCC=Cc1ccc(cc1)Cl 271570a_100016286323_100000755918 [0,2,0,0,0,0|2,0,0]=4 7573 B12R1.1 COCC=Cc1ccc(cc1)F 271570a_100016286323_100000211213 [0,2,0,0,0,0|2,0,0]=4 7574 B12R1.1 COCC=Cc1ccc(cc1)N 271570a_100016286323_100000185761 [0,2,0,0,0,0|2,0,0]=4 7575 B12R1.1 COCC=Cc1ccc(cc1)O 271570a_100016286323_100000185759 [0,2,0,0,0,0|1,0,0]=3 7576 B12R1.1 COCC=Cc1ccc(cn1)O 271570a_100016286323_100000685995 [0,2,0,0,0,0|2,0,0]=4 7577 B12R1.1 COCCCc1ccc(cc1)Br 34a_100011709247_200000210301 [0,2,0,0,0,0|2,0,0]=4 7578 B12R1.1 COCCCc1ccc(cc1)Br 34a_100138415774_100011713682 [0,2,0,0,0,0|2,0,0]=4 7579 B12R1.1 COCCCc1ccc(cc1)Br 7a_100011709247_200000210301 [0,2,0,0,0,0|2,0,0]=4 7580 B12R1.1 COCCCc1ccc(cc1)C 34a_100000189427_200000210301 [0,2,0,0,0,0|2,0,0]=4 7581 B12R1.1 COCCCc1ccc(cc1)C 7a_100000189427_200000210301 [0,2,0,0,0,0|2,0,0]=4 7582 B12R1.1 COCCCc1ccc(cc1)Cl 34a_100011217485_200000210301 [0,2,0,0,0,0|2,0,0]=4 7583 B12R1.1 COCCCc1ccc(cc1)Cl 34a_100138415774_100000759440 [0,2,0,0,0,0|2,0,0]=4 7584 B12R1.1 COCCCc1ccc(cc1)Cl 7a_100011217485_200000210301 [0,2,0,0,0,0|2,0,0]=4 7585 B12R1.1 COCCCc1ccc(cc1)F 34a_100000757351_200000210301 [0,2,0,0,0,0|2,0,0]=4 7586 B12R1.1 COCCCc1ccc(cc1)F 34a_100138415774_200011713563 [0,2,0,0,0,0|2,0,0]=4 7587 B12R1.1 COCCCc1ccc(cc1)F 7a_100000757351_200000210301 [0,2,0,0,0,0|2,0,0]=4 7588 B12R1.1 COCCNc1ccc(cc1)Br 2230a_100000210018_100011201679 [0,2,0,0,0,0|2,0,0]=4 7589 B12R1.1 COCCNc1ccc(cc1)Br 34a_100000210018_100011201679 [0,2,0,0,0,0|2,0,0]=4 7590 B12R1.1 COCCNc1ccc(cc1)C 34a_100000124888_100011201679 [0,2,0,0,0,0|2,0,0]=4 7591 B12R1.1 COCCNc1ccc(cc1)Cl 2230a_100000210052_100011201679 [0,2,0,0,0,0|2,0,0]=4 7592 B12R1.1 COCCNc1ccc(cc1)Cl 34a_100000210052_100011201679 [0,2,0,0,0,0|2,0,0]=4 7593 B12R1.1 COCCNc1ccc(cc1)F 34a_100000185862_100011201679 [0,2,0,0,0,0|2,0,0]=4 7594 B12R1.1 COCCNc1ccc(cc1)I 34a_100000185761_100011201679 [0,2,0,0,0,0|2,0,0]=4 7595 B12R1.1 COCCNc1ccc(cc1)O 34a_100000185829_100011201679 [0,2,0,0,0,0|1,0,0]=3 7596 B12R1.1 COCCOc1ccc(=O)[nH]c1 34a_100000075641_100011201679 [0,2,0,0,0,0|1,0,1]=4 7597 B12R1.1 COCCOc1ccc(cc1)Br 34a_100000185759_100011201679 [0,2,0,0,0,0|1,0,0]=3 7598 B12R1.1 COCCOc1ccc(cc1)Br 34a_100000686261_200000210301 [0,2,0,0,0,0|1,0,0]=3 7599 B12R1.1 COCCOc1ccc(cc1)Br 34a_100138415774_100000183278 [0,2,0,0,0,0|1,0,0]=3 7600 B12R1.1 COCCOc1ccc(cc1)Br 7a_100000185759_100000233755 [0,2,0,0,0,0|1,0,0]=3 7601 B12R1.1 COCCOc1ccc(cc1)Br 7a_100000686261_200000210301 [0,2,0,0,0,0|1,0,0]=3 7602 B12R1.1 COCCOc1ccc(cc1)C 34a_100000210336_100011201679 [0,2,0,0,0,0|1,0,0]=3 7603 B12R1.1 COCCOc1ccc(cc1)C 34a_100011219107_200000210301 [0,2,0,0,0,0|1,0,0]=3 7604 B12R1.1 COCCOc1ccc(cc1)C 34a_100138415774_100000183172 [0,2,0,0,0,0|1,0,0]=3 7605 B12R1.1 COCCOc1ccc(cc1)C 7a_100000210336_100000233755 [0,2,0,0,0,0|1,0,0]=3 7606 B12R1.1 COCCOc1ccc(cc1)C 7a_100011219107_200000210301 [0,2,0,0,0,0|1,0,0]=3 7607 B12R1.1 COCCOc1ccc(cc1)Cl 34a_100000210216_100011201679 [0,2,0,0,0,0|1,0,0]=3 7608 B12R1.1 COCCOc1ccc(cc1)Cl 34a_100000237962_200000210301 [0,2,0,0,0,0|1,0,0]=3 7609 B12R1.1 COCCOc1ccc(cc1)Cl 34a_100138415774_100000184122 [0,2,0,0,0,0|1,0,0]=3 7610 B12R1.1 COCCOc1ccc(cc1)Cl 7a_100000210216_100000233755 [0,2,0,0,0,0|1,0,0]=3 7611 B12R1.1 COCCOc1ccc(cc1)Cl 7a_100000237962_200000210301 [0,2,0,0,0,0|1,0,0]=3 7612 B12R1.1 COCCOc1ccc(cc1)F 34a_100000210339_100011201679 [0,2,0,0,0,0|1,0,0]=3 7613 B12R1.1 COCCOc1ccc(cc1)F 34a_100138415774_100000184936 [0,2,0,0,0,0|1,0,0]=3 7614 B12R1.1 COCCOc1ccc(cc1)I 34a_100000212066_100011201679 [0,2,0,0,0,0|1,0,0]=3 7615 B12R1.1 COCCOc1ccc(cc1)I 7a_100000212066_100000233755 [0,2,0,0,0,0|1,0,0]=3 7616 B12R1.1 COCCOc1ccc(cc1)N 34a_100000185829_100011201679 [0,2,0,0,0,0|1,0,0]=3 7617 B12R1.1 COCCOc1ccc(cc1)N 34a_100000754363_200000210301 [0,2,0,0,0,0|1,0,0]=3 7618 B12R1.1 COCCOc1ccc(cc1)O 271570a_203496583355_100000234135 [0,2,0,0,0,0|0,0,0]=2 7619 B12R1.1 COCCOc1ccc(cn1)C 34a_100000759353_100011201679 [0,2,0,0,0,0|2,0,0]=4 7620 B12R1.1 COCCOc1ccc(cn1)Cl 34a_100011215309_100011201679 [0,2,0,0,0,0|2,0,0]=4 7621 B12R1.1 COCCOc1ccc(cn1)F 34a_100000742473_100011201679 [0,2,0,0,0,0|2,0,0]=4 7622 B12R1.1 COCCOc1ccc(cn1)N 34a_100000729260_100011201679 [0,2,0,0,0,0|2,0,0]=4 7623 B12R1.1 COCCOc1ccc(cn1)N 34a_100102662783_200000210301 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.1 COCCOc1ccc(cn1)O 271570a_203496583355_100000758753 [0,2,0,0,0,0|1,0,0]=3 7625 B12R1.1 COCCOc1ccc(nc1)Br 34a_100000685995_100011201679 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.1 COCCOc1ccc(nc1)Br 34a_200013150534_200000210301 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.1 COCCOc1ccc(nc1)Br 7a_100000685995_100000233755 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.1 COCCOc1ccc(nc1)Br 7a_200013150534_200000210301 [0,2,0,0,0,0|2,0,0]=4 7629 B12R1.1 COCCOc1ccc(nc1)C 34a_100000745506_100011201679 [0,2,0,0,0,0|2,0,0]=4 7630 B12R1.1 COCCOc1ccc(nc1)C 7a_100000745506_100000233755 [0,2,0,0,0,0|2,0,0]=4 7631 B12R1.1 COCCOc1ccc(nc1)Cl 34a_100000744096_100011201679 [0,2,0,0,0,0|2,0,0]=4 7632 B12R1.1 COCCOc1ccc(nc1)Cl 7a_100000744096_100000233755 [0,2,0,0,0,0|2,0,0]=4 7633 B12R1.1 COCCOc1ccc(nc1)F 34a_100000688820_100011201679 [0,2,0,0,0,0|2,0,0]=4 7634 B12R1.1 COCCOc1ccc(nc1)F 7a_100000688820_100000233755 [0,2,0,0,0,0|2,0,0]=4 7635 B12R1.1 COCCOc1ccc(nc1)I 34a_100000687607_100011201679 [0,2,0,0,0,0|2,0,0]=4 7636 B12R1.1 COCCOc1ccc(nc1)I 7a_100000687607_100000233755 [0,2,0,0,0,0|2,0,0]=4 7637 B12R1.1 COCCOc1ccc(nc1)N 34a_100015188713_100011201679 [0,2,0,0,0,0|2,0,0]=4 7638 B12R1.1 COCCOc1ccc(nc1)N 7a_100015188713_100000233755 [0,2,0,0,0,0|2,0,0]=4 7639 B12R1.1 COCCOc1ncc(cn1)O 271570a_203496583355_200011939457 [0,2,0,0,0,0|2,0,0]=4 7640 B12R1.1 COCCSc1ccc(cc1)Br 62a_100000233755_100000752885 [0,2,0,0,0,0|1,1,0]=4 7641 B12R1.1 COCCSc1ccc(cc1)Br 62a_100000752885_100000233755 [0,2,0,0,0,0|1,1,0]=4 7642 B12R1.1 COCCSc1ccc(cc1)C 34a_200000230582_200000210301 [0,2,0,0,0,0|1,1,0]=4 7643 B12R1.1 COCCSc1ccc(cc1)C 62a_100000186775_100000233755 [0,2,0,0,0,0|1,1,0]=4 7644 B12R1.1 COCCSc1ccc(cc1)C 62a_100000233755_100000186775 [0,2,0,0,0,0|1,1,0]=4 7645 B12R1.1 COCCSc1ccc(cc1)C 7a_200000230582_200000210301 [0,2,0,0,0,0|1,1,0]=4 7646 B12R1.1 COCCSc1ccc(cc1)Cl 34a_100000230527_200000210301 [0,2,0,0,0,0|1,1,0]=4 7647 B12R1.1 COCCSc1ccc(cc1)Cl 62a_100000233755_100000755918 [0,2,0,0,0,0|1,1,0]=4 7648 B12R1.1 COCCSc1ccc(cc1)Cl 62a_100000755918_100000233755 [0,2,0,0,0,0|1,1,0]=4 7649 B12R1.1 COCCSc1ccc(cc1)Cl 7a_100000230527_200000210301 [0,2,0,0,0,0|1,1,0]=4 7650 B12R1.1 COCCSc1ccc(cc1)F 34a_200000230679_200000210301 [0,2,0,0,0,0|1,1,0]=4 7651 B12R1.1 COCCSc1ccc(cc1)F 62a_100000211213_100000233755 [0,2,0,0,0,0|1,1,0]=4 7652 B12R1.1 COCCSc1ccc(cc1)F 62a_100000233755_100000211213 [0,2,0,0,0,0|1,1,0]=4 7653 B12R1.1 COCCSc1ccc(cc1)F 7a_200000230679_200000210301 [0,2,0,0,0,0|1,1,0]=4 7654 B12R1.1 COCCSc1ccc(cc1)N 62a_100000185761_100000233755 [0,2,0,0,0,0|1,1,0]=4 7655 B12R1.1 COCCSc1ccc(cc1)N 62a_100000233755_100000185761 [0,2,0,0,0,0|1,1,0]=4 7656 B12R1.1 COCCSc1ccc(cc1)O 271570a_203496583355_200009813259 [0,2,0,0,0,0|0,1,0]=3 7657 B12R1.1 COCCSc1ccc(cc1)O 62a_100000233755_100000185759 [0,2,0,0,0,0|0,1,0]=3 7658 B12R1.1 COCCSc1ccc(cn1)O 62a_100000233755_100000744096 [0,2,0,0,0,0|1,1,0]=4 7659 B12R1.1 COCCSc1ccc(cn1)O 62a_100000685995_100000233755 [0,2,0,0,0,0|1,1,0]=4 7660 B12R1.1 COCNCc1ccc(cc1)Br 2230a_100000174875_100000766300 [0,2,0,0,0,0|2,0,0]=4 7661 B12R1.1 COCNCc1ccc(cc1)C 2230a_100000174908_100000766300 [0,2,0,0,0,0|2,0,0]=4 7662 B12R1.1 COCNCc1ccc(cc1)Cl 2230a_100000174871_100000766300 [0,2,0,0,0,0|2,0,0]=4 7663 B12R1.1 COCNCc1ccc(cc1)F 2230a_100000174882_100000766300 [0,2,0,0,0,0|2,0,0]=4 7664 B12R1.1 COCNCc1ccc(cc1)I 2230a_100016989417_100000766300 [0,2,0,0,0,0|2,0,0]=4 7665 B12R1.1 COCNCc1ccc(nc1)O 2230a_100000757128_100000766300 [0,2,0,0,0,0|2,0,0]=4 7666 B12R1.1 COCSCc1ccc(cc1)Br 62a_100000189115_100000766300 [0,2,0,0,0,0|1,1,0]=4 7667 B12R1.1 COCSCc1ccc(cc1)Br 62a_100000766300_100000189115 [0,2,0,0,0,0|1,1,0]=4 7668 B12R1.1 COCSCc1ccc(cc1)C 62a_100000210814_100000766300 [0,2,0,0,0,0|1,1,0]=4 7669 B12R1.1 COCSCc1ccc(cc1)C 62a_100000766300_100000210814 [0,2,0,0,0,0|1,1,0]=4 7670 B12R1.1 COCSCc1ccc(cc1)Cl 62a_100000187161_100000766300 [0,2,0,0,0,0|1,1,0]=4 7671 B12R1.1 COCSCc1ccc(cc1)Cl 62a_100000766300_100000187161 [0,2,0,0,0,0|1,1,0]=4 7672 B12R1.1 COCSCc1ccc(cc1)F 62a_100000198546_100000766300 [0,2,0,0,0,0|1,1,0]=4 7673 B12R1.1 COCSCc1ccc(cc1)F 62a_100000766300_100000187164 [0,2,0,0,0,0|1,1,0]=4 7674 B12R1.1 COCSCc1ccc(cc1)I 62a_100000189116_100000766300 [0,2,0,0,0,0|1,1,0]=4 7675 B12R1.1 COCSCc1ccc(cc1)I 62a_100000766300_100000189116 [0,2,0,0,0,0|1,1,0]=4 7676 B12R1.1 CSCC#Cc1ccc(cc1)Br 62a_100010706785_200000210301 [0,2,0,0,0,0|2,0,0]=4 7677 B12R1.1 CSCC#Cc1ccc(cc1)Br 62a_200000210301_100010706785 [0,2,0,0,0,0|2,0,0]=4 7678 B12R1.1 CSCC#Cc1ccc(cc1)F 62a_100010402171_200000210301 [0,2,0,0,0,0|2,0,0]=4 7679 B12R1.1 CSCC#Cc1ccc(cc1)F 62a_200000210301_100010402171 [0,2,0,0,0,0|2,0,0]=4 7680 B12R1.1 CSCCCc1ccc(cc1)Br 62a_100011713682_200000210301 [0,2,0,0,0,0|2,0,0]=4 7681 B12R1.1 CSCCCc1ccc(cc1)Br 62a_200000210301_100011713682 [0,2,0,0,0,0|2,0,0]=4 7682 B12R1.1 CSCCCc1ccc(cc1)Cl 62a_100000759440_200000210301 [0,2,0,0,0,0|2,0,0]=4 7683 B12R1.1 CSCCCc1ccc(cc1)Cl 62a_200000210301_100000759440 [0,2,0,0,0,0|2,0,0]=4 7684 B12R1.1 CSCCCc1ccc(cc1)F 62a_200000210301_200011713563 [0,2,0,0,0,0|2,0,0]=4 7685 B12R1.1 CSCCCc1ccc(cc1)F 62a_200011713563_200000210301 [0,2,0,0,0,0|2,0,0]=4 7686 B12R1.1 CSCCNc1ccc(cc1)Br 2230a_100000210018_100000751147 [0,2,0,0,0,0|2,0,0]=4 7687 B12R1.1 CSCCNc1ccc(cc1)Br 34a_100000210018_100000212216 [0,2,0,0,0,0|2,0,0]=4 7688 B12R1.1 CSCCNc1ccc(cc1)C 34a_100000124888_100000212216 [0,2,0,0,0,0|2,0,0]=4 7689 B12R1.1 CSCCNc1ccc(cc1)Cl 2230a_100000210052_100000751147 [0,2,0,0,0,0|2,0,0]=4 7690 B12R1.1 CSCCNc1ccc(cc1)Cl 34a_100000210052_100000212216 [0,2,0,0,0,0|2,0,0]=4 7691 B12R1.1 CSCCNc1ccc(cc1)F 34a_100000185862_100000212216 [0,2,0,0,0,0|2,0,0]=4 7692 B12R1.1 CSCCNc1ccc(cc1)I 34a_100000185761_100000212216 [0,2,0,0,0,0|2,0,0]=4 7693 B12R1.1 CSCCNc1ccc(cc1)O 34a_100000185829_100000212216 [0,2,0,0,0,0|1,0,0]=3 7694 B12R1.1 CSCCOc1ccc(=O)[nH]c1 34a_100000075641_100000212216 [0,2,0,0,0,0|1,0,1]=4 7695 B12R1.1 CSCCOc1ccc(cc1)Br 34a_100000185759_100000212216 [0,2,0,0,0,0|1,0,0]=3 7696 B12R1.1 CSCCOc1ccc(cc1)Br 62a_100000183278_200000210301 [0,2,0,0,0,0|1,0,0]=3 7697 B12R1.1 CSCCOc1ccc(cc1)Br 62a_200000210301_100000183278 [0,2,0,0,0,0|1,0,0]=3 7698 B12R1.1 CSCCOc1ccc(cc1)Br 7a_100000185759_100000212216 [0,2,0,0,0,0|1,0,0]=3 7699 B12R1.1 CSCCOc1ccc(cc1)C 34a_100000210336_100000212216 [0,2,0,0,0,0|1,0,0]=3 7700 B12R1.1 CSCCOc1ccc(cc1)C 62a_100000183172_200000210301 [0,2,0,0,0,0|1,0,0]=3 7701 B12R1.1 CSCCOc1ccc(cc1)C 62a_200000210301_100000183172 [0,2,0,0,0,0|1,0,0]=3 7702 B12R1.1 CSCCOc1ccc(cc1)C 7a_100000210336_100000212216 [0,2,0,0,0,0|1,0,0]=3 7703 B12R1.1 CSCCOc1ccc(cc1)Cl 34a_100000210216_100000212216 [0,2,0,0,0,0|1,0,0]=3 7704 B12R1.1 CSCCOc1ccc(cc1)Cl 62a_100000184122_200000210301 [0,2,0,0,0,0|1,0,0]=3 7705 B12R1.1 CSCCOc1ccc(cc1)Cl 62a_200000210301_100000184122 [0,2,0,0,0,0|1,0,0]=3 7706 B12R1.1 CSCCOc1ccc(cc1)Cl 7a_100000210216_100000212216 [0,2,0,0,0,0|1,0,0]=3 7707 B12R1.1 CSCCOc1ccc(cc1)F 34a_100000210339_100000212216 [0,2,0,0,0,0|1,0,0]=3 7708 B12R1.1 CSCCOc1ccc(cc1)F 62a_100000184936_200000210301 [0,2,0,0,0,0|1,0,0]=3 7709 B12R1.1 CSCCOc1ccc(cc1)F 62a_200000210301_100000184936 [0,2,0,0,0,0|1,0,0]=3 7710 B12R1.1 CSCCOc1ccc(cc1)I 34a_100000212066_100000212216 [0,2,0,0,0,0|1,0,0]=3 7711 B12R1.1 CSCCOc1ccc(cc1)I 7a_100000212066_100000212216 [0,2,0,0,0,0|1,0,0]=3 7712 B12R1.1 CSCCOc1ccc(cc1)N 34a_100000185829_100000212216 [0,2,0,0,0,0|1,0,0]=3 7713 B12R1.1 CSCCOc1ccc(cn1)C 34a_100000759353_100000212216 [0,2,0,0,0,0|2,0,0]=4 7714 B12R1.1 CSCCOc1ccc(cn1)Cl 34a_100011215309_100000212216 [0,2,0,0,0,0|2,0,0]=4 7715 B12R1.1 CSCCOc1ccc(cn1)F 34a_100000742473_100000212216 [0,2,0,0,0,0|2,0,0]=4 7716 B12R1.1 CSCCOc1ccc(cn1)N 34a_100000729260_100000212216 [0,2,0,0,0,0|2,0,0]=4 7717 B12R1.1 CSCCOc1ccc(nc1)Br 34a_100000685995_100000212216 [0,2,0,0,0,0|2,0,0]=4 7718 B12R1.1 CSCCOc1ccc(nc1)Br 7a_100000685995_100000212216 [0,2,0,0,0,0|2,0,0]=4 7719 B12R1.1 CSCCOc1ccc(nc1)C 34a_100000745506_100000212216 [0,2,0,0,0,0|2,0,0]=4 7720 B12R1.1 CSCCOc1ccc(nc1)C 7a_100000745506_100000212216 [0,2,0,0,0,0|2,0,0]=4 7721 B12R1.1 CSCCOc1ccc(nc1)Cl 34a_100000744096_100000212216 [0,2,0,0,0,0|2,0,0]=4 7722 B12R1.1 CSCCOc1ccc(nc1)Cl 7a_100000744096_100000212216 [0,2,0,0,0,0|2,0,0]=4 7723 B12R1.1 CSCCOc1ccc(nc1)F 34a_100000688820_100000212216 [0,2,0,0,0,0|2,0,0]=4 7724 B12R1.1 CSCCOc1ccc(nc1)F 7a_100000688820_100000212216 [0,2,0,0,0,0|2,0,0]=4 7725 B12R1.1 CSCCOc1ccc(nc1)I 34a_100000687607_100000212216 [0,2,0,0,0,0|2,0,0]=4 7726 B12R1.1 CSCCOc1ccc(nc1)I 7a_100000687607_100000212216 [0,2,0,0,0,0|2,0,0]=4 7727 B12R1.1 CSCCOc1ccc(nc1)N 34a_100015188713_100000212216 [0,2,0,0,0,0|2,0,0]=4 7728 B12R1.1 CSCCOc1ccc(nc1)N 7a_100015188713_100000212216 [0,2,0,0,0,0|2,0,0]=4 7729 B12R1.1 CSCCSc1ccc(cc1)Br 62a_100000212216_100000752885 [0,2,0,0,0,0|1,1,0]=4 7730 B12R1.1 CSCCSc1ccc(cc1)Br 62a_100000752885_100000751147 [0,2,0,0,0,0|1,1,0]=4 7731 B12R1.1 CSCCSc1ccc(cc1)C 62a_100000186775_100000751147 [0,2,0,0,0,0|1,1,0]=4 7732 B12R1.1 CSCCSc1ccc(cc1)C 62a_100000212216_100000186775 [0,2,0,0,0,0|1,1,0]=4 7733 B12R1.1 CSCCSc1ccc(cc1)Cl 62a_100000212216_100000755918 [0,2,0,0,0,0|1,1,0]=4 7734 B12R1.1 CSCCSc1ccc(cc1)Cl 62a_100000755918_100000751147 [0,2,0,0,0,0|1,1,0]=4 7735 B12R1.1 CSCCSc1ccc(cc1)F 62a_100000211213_100000751147 [0,2,0,0,0,0|1,1,0]=4 7736 B12R1.1 CSCCSc1ccc(cc1)F 62a_100000212216_100000211213 [0,2,0,0,0,0|1,1,0]=4 7737 B12R1.1 CSCCSc1ccc(cc1)N 62a_100000185761_100000751147 [0,2,0,0,0,0|1,1,0]=4 7738 B12R1.1 CSCCSc1ccc(cc1)N 62a_100000212216_100000185761 [0,2,0,0,0,0|1,1,0]=4 7739 B12R1.1 CSCCSc1ccc(cc1)O 62a_100000212216_100000185759 [0,2,0,0,0,0|0,1,0]=3 7740 B12R1.1 CSCCSc1ccc(cn1)O 62a_100000212216_100000744096 [0,2,0,0,0,0|1,1,0]=4 7741 B12R1.1 CSCCSc1ccc(cn1)O 62a_100000685995_100000751147 [0,2,0,0,0,0|1,1,0]=4 7742 B12R1.1 CSCNCc1ccc(cc1)Br 2230a_100000174875_100011218213 [0,2,0,0,0,0|2,0,0]=4 7743 B12R1.1 CSCNCc1ccc(cc1)Br 34a_100000174875_100011218213 [0,2,0,0,0,0|2,0,0]=4 7744 B12R1.1 CSCNCc1ccc(cc1)C 2230a_100000174908_100011218213 [0,2,0,0,0,0|2,0,0]=4 7745 B12R1.1 CSCNCc1ccc(cc1)C 34a_100000174908_100011218213 [0,2,0,0,0,0|2,0,0]=4 7746 B12R1.1 CSCNCc1ccc(cc1)Cl 2230a_100000174871_100011218213 [0,2,0,0,0,0|2,0,0]=4 7747 B12R1.1 CSCNCc1ccc(cc1)Cl 34a_100000174871_100011218213 [0,2,0,0,0,0|2,0,0]=4 7748 B12R1.1 CSCNCc1ccc(cc1)F 2230a_100000174882_100011218213 [0,2,0,0,0,0|2,0,0]=4 7749 B12R1.1 CSCNCc1ccc(cc1)F 34a_100000174882_100011218213 [0,2,0,0,0,0|2,0,0]=4 7750 B12R1.1 CSCNCc1ccc(cc1)I 2230a_100016989417_100011218213 [0,2,0,0,0,0|2,0,0]=4 7751 B12R1.1 CSCNCc1ccc(cc1)I 34a_100016989417_100011218213 [0,2,0,0,0,0|2,0,0]=4 7752 B12R1.1 CSCNCc1ccc(cc1)O 34a_100000185549_100011218213 [0,2,0,0,0,0|1,0,0]=3 7753 B12R1.1 CSCNCc1ccc(nc1)O 2230a_100000757128_100011218213 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.1 CSCOCc1cc[n+](cc1)C 34a_100009831711_100011218213 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.1 CSCOCc1cc[n+](cc1)[O-] 34a_100000031831_100011218213 [0,2,0,0,0,0|1,0,1]=4 7756 B12R1.1 CSCOCc1ccc(=O)[nH]c1 34a_100011999846_100011218213 [0,2,0,0,0,0|1,0,1]=4 7757 B12R1.1 CSCOCc1ccc(cc1)Br 34a_100000695286_100011218213 [0,2,0,0,0,0|1,0,0]=3 7758 B12R1.1 CSCOCc1ccc(cc1)C 34a_100011215236_100011218213 [0,2,0,0,0,0|1,0,0]=3 7759 B12R1.1 CSCOCc1ccc(cc1)Cl 34a_100000211118_100011218213 [0,2,0,0,0,0|1,0,0]=3 7760 B12R1.1 CSCOCc1ccc(cc1)F 34a_100000210977_100011218213 [0,2,0,0,0,0|1,0,0]=3 7761 B12R1.1 CSCOCc1ccc(cc1)I 34a_100000690907_100011218213 [0,2,0,0,0,0|1,0,0]=3 7762 B12R1.1 CSCOCc1ccc(cc1)N 34a_100011215238_100011218213 [0,2,0,0,0,0|1,0,0]=3 7763 B12R1.1 CSCOCc1ccc(cn1)Br 34a_100000754261_100011218213 [0,2,0,0,0,0|2,0,0]=4 7764 B12R1.1 CSCOCc1ccc(cn1)C 34a_100012001401_100011218213 [0,2,0,0,0,0|2,0,0]=4 7765 B12R1.1 CSCOCc1ccc(cn1)Cl 34a_100000703999_100011218213 [0,2,0,0,0,0|2,0,0]=4 7766 B12R1.1 CSCOCc1ccc(cn1)F 34a_100011999454_100011218213 [0,2,0,0,0,0|2,0,0]=4 7767 B12R1.1 CSCOCc1ccc(cn1)N 34a_100011998161_100011218213 [0,2,0,0,0,0|2,0,0]=4 7768 B12R1.1 CSCOCc1ccc(nc1)Br 34a_100009816760_100011218213 [0,2,0,0,0,0|2,0,0]=4 7769 B12R1.1 CSCOCc1ccc(nc1)C 34a_100011248133_100011218213 [0,2,0,0,0,0|2,0,0]=4 7770 B12R1.1 CSCOCc1ccc(nc1)Cl 34a_100000755211_100011218213 [0,2,0,0,0,0|2,0,0]=4 7771 B12R1.1 CSCOCc1ccc(nc1)F 34a_100000079959_100011218213 [0,2,0,0,0,0|2,0,0]=4 7772 B12R1.1 CSCOCc1ccc(nc1)N 34a_100000704267_100011218213 [0,2,0,0,0,0|2,0,0]=4 7773 B12R1.1 CSCSCc1ccc(cc1)Br 62a_100000189115_100011218213 [0,2,0,0,0,0|1,1,0]=4 7774 B12R1.1 CSCSCc1ccc(cc1)Br 62a_100011218213_100000189115 [0,2,0,0,0,0|1,1,0]=4 7775 B12R1.1 CSCSCc1ccc(cc1)C 62a_100000210814_100011218213 [0,2,0,0,0,0|1,1,0]=4 7776 B12R1.1 CSCSCc1ccc(cc1)C 62a_100011218213_100000210814 [0,2,0,0,0,0|1,1,0]=4 7777 B12R1.1 CSCSCc1ccc(cc1)Cl 62a_100000187161_100011218213 [0,2,0,0,0,0|1,1,0]=4 7778 B12R1.1 CSCSCc1ccc(cc1)Cl 62a_100011218213_100000187161 [0,2,0,0,0,0|1,1,0]=4 7779 B12R1.1 CSCSCc1ccc(cc1)F 62a_100000198546_100011218213 [0,2,0,0,0,0|1,1,0]=4 7780 B12R1.1 CSCSCc1ccc(cc1)F 62a_100011218213_100000187164 [0,2,0,0,0,0|1,1,0]=4 7781 B12R1.1 CSCSCc1ccc(cc1)I 62a_100000189116_100011218213 [0,2,0,0,0,0|1,1,0]=4 7782 B12R1.1 CSCSCc1ccc(cc1)I 62a_100011218213_100000189116 [0,2,0,0,0,0|1,1,0]=4 7783 B12R1.1 C[n+]1ccc(cc1)COCCF 34a_100009831711_100011217306 [0,2,0,0,0,0|2,0,0]=4 7784 B12R1.1 C[n+]1ccc(cc1)COCCO 34a_100009831711_100000211926 [0,2,0,0,0,0|2,0,0]=4 7785 B12R1.1 Cc1ccc(cc1)C#CCO[13CH3] 34a_100000696136_200025704644 [0,2,0,0,0,0|2,0,0]=4 7786 B12R1.1 Cc1ccc(cc1)C#CCO[13CH3] 7a_100000696136_200025704644 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.1 Cc1ccc(cc1)CCCN[13CH3] 2230a_100011236272_200025704644 [0,2,0,0,0,0|2,0,0]=4 7788 B12R1.1 Cc1ccc(cc1)CCCN[13CH3] 34a_100011236272_200025704644 [0,2,0,0,0,0|2,0,0]=4 7789 B12R1.1 Cc1ccc(cc1)CCCO[13CH3] 34a_100000189427_200025704644 [0,2,0,0,0,0|2,0,0]=4 7790 B12R1.1 Cc1ccc(cc1)CCCO[13CH3] 7a_100000189427_200025704644 [0,2,0,0,0,0|2,0,0]=4 7791 B12R1.1 Cc1ccc(cc1)CCNCF 34a_100000705350_100015361967 [0,2,0,0,0,0|2,0,0]=4 7792 B12R1.1 Cc1ccc(cc1)CCOCF 34a_100000756670_100015361967 [0,2,0,0,0,0|2,0,0]=4 7793 B12R1.1 Cc1ccc(cc1)CCOCF 7a_100000756670_100015361967 [0,2,0,0,0,0|2,0,0]=4 7794 B12R1.1 Cc1ccc(cc1)CCSCF 62a_100011713686_100015361967 [0,2,0,0,0,0|2,0,0]=4 7795 B12R1.1 Cc1ccc(cc1)CCSCF 62a_100015361967_100011713686 [0,2,0,0,0,0|2,0,0]=4 7796 B12R1.1 Cc1ccc(cc1)CNCCF 2230a_100000174908_100011217306 [0,2,0,0,0,0|2,0,0]=4 7797 B12R1.1 Cc1ccc(cc1)CNCCF 34a_100000174908_100011217306 [0,2,0,0,0,0|2,0,0]=4 7798 B12R1.1 Cc1ccc(cc1)CNCCF 34a_100000724931_100000210814 [0,2,0,0,0,0|2,0,0]=4 7799 B12R1.1 Cc1ccc(cc1)CNCCO 207a_100000210304_100000211033 [0,2,0,0,0,0|2,0,0]=4 7800 B12R1.1 Cc1ccc(cc1)CNCCO 2230a_100000174908_100000211926 [0,2,0,0,0,0|2,0,0]=4 7801 B12R1.1 Cc1ccc(cc1)CNCCO 2230a_100016997473_100000210814 [0,2,0,0,0,0|2,0,0]=4 7802 B12R1.1 Cc1ccc(cc1)CNCCO 270004a_100000210304_100000211033 [0,2,0,0,0,0|2,0,0]=4 7803 B12R1.1 Cc1ccc(cc1)CNCCO 34a_100000174908_100000211926 [0,2,0,0,0,0|2,0,0]=4 7804 B12R1.1 Cc1ccc(cc1)CNCCO 34a_100016990907_100000210814 [0,2,0,0,0,0|2,0,0]=4 7805 B12R1.1 Cc1ccc(cc1)COCC#N 7a_100011215236_100011215382 [0,2,0,0,0,0|1,0,1]=4 7806 B12R1.1 Cc1ccc(cc1)COCC=O 34a_100011215236_200009817547 [0,2,0,0,0,0|1,0,1]=4 7807 B12R1.1 Cc1ccc(cc1)COCC=O 7a_100011215236_200015260668 [0,2,0,0,0,0|1,0,1]=4 7808 B12R1.1 Cc1ccc(cc1)COCCBr 34a_100000211926_100000210814 [0,2,0,0,0,0|1,0,0]=3 7809 B12R1.1 Cc1ccc(cc1)COCCF 34a_100011215236_100011217306 [0,2,0,0,0,0|1,0,0]=3 7810 B12R1.1 Cc1ccc(cc1)COCCF 7a_100011215236_100011217306 [0,2,0,0,0,0|1,0,0]=3 7811 B12R1.1 Cc1ccc(cc1)COCCN 34a_100000210304_100000210814 [0,2,0,0,0,0|1,0,0]=3 7812 B12R1.1 Cc1ccc(cc1)COCCO 34a_100011215236_100000211926 [0,2,0,0,0,0|1,0,0]=3 7813 B12R1.1 Cc1ccc(cc1)COCCO 7a_100011215236_100000211926 [0,2,0,0,0,0|1,0,0]=3 7814 B12R1.1 Cc1ccc(cc1)CSCCF 62a_100000210814_100011217306 [0,2,0,0,0,0|1,1,0]=4 7815 B12R1.1 Cc1ccc(cc1)CSCCF 62a_100011217306_100000210814 [0,2,0,0,0,0|1,1,0]=4 7816 B12R1.1 Cc1ccc(cc1)CSCCO 62a_100000210814_100000211926 [0,2,0,0,0,0|1,1,0]=4 7817 B12R1.1 Cc1ccc(cc1)CSCCO 62a_100000211926_100000210814 [0,2,0,0,0,0|1,1,0]=4 7818 B12R1.1 Cc1ccc(cc1)NCCCF 34a_100000124888_100011934791 [0,2,0,0,0,0|2,0,0]=4 7819 B12R1.1 Cc1ccc(cc1)NCCCO 34a_100000124888_100000230001 [0,2,0,0,0,0|2,0,0]=4 7820 B12R1.1 Cc1ccc(cc1)OCCC#N 7a_100000210336_100000184422 [0,2,0,0,0,0|1,0,0]=3 7821 B12R1.1 Cc1ccc(cc1)OCCCF 34a_100000210336_100011934791 [0,2,0,0,0,0|1,0,0]=3 7822 B12R1.1 Cc1ccc(cc1)OCCCF 7a_100000210336_100011934791 [0,2,0,0,0,0|1,0,0]=3 7823 B12R1.1 Cc1ccc(cc1)OCCCO 34a_100000210336_100000230001 [0,2,0,0,0,0|1,0,0]=3 7824 B12R1.1 Cc1ccc(cc1)OCCCO 7a_100000210336_100011215043 [0,2,0,0,0,0|1,0,0]=3 7825 B12R1.1 Cc1ccc(cc1)OCCN[13CH3] 2230a_100020666663_200025704644 [0,2,0,0,0,0|1,0,0]=3 7826 B12R1.1 Cc1ccc(cc1)OCCN[13CH3] 34a_100020666663_200025704644 [0,2,0,0,0,0|1,0,0]=3 7827 B12R1.1 Cc1ccc(cc1)OCCO[13CH3] 34a_100011219107_200025704644 [0,2,0,0,0,0|1,0,0]=3 7828 B12R1.1 Cc1ccc(cc1)OCCO[13CH3] 7a_100011219107_200025704644 [0,2,0,0,0,0|1,0,0]=3 7829 B12R1.1 Cc1ccc(cc1)OCCS[13CH3] 62a_100000183172_200025704644 [0,2,0,0,0,0|1,0,0]=3 7830 B12R1.1 Cc1ccc(cc1)OCCS[13CH3] 62a_200025704644_100000183172 [0,2,0,0,0,0|1,0,0]=3 7831 B12R1.1 Cc1ccc(cc1)SCCC#N 62a_100000186775_100011215226 [0,2,0,0,0,0|1,1,0]=4 7832 B12R1.1 Cc1ccc(cc1)SCCC#N 62a_100011215226_100000186775 [0,2,0,0,0,0|1,1,0]=4 7833 B12R1.1 Cc1ccc(cc1)SCCCF 62a_100000186775_100011934791 [0,2,0,0,0,0|1,1,0]=4 7834 B12R1.1 Cc1ccc(cc1)SCCCF 62a_100011934791_100000186775 [0,2,0,0,0,0|1,1,0]=4 7835 B12R1.1 Cc1ccc(cc1)SCCCO 62a_100000186775_100011215043 [0,2,0,0,0,0|1,1,0]=4 7836 B12R1.1 Cc1ccc(cc1)SCCCO 62a_100011215043_100000186775 [0,2,0,0,0,0|1,1,0]=4 7837 B12R1.1 Cc1ccc(cc1)SCCN[13CH3] 2230a_100000739754_200025704644 [0,2,0,0,0,0|1,1,0]=4 7838 B12R1.1 Cc1ccc(cc1)SCCO[13CH3] 34a_200000230582_200025704644 [0,2,0,0,0,0|1,1,0]=4 7839 B12R1.1 Cc1ccc(cc1)SCCO[13CH3] 7a_200000230582_200025704644 [0,2,0,0,0,0|1,1,0]=4 7840 B12R1.1 Cc1ccc(cn1)COCCBr 34a_100000211926_100016987292 [0,2,0,0,0,0|2,0,0]=4 7841 B12R1.1 Cc1ccc(cn1)COCCF 34a_100011248133_100011217306 [0,2,0,0,0,0|2,0,0]=4 7842 B12R1.1 Cc1ccc(cn1)COCCN 34a_100000210304_100016987292 [0,2,0,0,0,0|2,0,0]=4 7843 B12R1.1 Cc1ccc(cn1)COCCO 34a_100011248133_100000211926 [0,2,0,0,0,0|2,0,0]=4 7844 B12R1.1 Cc1ccc(cn1)OCCC#N 7a_100000745506_100000184422 [0,2,0,0,0,0|2,0,0]=4 7845 B12R1.1 Cc1ccc(cn1)OCCCF 34a_100000745506_100011934791 [0,2,0,0,0,0|2,0,0]=4 7846 B12R1.1 Cc1ccc(cn1)OCCCF 7a_100000745506_100011934791 [0,2,0,0,0,0|2,0,0]=4 7847 B12R1.1 Cc1ccc(cn1)OCCCO 34a_100000745506_100000230001 [0,2,0,0,0,0|2,0,0]=4 7848 B12R1.1 Cc1ccc(cn1)OCCCO 7a_100000745506_100011215043 [0,2,0,0,0,0|2,0,0]=4 7849 B12R1.1 Cc1ccc(nc1)COCCBr 34a_100000211926_100000691093 [0,2,0,0,0,0|2,0,0]=4 7850 B12R1.1 Cc1ccc(nc1)COCCF 34a_100012001401_100011217306 [0,2,0,0,0,0|2,0,0]=4 7851 B12R1.1 Cc1ccc(nc1)COCCN 34a_100000210304_100000691093 [0,2,0,0,0,0|2,0,0]=4 7852 B12R1.1 Cc1ccc(nc1)COCCO 34a_100012001401_100000211926 [0,2,0,0,0,0|2,0,0]=4 7853 B12R1.1 Cc1ccc(nc1)OCCCF 34a_100000759353_100011934791 [0,2,0,0,0,0|2,0,0]=4 7854 B12R1.1 Cc1ccc(nc1)OCCCO 34a_100000759353_100000230001 [0,2,0,0,0,0|2,0,0]=4 7855 B12R1.1 Clc1ccc(cc1)COCCBr 34a_100000211926_100000694040 [0,2,0,0,0,0|1,0,0]=3 7856 B12R1.1 Clc1ccc(cn1)COCCBr 34a_100000211926_100000735431 [0,2,0,0,0,0|2,0,0]=4 7857 B12R1.1 Clc1ccc(nc1)COCCBr 34a_100000211926_100012066911 [0,2,0,0,0,0|2,0,0]=4 7858 B12R1.1 FCCCNc1ccc(cc1)Br 2230a_100000210018_100011934791 [0,2,0,0,0,0|2,0,0]=4 7859 B12R1.1 FCCCNc1ccc(cc1)Br 34a_100000210018_100011934791 [0,2,0,0,0,0|2,0,0]=4 7860 B12R1.1 FCCCNc1ccc(cc1)Cl 2230a_100000210052_100011934791 [0,2,0,0,0,0|2,0,0]=4 7861 B12R1.1 FCCCNc1ccc(cc1)Cl 34a_100000210052_100011934791 [0,2,0,0,0,0|2,0,0]=4 7862 B12R1.1 FCCCNc1ccc(cc1)F 34a_100000185862_100011934791 [0,2,0,0,0,0|2,0,0]=4 7863 B12R1.1 FCCCNc1ccc(cc1)I 34a_100000185761_100011934791 [0,2,0,0,0,0|2,0,0]=4 7864 B12R1.1 FCCCOc1ccc(cc1)Br 34a_100000185759_100011934791 [0,2,0,0,0,0|1,0,0]=3 7865 B12R1.1 FCCCOc1ccc(cc1)Br 7a_100000185759_100011934791 [0,2,0,0,0,0|1,0,0]=3 7866 B12R1.1 FCCCOc1ccc(cc1)Cl 34a_100000210216_100011934791 [0,2,0,0,0,0|1,0,0]=3 7867 B12R1.1 FCCCOc1ccc(cc1)Cl 7a_100000210216_100011934791 [0,2,0,0,0,0|1,0,0]=3 7868 B12R1.1 FCCCOc1ccc(cc1)F 34a_100000210339_100011934791 [0,2,0,0,0,0|1,0,0]=3 7869 B12R1.1 FCCCOc1ccc(cc1)I 34a_100000212066_100011934791 [0,2,0,0,0,0|1,0,0]=3 7870 B12R1.1 FCCCOc1ccc(cc1)I 7a_100000212066_100011934791 [0,2,0,0,0,0|1,0,0]=3 7871 B12R1.1 FCCCOc1ccc(cn1)Cl 34a_100011215309_100011934791 [0,2,0,0,0,0|2,0,0]=4 7872 B12R1.1 FCCCOc1ccc(cn1)F 34a_100000742473_100011934791 [0,2,0,0,0,0|2,0,0]=4 7873 B12R1.1 FCCCOc1ccc(nc1)Br 34a_100000685995_100011934791 [0,2,0,0,0,0|2,0,0]=4 7874 B12R1.1 FCCCOc1ccc(nc1)Br 7a_100000685995_100011934791 [0,2,0,0,0,0|2,0,0]=4 7875 B12R1.1 FCCCOc1ccc(nc1)Cl 34a_100000744096_100011934791 [0,2,0,0,0,0|2,0,0]=4 7876 B12R1.1 FCCCOc1ccc(nc1)Cl 7a_100000744096_100011934791 [0,2,0,0,0,0|2,0,0]=4 7877 B12R1.1 FCCCOc1ccc(nc1)F 34a_100000688820_100011934791 [0,2,0,0,0,0|2,0,0]=4 7878 B12R1.1 FCCCOc1ccc(nc1)F 7a_100000688820_100011934791 [0,2,0,0,0,0|2,0,0]=4 7879 B12R1.1 FCCCOc1ccc(nc1)I 34a_100000687607_100011934791 [0,2,0,0,0,0|2,0,0]=4 7880 B12R1.1 FCCCOc1ccc(nc1)I 7a_100000687607_100011934791 [0,2,0,0,0,0|2,0,0]=4 7881 B12R1.1 FCCCSc1ccc(cc1)Br 62a_100000752885_100011934791 [0,2,0,0,0,0|1,1,0]=4 7882 B12R1.1 FCCCSc1ccc(cc1)Br 62a_100011934791_100000752885 [0,2,0,0,0,0|1,1,0]=4 7883 B12R1.1 FCCCSc1ccc(cc1)Cl 62a_100000755918_100011934791 [0,2,0,0,0,0|1,1,0]=4 7884 B12R1.1 FCCCSc1ccc(cc1)Cl 62a_100011934791_100000755918 [0,2,0,0,0,0|1,1,0]=4 7885 B12R1.1 FCCCSc1ccc(cc1)F 62a_100000211213_100011934791 [0,2,0,0,0,0|1,1,0]=4 7886 B12R1.1 FCCCSc1ccc(cc1)F 62a_100011934791_100000211213 [0,2,0,0,0,0|1,1,0]=4 7887 B12R1.1 FCCNCc1ccc(cc1)Br 2230a_100000174875_100011217306 [0,2,0,0,0,0|2,0,0]=4 7888 B12R1.1 FCCNCc1ccc(cc1)Br 34a_100000174875_100011217306 [0,2,0,0,0,0|2,0,0]=4 7889 B12R1.1 FCCNCc1ccc(cc1)Br 34a_100000724931_100000189115 [0,2,0,0,0,0|2,0,0]=4 7890 B12R1.1 FCCNCc1ccc(cc1)Cl 2230a_100000174871_100011217306 [0,2,0,0,0,0|2,0,0]=4 7891 B12R1.1 FCCNCc1ccc(cc1)Cl 34a_100000174871_100011217306 [0,2,0,0,0,0|2,0,0]=4 7892 B12R1.1 FCCNCc1ccc(cc1)Cl 34a_100000724931_100000694040 [0,2,0,0,0,0|2,0,0]=4 7893 B12R1.1 FCCNCc1ccc(cc1)F 2230a_100000174882_100011217306 [0,2,0,0,0,0|2,0,0]=4 7894 B12R1.1 FCCNCc1ccc(cc1)F 34a_100000174882_100011217306 [0,2,0,0,0,0|2,0,0]=4 7895 B12R1.1 FCCNCc1ccc(cc1)F 34a_100000724931_100000198546 [0,2,0,0,0,0|2,0,0]=4 7896 B12R1.1 FCCNCc1ccc(cc1)I 2230a_100016989417_100011217306 [0,2,0,0,0,0|2,0,0]=4 7897 B12R1.1 FCCNCc1ccc(cc1)I 34a_100000724931_100000189116 [0,2,0,0,0,0|2,0,0]=4 7898 B12R1.1 FCCNCc1ccc(cc1)I 34a_100016989417_100011217306 [0,2,0,0,0,0|2,0,0]=4 7899 B12R1.1 FCCOCc1ccc(cc1)Br 34a_100000695286_100011217306 [0,2,0,0,0,0|1,0,0]=3 7900 B12R1.1 FCCOCc1ccc(cc1)Cl 34a_100000211118_100011217306 [0,2,0,0,0,0|1,0,0]=3 7901 B12R1.1 FCCOCc1ccc(cc1)Cl 7a_100000211118_100011217306 [0,2,0,0,0,0|1,0,0]=3 7902 B12R1.1 FCCOCc1ccc(cc1)F 34a_100000210977_100011217306 [0,2,0,0,0,0|1,0,0]=3 7903 B12R1.1 FCCOCc1ccc(cc1)F 7a_100000210977_100011217306 [0,2,0,0,0,0|1,0,0]=3 7904 B12R1.1 FCCOCc1ccc(cc1)I 34a_100000690907_100011217306 [0,2,0,0,0,0|1,0,0]=3 7905 B12R1.1 FCCOCc1ccc(cc1)I 7a_100000690907_100011217306 [0,2,0,0,0,0|1,0,0]=3 7906 B12R1.1 FCCOCc1ccc(cn1)Br 34a_100000754261_100011217306 [0,2,0,0,0,0|2,0,0]=4 7907 B12R1.1 FCCOCc1ccc(cn1)Cl 34a_100000703999_100011217306 [0,2,0,0,0,0|2,0,0]=4 7908 B12R1.1 FCCOCc1ccc(cn1)F 34a_100011999454_100011217306 [0,2,0,0,0,0|2,0,0]=4 7909 B12R1.1 FCCOCc1ccc(nc1)Br 34a_100009816760_100011217306 [0,2,0,0,0,0|2,0,0]=4 7910 B12R1.1 FCCOCc1ccc(nc1)Br 7a_100009816760_100011217306 [0,2,0,0,0,0|2,0,0]=4 7911 B12R1.1 FCCOCc1ccc(nc1)Cl 34a_100000755211_100011217306 [0,2,0,0,0,0|2,0,0]=4 7912 B12R1.1 FCCOCc1ccc(nc1)Cl 7a_100000755211_100011217306 [0,2,0,0,0,0|2,0,0]=4 7913 B12R1.1 FCCOCc1ccc(nc1)F 34a_100000079959_100011217306 [0,2,0,0,0,0|2,0,0]=4 7914 B12R1.1 FCCSCc1ccc(cc1)Br 62a_100000189115_100011217306 [0,2,0,0,0,0|1,1,0]=4 7915 B12R1.1 FCCSCc1ccc(cc1)Br 62a_100011217306_100000189115 [0,2,0,0,0,0|1,1,0]=4 7916 B12R1.1 FCCSCc1ccc(cc1)Cl 62a_100000187161_100011217306 [0,2,0,0,0,0|1,1,0]=4 7917 B12R1.1 FCCSCc1ccc(cc1)Cl 62a_100011217306_100000187161 [0,2,0,0,0,0|1,1,0]=4 7918 B12R1.1 FCCSCc1ccc(cc1)F 62a_100000198546_100011217306 [0,2,0,0,0,0|1,1,0]=4 7919 B12R1.1 FCCSCc1ccc(cc1)F 62a_100011217306_100000187164 [0,2,0,0,0,0|1,1,0]=4 7920 B12R1.1 FCCSCc1ccc(cc1)I 62a_100000189116_100011217306 [0,2,0,0,0,0|1,1,0]=4 7921 B12R1.1 FCCSCc1ccc(cc1)I 62a_100011217306_100000189116 [0,2,0,0,0,0|1,1,0]=4 7922 B12R1.1 FCNCCc1ccc(cc1)Br 34a_100000755846_100015361967 [0,2,0,0,0,0|2,0,0]=4 7923 B12R1.1 FCNCCc1ccc(cc1)Cl 34a_100000185265_100015361967 [0,2,0,0,0,0|2,0,0]=4 7924 B12R1.1 FCNCCc1ccc(cc1)F 34a_100000199005_100015361967 [0,2,0,0,0,0|2,0,0]=4 7925 B12R1.1 FCOCCc1ccc(cc1)Br 34a_100000766406_100015361967 [0,2,0,0,0,0|2,0,0]=4 7926 B12R1.1 FCOCCc1ccc(cc1)Br 7a_100000766406_100015361967 [0,2,0,0,0,0|2,0,0]=4 7927 B12R1.1 FCOCCc1ccc(cc1)Cl 34a_100011219627_100015361967 [0,2,0,0,0,0|2,0,0]=4 7928 B12R1.1 FCOCCc1ccc(cc1)Cl 7a_100011219627_100015361967 [0,2,0,0,0,0|2,0,0]=4 7929 B12R1.1 FCOCCc1ccc(cc1)F 34a_100000754732_100015361967 [0,2,0,0,0,0|2,0,0]=4 7930 B12R1.1 FCOCCc1ccc(cc1)F 7a_100000754732_100015361967 [0,2,0,0,0,0|2,0,0]=4 7931 B12R1.1 FCOCCc1ccc(cc1)I 34a_100012291149_100015361967 [0,2,0,0,0,0|2,0,0]=4 7932 B12R1.1 FCOCCc1ccc(cc1)I 7a_100012291149_100015361967 [0,2,0,0,0,0|2,0,0]=4 7933 B12R1.1 FCSCCc1ccc(cc1)Br 62a_100011740612_100015361967 [0,2,0,0,0,0|2,0,0]=4 7934 B12R1.1 FCSCCc1ccc(cc1)Br 62a_100015361967_100011740612 [0,2,0,0,0,0|2,0,0]=4 7935 B12R1.1 FCSCCc1ccc(cc1)Cl 62a_100011713675_100015361967 [0,2,0,0,0,0|2,0,0]=4 7936 B12R1.1 FCSCCc1ccc(cc1)Cl 62a_100015361967_100011713675 [0,2,0,0,0,0|2,0,0]=4 7937 B12R1.1 FCSCCc1ccc(cc1)F 62a_100011217392_100015361967 [0,2,0,0,0,0|2,0,0]=4 7938 B12R1.1 FCSCCc1ccc(cc1)F 62a_100015361967_100011217392 [0,2,0,0,0,0|2,0,0]=4 7939 B12R1.1 Fc1ccc(cc1)COCCBr 34a_100000211926_100000198546 [0,2,0,0,0,0|1,0,0]=3 7940 B12R1.1 Fc1ccc(cn1)COCCBr 34a_100000211926_100000099788 [0,2,0,0,0,0|2,0,0]=4 7941 B12R1.1 Fc1ccc(nc1)COCCBr 34a_100000211926_100000703193 [0,2,0,0,0,0|2,0,0]=4 7942 B12R1.1 N#CCCNc1ccc(cc1)Br 2230a_100000210018_100011215226 [0,2,0,0,0,0|2,0,0]=4 7943 B12R1.1 N#CCCNc1ccc(cc1)Cl 2230a_100000210052_100011215226 [0,2,0,0,0,0|2,0,0]=4 7944 B12R1.1 N#CCCOc1ccc(cc1)Br 7a_100000185759_100000184422 [0,2,0,0,0,0|1,0,0]=3 7945 B12R1.1 N#CCCOc1ccc(cc1)Cl 7a_100000210216_100000184422 [0,2,0,0,0,0|1,0,0]=3 7946 B12R1.1 N#CCCOc1ccc(cc1)I 7a_100000212066_100000184422 [0,2,0,0,0,0|1,0,0]=3 7947 B12R1.1 N#CCCOc1ccc(cc1)O 271570a_203496583355_100000172056 [0,2,0,0,0,0|0,0,0]=2 7948 B12R1.1 N#CCCOc1ccc(nc1)Br 7a_100000685995_100000184422 [0,2,0,0,0,0|2,0,0]=4 7949 B12R1.1 N#CCCOc1ccc(nc1)Cl 7a_100000744096_100000184422 [0,2,0,0,0,0|2,0,0]=4 7950 B12R1.1 N#CCCOc1ccc(nc1)F 7a_100000688820_100000184422 [0,2,0,0,0,0|2,0,0]=4 7951 B12R1.1 N#CCCOc1ccc(nc1)I 7a_100000687607_100000184422 [0,2,0,0,0,0|2,0,0]=4 7952 B12R1.1 N#CCCOc1ccc(nc1)N 7a_100015188713_100000184422 [0,2,0,0,0,0|2,0,0]=4 7953 B12R1.1 N#CCCSc1ccc(cc1)Br 62a_100000752885_100011215226 [0,2,0,0,0,0|1,1,0]=4 7954 B12R1.1 N#CCCSc1ccc(cc1)Br 62a_100011215226_100000752885 [0,2,0,0,0,0|1,1,0]=4 7955 B12R1.1 N#CCCSc1ccc(cc1)Cl 62a_100000755918_100011215226 [0,2,0,0,0,0|1,1,0]=4 7956 B12R1.1 N#CCCSc1ccc(cc1)Cl 62a_100011215226_100000755918 [0,2,0,0,0,0|1,1,0]=4 7957 B12R1.1 N#CCCSc1ccc(cc1)F 62a_100000211213_100011215226 [0,2,0,0,0,0|1,1,0]=4 7958 B12R1.1 N#CCCSc1ccc(cc1)F 62a_100011215226_100000211213 [0,2,0,0,0,0|1,1,0]=4 7959 B12R1.1 N#CCCSc1ccc(cc1)N 62a_100000185761_100011215226 [0,2,0,0,0,0|1,1,0]=4 7960 B12R1.1 N#CCCSc1ccc(cc1)N 62a_100011215226_100000185761 [0,2,0,0,0,0|1,1,0]=4 7961 B12R1.1 N#CCCSc1ccc(cc1)O 62a_100011215226_100000185759 [0,2,0,0,0,0|0,1,0]=3 7962 B12R1.1 N#CCCSc1ccc(cn1)O 62a_100000685995_100011215226 [0,2,0,0,0,0|1,1,0]=4 7963 B12R1.1 N#CCCSc1ccc(cn1)O 62a_100011215226_100000744096 [0,2,0,0,0,0|1,1,0]=4 7964 B12R1.1 N#CCOCc1ccc(cc1)Cl 7a_100000211118_100011215382 [0,2,0,0,0,0|1,0,1]=4 7965 B12R1.1 N#CCOCc1ccc(cc1)F 7a_100000210977_100011215382 [0,2,0,0,0,0|1,0,1]=4 7966 B12R1.1 N#CCOCc1ccc(cc1)I 7a_100000690907_100011215382 [0,2,0,0,0,0|1,0,1]=4 7967 B12R1.1 N#CSCSc1ccc(cc1)O 62a_100000211825_100000185759 [0,2,0,0,0,0|0,1,1]=4 7968 B12R1.1 NCCOCc1ccc(cc1)Br 34a_100000210304_100000189115 [0,2,0,0,0,0|1,0,0]=3 7969 B12R1.1 NCCOCc1ccc(cc1)Cl 34a_100000210304_100000694040 [0,2,0,0,0,0|1,0,0]=3 7970 B12R1.1 NCCOCc1ccc(cc1)F 34a_100000210304_100000198546 [0,2,0,0,0,0|1,0,0]=3 7971 B12R1.1 NCCOCc1ccc(cc1)I 34a_100000210304_100000189116 [0,2,0,0,0,0|1,0,0]=3 7972 B12R1.1 NCCOCc1ccc(cn1)Br 34a_100000210304_100000702658 [0,2,0,0,0,0|2,0,0]=4 7973 B12R1.1 NCCOCc1ccc(cn1)Cl 34a_100000210304_100012066911 [0,2,0,0,0,0|2,0,0]=4 7974 B12R1.1 NCCOCc1ccc(cn1)F 34a_100000210304_100000703193 [0,2,0,0,0,0|2,0,0]=4 7975 B12R1.1 NCCOCc1ccc(nc1)Br 34a_100000210304_100009831999 [0,2,0,0,0,0|2,0,0]=4 7976 B12R1.1 NCCOCc1ccc(nc1)Cl 34a_100000210304_100000735431 [0,2,0,0,0,0|2,0,0]=4 7977 B12R1.1 NCCOCc1ccc(nc1)F 34a_100000210304_100000099788 [0,2,0,0,0,0|2,0,0]=4 7978 B12R1.1 Nc1ccc(cc1)CCOCF 34a_100011204434_100015361967 [0,2,0,0,0,0|2,0,0]=4 7979 B12R1.1 Nc1ccc(cc1)COCC=O 34a_100011215238_200009817547 [0,2,0,0,0,0|1,0,1]=4 7980 B12R1.1 Nc1ccc(cc1)COCCF 34a_100011215238_100011217306 [0,2,0,0,0,0|1,0,0]=3 7981 B12R1.1 Nc1ccc(cc1)COCCO 34a_100011215238_100000211926 [0,2,0,0,0,0|1,0,0]=3 7982 B12R1.1 Nc1ccc(cc1)OCCCF 34a_100000185829_100011934791 [0,2,0,0,0,0|1,0,0]=3 7983 B12R1.1 Nc1ccc(cc1)OCCCO 34a_100000185829_100000230001 [0,2,0,0,0,0|1,0,0]=3 7984 B12R1.1 Nc1ccc(cc1)SCCCF 62a_100000185761_100011934791 [0,2,0,0,0,0|1,1,0]=4 7985 B12R1.1 Nc1ccc(cc1)SCCCF 62a_100011934791_100000185761 [0,2,0,0,0,0|1,1,0]=4 7986 B12R1.1 Nc1ccc(cc1)SCCCO 62a_100000185761_100011215043 [0,2,0,0,0,0|1,1,0]=4 7987 B12R1.1 Nc1ccc(cc1)SCCCO 62a_100011215043_100000185761 [0,2,0,0,0,0|1,1,0]=4 7988 B12R1.1 Nc1ccc(cn1)COCCF 34a_100000704267_100011217306 [0,2,0,0,0,0|2,0,0]=4 7989 B12R1.1 Nc1ccc(cn1)COCCO 34a_100000704267_100000211926 [0,2,0,0,0,0|2,0,0]=4 7990 B12R1.1 Nc1ccc(cn1)OCCCF 34a_100015188713_100011934791 [0,2,0,0,0,0|2,0,0]=4 7991 B12R1.1 Nc1ccc(cn1)OCCCF 7a_100015188713_100011934791 [0,2,0,0,0,0|2,0,0]=4 7992 B12R1.1 Nc1ccc(cn1)OCCCO 34a_100015188713_100000230001 [0,2,0,0,0,0|2,0,0]=4 7993 B12R1.1 Nc1ccc(cn1)OCCCO 7a_100015188713_100011215043 [0,2,0,0,0,0|2,0,0]=4 7994 B12R1.1 Nc1ccc(nc1)COCCF 34a_100011998161_100011217306 [0,2,0,0,0,0|2,0,0]=4 7995 B12R1.1 Nc1ccc(nc1)COCCO 34a_100011998161_100000211926 [0,2,0,0,0,0|2,0,0]=4 7996 B12R1.1 Nc1ccc(nc1)OCCCF 34a_100000729260_100011934791 [0,2,0,0,0,0|2,0,0]=4 7997 B12R1.1 Nc1ccc(nc1)OCCCO 34a_100000729260_100000230001 [0,2,0,0,0,0|2,0,0]=4 7998 B12R1.1 O=CCNCc1ccc(cc1)O 34a_100000185549_200009817547 [0,2,0,0,0,0|1,0,1]=4 7999 B12R1.1 O=CCOCc1ccc(cc1)Br 34a_100000695286_200009817547 [0,2,0,0,0,0|1,0,1]=4 8000 B12R1.1 O=CCOCc1ccc(cc1)Cl 34a_100000211118_200009817547 [0,2,0,0,0,0|1,0,1]=4 8001 B12R1.1 O=CCOCc1ccc(cc1)Cl 7a_100000211118_200015260668 [0,2,0,0,0,0|1,0,1]=4 8002 B12R1.1 O=CCOCc1ccc(cc1)F 34a_100000210977_200009817547 [0,2,0,0,0,0|1,0,1]=4 8003 B12R1.1 O=CCOCc1ccc(cc1)F 7a_100000210977_200015260668 [0,2,0,0,0,0|1,0,1]=4 8004 B12R1.1 O=CCOCc1ccc(cc1)I 34a_100000690907_200009817547 [0,2,0,0,0,0|1,0,1]=4 8005 B12R1.1 O=CCOCc1ccc(cc1)I 7a_100000690907_200015260668 [0,2,0,0,0,0|1,0,1]=4 8006 B12R1.1 O=CNCCc1ccc(cc1)O 271570a_203496583355_200012351260 [0,2,0,0,0,0|1,0,1]=4 8007 B12R1.1 O=c1ccc(c[nH]1)COCCF 34a_100011999846_100011217306 [0,2,0,0,0,0|1,0,1]=4 8008 B12R1.1 O=c1ccc(c[nH]1)COCCO 34a_100011999846_100000211926 [0,2,0,0,0,0|1,0,1]=4 8009 B12R1.1 O=c1ccc(c[nH]1)OCCCF 34a_100000075641_100011934791 [0,2,0,0,0,0|1,0,1]=4 8010 B12R1.1 O=c1ccc(c[nH]1)OCCCO 34a_100000075641_100000230001 [0,2,0,0,0,0|1,0,1]=4 8011 B12R1.1 OCCCNc1ccc(cc1)Br 2230a_100000210018_100000230001 [0,2,0,0,0,0|2,0,0]=4 8012 B12R1.1 OCCCNc1ccc(cc1)Br 34a_100000210018_100000230001 [0,2,0,0,0,0|2,0,0]=4 8013 B12R1.1 OCCCNc1ccc(cc1)Cl 2230a_100000210052_100000230001 [0,2,0,0,0,0|2,0,0]=4 8014 B12R1.1 OCCCNc1ccc(cc1)Cl 34a_100000210052_100000230001 [0,2,0,0,0,0|2,0,0]=4 8015 B12R1.1 OCCCNc1ccc(cc1)F 34a_100000185862_100000230001 [0,2,0,0,0,0|2,0,0]=4 8016 B12R1.1 OCCCNc1ccc(cc1)I 34a_100000185761_100000230001 [0,2,0,0,0,0|2,0,0]=4 8017 B12R1.1 OCCCNc1ccc(cc1)O 34a_100000185829_100000230001 [0,2,0,0,0,0|1,0,0]=3 8018 B12R1.1 OCCCOc1ccc(cc1)Br 34a_100000185759_100000230001 [0,2,0,0,0,0|1,0,0]=3 8019 B12R1.1 OCCCOc1ccc(cc1)Br 7a_100000185759_100011215043 [0,2,0,0,0,0|1,0,0]=3 8020 B12R1.1 OCCCOc1ccc(cc1)Cl 34a_100000210216_100000230001 [0,2,0,0,0,0|1,0,0]=3 8021 B12R1.1 OCCCOc1ccc(cc1)Cl 7a_100000210216_100011215043 [0,2,0,0,0,0|1,0,0]=3 8022 B12R1.1 OCCCOc1ccc(cc1)F 34a_100000210339_100000230001 [0,2,0,0,0,0|1,0,0]=3 8023 B12R1.1 OCCCOc1ccc(cc1)I 34a_100000212066_100000230001 [0,2,0,0,0,0|1,0,0]=3 8024 B12R1.1 OCCCOc1ccc(cc1)I 7a_100000212066_100011215043 [0,2,0,0,0,0|1,0,0]=3 8025 B12R1.1 OCCCOc1ccc(cc1)O 271570a_203496583355_100000756186 [0,2,0,0,0,0|0,0,0]=2 8026 B12R1.1 OCCCOc1ccc(cn1)Cl 34a_100011215309_100000230001 [0,2,0,0,0,0|2,0,0]=4 8027 B12R1.1 OCCCOc1ccc(cn1)F 34a_100000742473_100000230001 [0,2,0,0,0,0|2,0,0]=4 8028 B12R1.1 OCCCOc1ccc(nc1)Br 34a_100000685995_100000230001 [0,2,0,0,0,0|2,0,0]=4 8029 B12R1.1 OCCCOc1ccc(nc1)Br 7a_100000685995_100011215043 [0,2,0,0,0,0|2,0,0]=4 8030 B12R1.1 OCCCOc1ccc(nc1)Cl 34a_100000744096_100000230001 [0,2,0,0,0,0|2,0,0]=4 8031 B12R1.1 OCCCOc1ccc(nc1)Cl 7a_100000744096_100011215043 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.1 OCCCOc1ccc(nc1)F 34a_100000688820_100000230001 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.1 OCCCOc1ccc(nc1)F 7a_100000688820_100011215043 [0,2,0,0,0,0|2,0,0]=4 8034 B12R1.1 OCCCOc1ccc(nc1)I 34a_100000687607_100000230001 [0,2,0,0,0,0|2,0,0]=4 8035 B12R1.1 OCCCOc1ccc(nc1)I 7a_100000687607_100011215043 [0,2,0,0,0,0|2,0,0]=4 8036 B12R1.1 OCCCSc1ccc(cc1)Br 62a_100000752885_100011215043 [0,2,0,0,0,0|1,1,0]=4 8037 B12R1.1 OCCCSc1ccc(cc1)Br 62a_100011215043_100000752885 [0,2,0,0,0,0|1,1,0]=4 8038 B12R1.1 OCCCSc1ccc(cc1)Cl 62a_100000755918_100011215043 [0,2,0,0,0,0|1,1,0]=4 8039 B12R1.1 OCCCSc1ccc(cc1)Cl 62a_100011215043_100000755918 [0,2,0,0,0,0|1,1,0]=4 8040 B12R1.1 OCCCSc1ccc(cc1)F 62a_100000211213_100011215043 [0,2,0,0,0,0|1,1,0]=4 8041 B12R1.1 OCCCSc1ccc(cc1)F 62a_100011215043_100000211213 [0,2,0,0,0,0|1,1,0]=4 8042 B12R1.1 OCCCSc1ccc(cc1)O 62a_100011215043_100000185759 [0,2,0,0,0,0|0,1,0]=3 8043 B12R1.1 OCCCSc1ccc(cn1)O 62a_100000685995_100011215043 [0,2,0,0,0,0|1,1,0]=4 8044 B12R1.1 OCCCSc1ccc(cn1)O 62a_100011215043_100000744096 [0,2,0,0,0,0|1,1,0]=4 8045 B12R1.1 OCCNCc1ccc(cc1)Br 207a_100000210304_100000186029 [0,2,0,0,0,0|2,0,0]=4 8046 B12R1.1 OCCNCc1ccc(cc1)Br 2230a_100000174875_100000211926 [0,2,0,0,0,0|2,0,0]=4 8047 B12R1.1 OCCNCc1ccc(cc1)Br 2230a_100016997473_100011217064 [0,2,0,0,0,0|2,0,0]=4 8048 B12R1.1 OCCNCc1ccc(cc1)Br 270004a_100000210304_100000186029 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.1 OCCNCc1ccc(cc1)Br 34a_100000174875_100000211926 [0,2,0,0,0,0|2,0,0]=4 8050 B12R1.1 OCCNCc1ccc(cc1)Br 34a_100016990907_100000189115 [0,2,0,0,0,0|2,0,0]=4 8051 B12R1.1 OCCNCc1ccc(cc1)Cl 207a_100000210304_100000189385 [0,2,0,0,0,0|2,0,0]=4 8052 B12R1.1 OCCNCc1ccc(cc1)Cl 2230a_100000174871_100000211926 [0,2,0,0,0,0|2,0,0]=4 8053 B12R1.1 OCCNCc1ccc(cc1)Cl 2230a_100016997473_100000694040 [0,2,0,0,0,0|2,0,0]=4 8054 B12R1.1 OCCNCc1ccc(cc1)Cl 270004a_100000210304_100000189385 [0,2,0,0,0,0|2,0,0]=4 8055 B12R1.1 OCCNCc1ccc(cc1)Cl 34a_100000174871_100000211926 [0,2,0,0,0,0|2,0,0]=4 8056 B12R1.1 OCCNCc1ccc(cc1)Cl 34a_100016990907_100000694040 [0,2,0,0,0,0|2,0,0]=4 8057 B12R1.1 OCCNCc1ccc(cc1)F 207a_100000210304_100000210084 [0,2,0,0,0,0|2,0,0]=4 8058 B12R1.1 OCCNCc1ccc(cc1)F 2230a_100000174882_100000211926 [0,2,0,0,0,0|2,0,0]=4 8059 B12R1.1 OCCNCc1ccc(cc1)F 2230a_100016997473_100000198546 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.1 OCCNCc1ccc(cc1)F 270004a_100000210304_100000210084 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.1 OCCNCc1ccc(cc1)F 34a_100000174882_100000211926 [0,2,0,0,0,0|2,0,0]=4 8062 B12R1.1 OCCNCc1ccc(cc1)F 34a_100016990907_100000198546 [0,2,0,0,0,0|2,0,0]=4 8063 B12R1.1 OCCNCc1ccc(cc1)I 207a_100000210304_100000188517 [0,2,0,0,0,0|2,0,0]=4 8064 B12R1.1 OCCNCc1ccc(cc1)I 2230a_100016989417_100000211926 [0,2,0,0,0,0|2,0,0]=4 8065 B12R1.1 OCCNCc1ccc(cc1)I 2230a_100016997473_100000189116 [0,2,0,0,0,0|2,0,0]=4 8066 B12R1.1 OCCNCc1ccc(cc1)I 34a_100016989417_100000211926 [0,2,0,0,0,0|2,0,0]=4 8067 B12R1.1 OCCNCc1ccc(cc1)I 34a_100016990907_100000189116 [0,2,0,0,0,0|2,0,0]=4 8068 B12R1.1 OCCNCc1ccc(cc1)O 271570a_203496583355_100000186819 [0,2,0,0,0,0|1,0,0]=3 8069 B12R1.1 OCCNCc1ccc(cc1)O 34a_100000185549_100000211926 [0,2,0,0,0,0|1,0,0]=3 8070 B12R1.1 OCCNCc1ccc(nc1)O 207a_100000210304_100011361521 [0,2,0,0,0,0|2,0,0]=4 8071 B12R1.1 OCCNCc1ccc(nc1)O 2230a_100000757128_100000211926 [0,2,0,0,0,0|2,0,0]=4 8072 B12R1.1 OCCOCc1ccc(cc1)Br 34a_100000695286_100000211926 [0,2,0,0,0,0|1,0,0]=3 8073 B12R1.1 OCCOCc1ccc(cc1)Cl 34a_100000211118_100000211926 [0,2,0,0,0,0|1,0,0]=3 8074 B12R1.1 OCCOCc1ccc(cc1)Cl 7a_100000211118_100000211926 [0,2,0,0,0,0|1,0,0]=3 8075 B12R1.1 OCCOCc1ccc(cc1)F 34a_100000210977_100000211926 [0,2,0,0,0,0|1,0,0]=3 8076 B12R1.1 OCCOCc1ccc(cc1)F 7a_100000210977_100000211926 [0,2,0,0,0,0|1,0,0]=3 8077 B12R1.1 OCCOCc1ccc(cc1)I 34a_100000690907_100000211926 [0,2,0,0,0,0|1,0,0]=3 8078 B12R1.1 OCCOCc1ccc(cc1)I 7a_100000690907_100000211926 [0,2,0,0,0,0|1,0,0]=3 8079 B12R1.1 OCCOCc1ccc(cn1)Br 34a_100000754261_100000211926 [0,2,0,0,0,0|2,0,0]=4 8080 B12R1.1 OCCOCc1ccc(cn1)Cl 34a_100000703999_100000211926 [0,2,0,0,0,0|2,0,0]=4 8081 B12R1.1 OCCOCc1ccc(cn1)F 34a_100011999454_100000211926 [0,2,0,0,0,0|2,0,0]=4 8082 B12R1.1 OCCOCc1ccc(nc1)Br 34a_100009816760_100000211926 [0,2,0,0,0,0|2,0,0]=4 8083 B12R1.1 OCCOCc1ccc(nc1)Br 7a_100009816760_100000211926 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.1 OCCOCc1ccc(nc1)Cl 34a_100000755211_100000211926 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.1 OCCOCc1ccc(nc1)Cl 7a_100000755211_100000211926 [0,2,0,0,0,0|2,0,0]=4 8086 B12R1.1 OCCOCc1ccc(nc1)F 34a_100000079959_100000211926 [0,2,0,0,0,0|2,0,0]=4 8087 B12R1.1 OCCSCc1ccc(cc1)Br 62a_100000189115_100000211926 [0,2,0,0,0,0|1,1,0]=4 8088 B12R1.1 OCCSCc1ccc(cc1)Br 62a_100000211926_100000189115 [0,2,0,0,0,0|1,1,0]=4 8089 B12R1.1 OCCSCc1ccc(cc1)Cl 62a_100000187161_100000211926 [0,2,0,0,0,0|1,1,0]=4 8090 B12R1.1 OCCSCc1ccc(cc1)Cl 62a_100000211926_100000187161 [0,2,0,0,0,0|1,1,0]=4 8091 B12R1.1 OCCSCc1ccc(cc1)F 62a_100000198546_100000211926 [0,2,0,0,0,0|1,1,0]=4 8092 B12R1.1 OCCSCc1ccc(cc1)F 62a_100000211926_100000187164 [0,2,0,0,0,0|1,1,0]=4 8093 B12R1.1 OCCSCc1ccc(cc1)I 62a_100000189116_100000211926 [0,2,0,0,0,0|1,1,0]=4 8094 B12R1.1 OCCSCc1ccc(cc1)I 62a_100000211926_100000189116 [0,2,0,0,0,0|1,1,0]=4 8095 B12R1.1 Oc1ccc(cc1)CCNCF 34a_100000743037_100015361967 [0,2,0,0,0,0|1,0,0]=3 8096 B12R1.1 Oc1ccc(cc1)CCSCF 62a_100009816426_100015361967 [0,2,0,0,0,0|1,0,0]=3 8097 B12R1.1 Oc1ccc(cc1)CCSCF 62a_100015361967_100009816426 [0,2,0,0,0,0|1,0,0]=3 8098 B12R1.1 Oc1ccc(cc1)CNCCF 34a_100000185549_100011217306 [0,2,0,0,0,0|1,0,0]=3 8099 B12R1.1 Oc1ccc(cc1)NCCCF 34a_100000185829_100011934791 [0,2,0,0,0,0|1,0,0]=3 8100 B12R1.1 Oc1ccc(cc1)SCCCF 62a_100011934791_100000185759 [0,2,0,0,0,0|0,1,0]=3 8101 B12R1.1 Oc1ccc(cn1)CNCCF 2230a_100000757128_100011217306 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.1 Oc1ccc(nc1)SCCCF 62a_100000685995_100011934791 [0,2,0,0,0,0|1,1,0]=4 8103 B12R1.1 Oc1ccc(nc1)SCCCF 62a_100011934791_100000744096 [0,2,0,0,0,0|1,1,0]=4 8104 B12R1.1 [13CH3]NCC#Cc1ccc(cc1)Cl 2230a_100011352944_200025704644 [0,2,0,0,0,0|2,0,0]=4 8105 B12R1.1 [13CH3]NCC#Cc1ccc(cc1)Cl 34a_100011352944_200025704644 [0,2,0,0,0,0|2,0,0]=4 8106 B12R1.1 [13CH3]NCCCc1ccc(cc1)Br 2230a_100011297623_200025704644 [0,2,0,0,0,0|2,0,0]=4 8107 B12R1.1 [13CH3]NCCCc1ccc(cc1)Br 34a_100011297623_200025704644 [0,2,0,0,0,0|2,0,0]=4 8108 B12R1.1 [13CH3]NCCCc1ccc(cc1)Cl 2230a_100000748451_200025704644 [0,2,0,0,0,0|2,0,0]=4 8109 B12R1.1 [13CH3]NCCCc1ccc(cc1)Cl 34a_100000748451_200025704644 [0,2,0,0,0,0|2,0,0]=4 8110 B12R1.1 [13CH3]NCCCc1ccc(cc1)F 2230a_100025745824_200025704644 [0,2,0,0,0,0|2,0,0]=4 8111 B12R1.1 [13CH3]NCCCc1ccc(cc1)F 34a_100025745824_200025704644 [0,2,0,0,0,0|2,0,0]=4 8112 B12R1.1 [13CH3]NCCOc1ccc(cc1)Br 2230a_100000746992_200025704644 [0,2,0,0,0,0|1,0,0]=3 8113 B12R1.1 [13CH3]NCCOc1ccc(cc1)Br 34a_100000746992_200025704644 [0,2,0,0,0,0|1,0,0]=3 8114 B12R1.1 [13CH3]NCCOc1ccc(cc1)Cl 2230a_100000697975_200025704644 [0,2,0,0,0,0|1,0,0]=3 8115 B12R1.1 [13CH3]NCCOc1ccc(cc1)Cl 34a_100000697975_200025704644 [0,2,0,0,0,0|1,0,0]=3 8116 B12R1.1 [13CH3]NCCOc1ccc(cc1)F 2230a_100000737420_200025704644 [0,2,0,0,0,0|1,0,0]=3 8117 B12R1.1 [13CH3]NCCOc1ccc(cc1)F 34a_100000737420_200025704644 [0,2,0,0,0,0|1,0,0]=3 8118 B12R1.1 [13CH3]NCCSc1ccc(cc1)Br 2230a_100000184645_200025704644 [0,2,0,0,0,0|1,1,0]=4 8119 B12R1.1 [13CH3]NCCSc1ccc(cc1)Cl 2230a_100000174974_200025704644 [0,2,0,0,0,0|1,1,0]=4 8120 B12R1.1 [13CH3]OCC#Cc1ccc(cc1)Br 34a_100009814260_200025704644 [0,2,0,0,0,0|2,0,0]=4 8121 B12R1.1 [13CH3]OCC#Cc1ccc(cc1)Br 7a_100009814260_200025704644 [0,2,0,0,0,0|2,0,0]=4 8122 B12R1.1 [13CH3]OCC#Cc1ccc(cc1)F 34a_100011219116_200025704644 [0,2,0,0,0,0|2,0,0]=4 8123 B12R1.1 [13CH3]OCC#Cc1ccc(cc1)F 7a_100011219116_200025704644 [0,2,0,0,0,0|2,0,0]=4 8124 B12R1.1 [13CH3]OCCCc1ccc(cc1)Br 34a_100011709247_200025704644 [0,2,0,0,0,0|2,0,0]=4 8125 B12R1.1 [13CH3]OCCCc1ccc(cc1)Br 7a_100011709247_200025704644 [0,2,0,0,0,0|2,0,0]=4 8126 B12R1.1 [13CH3]OCCCc1ccc(cc1)Cl 34a_100011217485_200025704644 [0,2,0,0,0,0|2,0,0]=4 8127 B12R1.1 [13CH3]OCCCc1ccc(cc1)Cl 7a_100011217485_200025704644 [0,2,0,0,0,0|2,0,0]=4 8128 B12R1.1 [13CH3]OCCCc1ccc(cc1)F 34a_100000757351_200025704644 [0,2,0,0,0,0|2,0,0]=4 8129 B12R1.1 [13CH3]OCCCc1ccc(cc1)F 7a_100000757351_200025704644 [0,2,0,0,0,0|2,0,0]=4 8130 B12R1.1 [13CH3]OCCOc1ccc(cc1)Br 34a_100000686261_200025704644 [0,2,0,0,0,0|1,0,0]=3 8131 B12R1.1 [13CH3]OCCOc1ccc(cc1)Br 7a_100000686261_200025704644 [0,2,0,0,0,0|1,0,0]=3 8132 B12R1.1 [13CH3]OCCOc1ccc(cc1)Cl 34a_100000237962_200025704644 [0,2,0,0,0,0|1,0,0]=3 8133 B12R1.1 [13CH3]OCCOc1ccc(cc1)Cl 7a_100000237962_200025704644 [0,2,0,0,0,0|1,0,0]=3 8134 B12R1.1 [13CH3]OCCOc1ccc(cc1)N 34a_100000754363_200025704644 [0,2,0,0,0,0|1,0,0]=3 8135 B12R1.1 [13CH3]OCCOc1ccc(cn1)N 34a_100102662783_200025704644 [0,2,0,0,0,0|2,0,0]=4 8136 B12R1.1 [13CH3]OCCOc1ccc(nc1)Br 34a_200013150534_200025704644 [0,2,0,0,0,0|2,0,0]=4 8137 B12R1.1 [13CH3]OCCOc1ccc(nc1)Br 7a_200013150534_200025704644 [0,2,0,0,0,0|2,0,0]=4 8138 B12R1.1 [13CH3]OCCSc1ccc(cc1)Cl 34a_100000230527_200025704644 [0,2,0,0,0,0|1,1,0]=4 8139 B12R1.1 [13CH3]OCCSc1ccc(cc1)Cl 7a_100000230527_200025704644 [0,2,0,0,0,0|1,1,0]=4 8140 B12R1.1 [13CH3]OCCSc1ccc(cc1)F 34a_200000230679_200025704644 [0,2,0,0,0,0|1,1,0]=4 8141 B12R1.1 [13CH3]OCCSc1ccc(cc1)F 7a_200000230679_200025704644 [0,2,0,0,0,0|1,1,0]=4 8142 B12R1.1 [13CH3]SCC#Cc1ccc(cc1)Br 62a_100010706785_200025704644 [0,2,0,0,0,0|2,0,0]=4 8143 B12R1.1 [13CH3]SCC#Cc1ccc(cc1)Br 62a_200025704644_100010706785 [0,2,0,0,0,0|2,0,0]=4 8144 B12R1.1 [13CH3]SCC#Cc1ccc(cc1)F 62a_100010402171_200025704644 [0,2,0,0,0,0|2,0,0]=4 8145 B12R1.1 [13CH3]SCC#Cc1ccc(cc1)F 62a_200025704644_100010402171 [0,2,0,0,0,0|2,0,0]=4 8146 B12R1.1 [13CH3]SCCCc1ccc(cc1)Br 62a_100011713682_200025704644 [0,2,0,0,0,0|2,0,0]=4 8147 B12R1.1 [13CH3]SCCCc1ccc(cc1)Br 62a_200025704644_100011713682 [0,2,0,0,0,0|2,0,0]=4 8148 B12R1.1 [13CH3]SCCCc1ccc(cc1)Cl 62a_100000759440_200025704644 [0,2,0,0,0,0|2,0,0]=4 8149 B12R1.1 [13CH3]SCCCc1ccc(cc1)Cl 62a_200025704644_100000759440 [0,2,0,0,0,0|2,0,0]=4 8150 B12R1.1 [13CH3]SCCCc1ccc(cc1)F 62a_200011713563_200025704644 [0,2,0,0,0,0|2,0,0]=4 8151 B12R1.1 [13CH3]SCCCc1ccc(cc1)F 62a_200025704644_200011713563 [0,2,0,0,0,0|2,0,0]=4 8152 B12R1.1 [13CH3]SCCOc1ccc(cc1)Br 62a_100000183278_200025704644 [0,2,0,0,0,0|1,0,0]=3 8153 B12R1.1 [13CH3]SCCOc1ccc(cc1)Br 62a_200025704644_100000183278 [0,2,0,0,0,0|1,0,0]=3 8154 B12R1.1 [13CH3]SCCOc1ccc(cc1)Cl 62a_100000184122_200025704644 [0,2,0,0,0,0|1,0,0]=3 8155 B12R1.1 [13CH3]SCCOc1ccc(cc1)Cl 62a_200025704644_100000184122 [0,2,0,0,0,0|1,0,0]=3 8156 B12R1.1 [13CH3]SCCOc1ccc(cc1)F 62a_100000184936_200025704644 [0,2,0,0,0,0|1,0,0]=3 8157 B12R1.1 [13CH3]SCCOc1ccc(cc1)F 62a_200025704644_100000184936 [0,2,0,0,0,0|1,0,0]=3 8158 B12R1.1 [O-][n+]1ccc(cc1)COCCF 34a_100000031831_100011217306 [0,2,0,0,0,0|1,0,1]=4 8159 B12R1.1 [O-][n+]1ccc(cc1)COCCF 7a_100000031831_100011217306 [0,2,0,0,0,0|1,0,1]=4 8160 B12R1.1 [O-][n+]1ccc(cc1)COCCO 34a_100000031831_100000211926 [0,2,0,0,0,0|1,0,1]=4 8161 B12R1.1 [O-][n+]1ccc(cc1)COCCO 7a_100000031831_100000211926 [0,2,0,0,0,0|1,0,1]=4 8162 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [0,2,0,0,0,0|1,0,1]=4 8163 B12R1.16 C#CCN(C)c1ccc(cc1)O 34a_100000182112_100000184674 [0,2,0,0,0,0|1,0,1]=4 8164 B12R1.16 C=C(OCC)c1ccc(nn1)O 271570a_203496583355_100010989170 [0,2,0,0,0,0|2,0,0]=4 8165 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [0,2,0,0,0,0|1,0,1]=4 8166 B12R1.16 C=CCC(O)c1ccc(cc1)O 271570a_203496583355_100011466436 [0,2,0,0,0,0|1,0,1]=4 8167 B12R1.16 C=CCN(C)c1ccc(cc1)O 269982a_100000182112_100000210623 [0,2,0,0,0,0|1,0,1]=4 8168 B12R1.16 C=CCN(C)c1ccc(cc1)O 34a_100000182112_100015514636 [0,2,0,0,0,0|1,0,1]=4 8169 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [0,2,0,0,0,0|1,0,1]=4 8170 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [0,2,0,0,0,0|1,0,0]=3 8171 B12R1.16 CC(OCF)c1ccc(cc1)Br 34a_100000745893_100015361967 [0,2,0,0,0,0|2,0,0]=4 8172 B12R1.16 CC(OCF)c1ccc(cc1)Br 7a_100000745893_100015361967 [0,2,0,0,0,0|2,0,0]=4 8173 B12R1.16 CC(OCF)c1ccc(cc1)F 34a_100000181323_100015361967 [0,2,0,0,0,0|2,0,0]=4 8174 B12R1.16 CC(OCF)c1ccc(cc1)F 7a_100000181323_100015361967 [0,2,0,0,0,0|2,0,0]=4 8175 B12R1.16 CC(OCF)c1ccc(cc1)N 34a_100011216399_100015361967 [0,2,0,0,0,0|2,0,0]=4 8176 B12R1.16 CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210303 [0,2,0,0,0,0|2,0,0]=4 8177 B12R1.16 CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210303 [0,2,0,0,0,0|2,0,0]=4 8178 B12R1.16 CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210303 [0,2,0,0,0,0|2,0,0]=4 8179 B12R1.16 CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210303 [0,2,0,0,0,0|2,0,0]=4 8180 B12R1.16 CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210303 [0,2,0,0,0,0|2,0,0]=4 8181 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [0,2,0,0,0,0|1,0,0]=3 8182 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [0,2,0,0,0,0|1,0,0]=3 8183 B12R1.16 CCCC(=O)c1ccc(nc1)O 271570a_203496583355_200012185933 [0,2,0,0,0,0|2,0,0]=4 8184 B12R1.16 CCCC(O)c1ccc(cc1)O 271570a_203496583355_100011350873 [0,2,0,0,0,0|1,0,0]=3 8185 B12R1.16 CCCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210303 [0,2,0,0,0,0|2,0,0]=4 8186 B12R1.16 CCCN(C)c1ccc(cc1)Br 269982a_100000219623_100000210303 [0,2,0,0,0,0|2,0,0]=4 8187 B12R1.16 CCCN(C)c1ccc(cc1)Br 34a_100000219623_100000210303 [0,2,0,0,0,0|2,0,0]=4 8188 B12R1.16 CCCN(C)c1ccc(cc1)C 2230a_100000219977_100000210303 [0,2,0,0,0,0|2,0,0]=4 8189 B12R1.16 CCCN(C)c1ccc(cc1)C 269982a_100000219977_100000210303 [0,2,0,0,0,0|2,0,0]=4 8190 B12R1.16 CCCN(C)c1ccc(cc1)C 34a_100000219977_100000210303 [0,2,0,0,0,0|2,0,0]=4 8191 B12R1.16 CCCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210303 [0,2,0,0,0,0|2,0,0]=4 8192 B12R1.16 CCCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210303 [0,2,0,0,0,0|2,0,0]=4 8193 B12R1.16 CCCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210303 [0,2,0,0,0,0|2,0,0]=4 8194 B12R1.16 CCCN(C)c1ccc(cc1)F 2230a_100000219829_100000210303 [0,2,0,0,0,0|2,0,0]=4 8195 B12R1.16 CCCN(C)c1ccc(cc1)F 269982a_100000219829_100000210303 [0,2,0,0,0,0|2,0,0]=4 8196 B12R1.16 CCCN(C)c1ccc(cc1)F 34a_100000219829_100000210303 [0,2,0,0,0,0|2,0,0]=4 8197 B12R1.16 CCCN(C)c1ccc(cc1)I 2230a_100000743151_100000210303 [0,2,0,0,0,0|2,0,0]=4 8198 B12R1.16 CCCN(C)c1ccc(cc1)I 269982a_100000743151_100000210303 [0,2,0,0,0,0|2,0,0]=4 8199 B12R1.16 CCCN(C)c1ccc(cc1)I 34a_100000743151_100000210303 [0,2,0,0,0,0|2,0,0]=4 8200 B12R1.16 CCCN(C)c1ccc(cc1)O 269982a_100000182112_100000210303 [0,2,0,0,0,0|1,0,0]=3 8201 B12R1.16 CCCN(C)c1ccc(cc1)O 34a_100000182112_100000210303 [0,2,0,0,0,0|1,0,0]=3 8202 B12R1.16 CCNC(=O)c1ccc(cc1)Br 11a_100015525214_100000185839 [0,2,0,0,0,0|2,0,0]=4 8203 B12R1.16 CCNC(=O)c1ccc(cc1)Br 240690a_100015525214_100000185839 [0,2,0,0,0,0|2,0,0]=4 8204 B12R1.16 CCNC(=O)c1ccc(cc1)Br 527a_100015525214_100000185839 [0,2,0,0,0,0|2,0,0]=4 8205 B12R1.16 CCNC(=O)c1ccc(cc1)C 11a_100015525214_100000188618 [0,2,0,0,0,0|2,0,0]=4 8206 B12R1.16 CCNC(=O)c1ccc(cc1)C 240690a_100015525214_100000188618 [0,2,0,0,0,0|2,0,0]=4 8207 B12R1.16 CCNC(=O)c1ccc(cc1)C 527a_100015525214_100000188618 [0,2,0,0,0,0|2,0,0]=4 8208 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 11a_100015525214_100000210187 [0,2,0,0,0,0|2,0,0]=4 8209 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 240690a_100015525214_100000210187 [0,2,0,0,0,0|2,0,0]=4 8210 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 527a_100015525214_100000210187 [0,2,0,0,0,0|2,0,0]=4 8211 B12R1.16 CCNC(=O)c1ccc(cc1)F 11a_100015525214_100000187176 [0,2,0,0,0,0|2,0,0]=4 8212 B12R1.16 CCNC(=O)c1ccc(cc1)F 240690a_100015525214_100000187176 [0,2,0,0,0,0|2,0,0]=4 8213 B12R1.16 CCNC(=O)c1ccc(cc1)F 527a_100015525214_100000187176 [0,2,0,0,0,0|2,0,0]=4 8214 B12R1.16 CCNC(=O)c1ccc(cc1)I 11a_100015525214_100000187904 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.16 CCNC(=O)c1ccc(cc1)I 240690a_100015525214_100000187904 [0,2,0,0,0,0|2,0,0]=4 8216 B12R1.16 CCNC(=O)c1ccc(cc1)I 527a_100015525214_100000187904 [0,2,0,0,0,0|2,0,0]=4 8217 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [0,2,0,0,0,0|1,0,0]=3 8218 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [0,2,0,0,0,0|1,0,0]=3 8219 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [0,2,0,0,0,0|1,0,0]=3 8220 B12R1.16 CCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781264 [0,2,0,0,0,0|2,0,0]=4 8221 B12R1.16 CCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000160145 [0,2,0,0,0,0|2,0,0]=4 8222 B12R1.16 CCNC(C)c1ccc(cc1)Br 2230a_100015525214_100000755118 [0,2,0,0,0,0|2,0,0]=4 8223 B12R1.16 CCNC(C)c1ccc(cc1)Br 269862a_100015525214_100000185794 [0,2,0,0,0,0|2,0,0]=4 8224 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [0,2,0,0,0,0|2,0,0]=4 8225 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [0,2,0,0,0,0|2,0,0]=4 8226 B12R1.16 CCNC(C)c1ccc(cc1)Cl 2230a_100015525214_100000684792 [0,2,0,0,0,0|2,0,0]=4 8227 B12R1.16 CCNC(C)c1ccc(cc1)Cl 269862a_100015525214_100000185797 [0,2,0,0,0,0|2,0,0]=4 8228 B12R1.16 CCNC(C)c1ccc(cc1)F 2230a_100015525214_100000743420 [0,2,0,0,0,0|2,0,0]=4 8229 B12R1.16 CCNC(C)c1ccc(cc1)F 269862a_100015525214_100000185800 [0,2,0,0,0,0|2,0,0]=4 8230 B12R1.16 CCNC(C)c1ccc(cc1)I 269862a_100015525214_100000185465 [0,2,0,0,0,0|2,0,0]=4 8231 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210202 [0,2,0,0,0,0|2,0,0]=4 8232 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210202 [0,2,0,0,0,0|2,0,0]=4 8233 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210202 [0,2,0,0,0,0|2,0,0]=4 8234 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [0,2,0,0,0,0|1,0,0]=3 8235 B12R1.16 CCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210202 [0,2,0,0,0,0|2,0,0]=4 8236 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [0,2,0,0,0,0|2,0,0]=4 8237 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [0,2,0,0,0,0|2,0,0]=4 8238 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210202 [0,2,0,0,0,0|2,0,0]=4 8239 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210202 [0,2,0,0,0,0|2,0,0]=4 8240 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [0,2,0,0,0,0|0,0,0]=2 8241 B12R1.16 CCOC(=O)c1ccc(cn1)O 271570a_203496583355_100011781174 [0,2,0,0,0,0|1,0,0]=3 8242 B12R1.16 CCOC(=O)c1ccc(nc1)O 271570a_203496583355_100000170224 [0,2,0,0,0,0|1,0,0]=3 8243 B12R1.16 CCOC(=O)c1ccc(nn1)O 271570a_203496583355_100011933454 [0,2,0,0,0,0|2,0,0]=4 8244 B12R1.16 CCOC(=O)c1cnc(cn1)O 271570a_203496583355_100000707868 [0,2,0,0,0,0|2,0,0]=4 8245 B12R1.16 CCOC(=O)c1cnc(nc1)O 271570a_203496583355_100011935661 [0,2,0,0,0,0|2,0,0]=4 8246 B12R1.16 CCOC(=O)c1ncc(cn1)O 271570a_203496583355_100010168878 [0,2,0,0,0,0|2,0,0]=4 8247 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210202 [0,2,0,0,0,0|1,0,0]=3 8248 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100121572206_100000755118 [0,2,0,0,0,0|1,0,0]=3 8249 B12R1.16 CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210202 [0,2,0,0,0,0|1,0,0]=3 8250 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [0,2,0,0,0,0|1,0,0]=3 8251 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210202 [0,2,0,0,0,0|1,0,0]=3 8252 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100121572206_100000743420 [0,2,0,0,0,0|1,0,0]=3 8253 B12R1.16 CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210202 [0,2,0,0,0,0|1,0,0]=3 8254 B12R1.16 CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210202 [0,2,0,0,0,0|1,0,0]=3 8255 B12R1.16 CCOC(C)c1ccc(cn1)Br 34a_100012353650_100000210202 [0,2,0,0,0,0|2,0,0]=4 8256 B12R1.16 CCOC(C)c1ccc(cn1)Br 7a_100012353650_100000210202 [0,2,0,0,0,0|2,0,0]=4 8257 B12R1.16 CCOC(C)c1ccc(nc1)Br 34a_200010274204_100000210202 [0,2,0,0,0,0|2,0,0]=4 8258 B12R1.16 CCOC(C)c1ccc(nc1)Br 7a_200010274204_100000210202 [0,2,0,0,0,0|2,0,0]=4 8259 B12R1.16 CCOC(C)c1ccc(nc1)C 34a_200011815720_100000210202 [0,2,0,0,0,0|2,0,0]=4 8260 B12R1.16 CCOC(C)c1ccc(nc1)C 7a_200011815720_100000210202 [0,2,0,0,0,0|2,0,0]=4 8261 B12R1.16 CCOC(C)c1ccc(nc1)Cl 34a_200012017543_100000210202 [0,2,0,0,0,0|2,0,0]=4 8262 B12R1.16 CCOC(C)c1ccc(nc1)Cl 7a_200012017543_100000210202 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [0,2,0,0,0,0|1,0,0]=3 8264 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [0,2,0,0,0,0|1,0,0]=3 8265 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [0,2,0,0,0,0|1,0,0]=3 8266 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [0,2,0,0,0,0|1,0,0]=3 8267 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000210202_100000755118 [0,2,0,0,0,0|1,1,0]=4 8268 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000755118_100000210202 [0,2,0,0,0,0|1,1,0]=4 8269 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100000210202_100011261388 [0,2,0,0,0,0|1,1,0]=4 8270 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100011261388_100000210202 [0,2,0,0,0,0|1,1,0]=4 8271 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000210202_100000684792 [0,2,0,0,0,0|1,1,0]=4 8272 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210202 [0,2,0,0,0,0|1,1,0]=4 8273 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000210202_100000743420 [0,2,0,0,0,0|1,1,0]=4 8274 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000743420_100000210202 [0,2,0,0,0,0|1,1,0]=4 8275 B12R1.16 CN(CC#N)c1ccc(cc1)O 269982a_100000182112_100011214920 [0,2,0,0,0,0|1,0,1]=4 8276 B12R1.16 CN(CC=O)c1ccc(cc1)O 269982a_100000182112_200015260668 [0,2,0,0,0,0|1,0,1]=4 8277 B12R1.16 CN(CC=O)c1ccc(cc1)O 34a_100000182112_200009817547 [0,2,0,0,0,0|1,0,1]=4 8278 B12R1.16 CN(CCF)c1ccc(cc1)Br 2230a_100000219623_100011217306 [0,2,0,0,0,0|2,0,0]=4 8279 B12R1.16 CN(CCF)c1ccc(cc1)Br 269982a_100000219623_100011217306 [0,2,0,0,0,0|2,0,0]=4 8280 B12R1.16 CN(CCF)c1ccc(cc1)Br 34a_100000219623_100011217306 [0,2,0,0,0,0|2,0,0]=4 8281 B12R1.16 CN(CCF)c1ccc(cc1)Cl 2230a_100020629279_100011217306 [0,2,0,0,0,0|2,0,0]=4 8282 B12R1.16 CN(CCF)c1ccc(cc1)Cl 269982a_100020629279_100011217306 [0,2,0,0,0,0|2,0,0]=4 8283 B12R1.16 CN(CCF)c1ccc(cc1)Cl 34a_100020629279_100011217306 [0,2,0,0,0,0|2,0,0]=4 8284 B12R1.16 CN(CCF)c1ccc(cc1)F 2230a_100000219829_100011217306 [0,2,0,0,0,0|2,0,0]=4 8285 B12R1.16 CN(CCF)c1ccc(cc1)F 269982a_100000219829_100011217306 [0,2,0,0,0,0|2,0,0]=4 8286 B12R1.16 CN(CCF)c1ccc(cc1)F 34a_100000219829_100011217306 [0,2,0,0,0,0|2,0,0]=4 8287 B12R1.16 CN(CCF)c1ccc(cc1)I 2230a_100000743151_100011217306 [0,2,0,0,0,0|2,0,0]=4 8288 B12R1.16 CN(CCF)c1ccc(cc1)I 269982a_100000743151_100011217306 [0,2,0,0,0,0|2,0,0]=4 8289 B12R1.16 CN(CCF)c1ccc(cc1)I 34a_100000743151_100011217306 [0,2,0,0,0,0|2,0,0]=4 8290 B12R1.16 CN(CCF)c1ccc(cc1)O 269982a_100000182112_100011217306 [0,2,0,0,0,0|1,0,0]=3 8291 B12R1.16 CN(CCF)c1ccc(cc1)O 34a_100000182112_100011217306 [0,2,0,0,0,0|1,0,0]=3 8292 B12R1.16 CN(CCO)c1ccc(cc1)Br 2230a_100000219623_100000211926 [0,2,0,0,0,0|2,0,0]=4 8293 B12R1.16 CN(CCO)c1ccc(cc1)Br 269982a_100000219623_100000211926 [0,2,0,0,0,0|2,0,0]=4 8294 B12R1.16 CN(CCO)c1ccc(cc1)Br 34a_100000219623_100000211926 [0,2,0,0,0,0|2,0,0]=4 8295 B12R1.16 CN(CCO)c1ccc(cc1)Cl 2230a_100020629279_100000211926 [0,2,0,0,0,0|2,0,0]=4 8296 B12R1.16 CN(CCO)c1ccc(cc1)Cl 269982a_100020629279_100000211926 [0,2,0,0,0,0|2,0,0]=4 8297 B12R1.16 CN(CCO)c1ccc(cc1)Cl 34a_100020629279_100000211926 [0,2,0,0,0,0|2,0,0]=4 8298 B12R1.16 CN(CCO)c1ccc(cc1)F 2230a_100000219829_100000211926 [0,2,0,0,0,0|2,0,0]=4 8299 B12R1.16 CN(CCO)c1ccc(cc1)F 269982a_100000219829_100000211926 [0,2,0,0,0,0|2,0,0]=4 8300 B12R1.16 CN(CCO)c1ccc(cc1)F 34a_100000219829_100000211926 [0,2,0,0,0,0|2,0,0]=4 8301 B12R1.16 CN(CCO)c1ccc(cc1)I 2230a_100000743151_100000211926 [0,2,0,0,0,0|2,0,0]=4 8302 B12R1.16 CN(CCO)c1ccc(cc1)I 269982a_100000743151_100000211926 [0,2,0,0,0,0|2,0,0]=4 8303 B12R1.16 CN(CCO)c1ccc(cc1)I 34a_100000743151_100000211926 [0,2,0,0,0,0|2,0,0]=4 8304 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [0,2,0,0,0,0|1,0,0]=3 8305 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [0,2,0,0,0,0|1,0,0]=3 8306 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [0,2,0,0,0,0|2,0,0]=4 8307 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [0,2,0,0,0,0|2,0,0]=4 8308 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [0,2,0,0,0,0|2,0,0]=4 8309 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [0,2,0,0,0,0|2,0,0]=4 8310 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [0,2,0,0,0,0|2,0,0]=4 8311 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [0,2,0,0,0,0|2,0,0]=4 8312 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [0,2,0,0,0,0|2,0,0]=4 8313 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [0,2,0,0,0,0|2,0,0]=4 8314 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [0,2,0,0,0,0|2,0,0]=4 8315 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [0,2,0,0,0,0|1,0,0]=3 8316 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [0,2,0,0,0,0|1,0,0]=3 8317 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [0,2,0,0,0,0|1,0,0]=3 8318 B12R1.16 CNCC(O)c1ccc(cc1)Br 2230a_100020626992_200000210301 [0,2,0,0,0,0|2,0,0]=4 8319 B12R1.16 CNCC(O)c1ccc(cc1)Br 34a_100020626992_200000210301 [0,2,0,0,0,0|2,0,0]=4 8320 B12R1.16 CNCC(O)c1ccc(cc1)C 2230a_200020610344_200000210301 [0,2,0,0,0,0|2,0,0]=4 8321 B12R1.16 CNCC(O)c1ccc(cc1)C 34a_200020610344_200000210301 [0,2,0,0,0,0|2,0,0]=4 8322 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_200000210301 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_106832991635_200011996143 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100000736658_200000210301 [0,2,0,0,0,0|2,0,0]=4 8325 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100102657272_200011996143 [0,2,0,0,0,0|2,0,0]=4 8326 B12R1.16 CNCC(O)c1ccc(cc1)Cl 7a_106832991635_200011996143 [0,2,0,0,0,0|2,0,0]=4 8327 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [0,2,0,0,0,0|1,0,0]=3 8328 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 2230a_106832991635_100000720402 [0,2,0,0,0,0|2,0,0]=4 8329 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 34a_100102657272_100000720402 [0,2,0,0,0,0|2,0,0]=4 8330 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 7a_106832991635_100000720402 [0,2,0,0,0,0|2,0,0]=4 8331 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [0,2,0,0,0,0|2,0,0]=4 8332 B12R1.16 COCC(=O)c1ccc(cc1)Br 34a_100138415774_100000188085 [0,2,0,0,0,0|2,0,0]=4 8333 B12R1.16 COCC(=O)c1ccc(cc1)C 34a_100138415774_100000211441 [0,2,0,0,0,0|2,0,0]=4 8334 B12R1.16 COCC(=O)c1ccc(cc1)F 34a_100000246311_200000210301 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.16 COCC(=O)c1ccc(cc1)I 34a_100138415774_100011216261 [0,2,0,0,0,0|2,0,0]=4 8336 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [0,2,0,0,0,0|1,0,0]=3 8337 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [0,2,0,0,0,0|1,0,0]=3 8338 B12R1.16 COCC(N)c1ccc(cc1)Br 34a_100000734186_200000210301 [0,2,0,0,0,0|2,0,0]=4 8339 B12R1.16 COCC(N)c1ccc(cc1)F 34a_100000705410_200000210301 [0,2,0,0,0,0|2,0,0]=4 8340 B12R1.16 COCC(O)c1ccc(cc1)Cl 34a_100138415774_200011996143 [0,2,0,0,0,0|2,0,0]=4 8341 B12R1.16 COCN(C)c1ccc(cc1)Br 2230a_100000219623_100000766300 [0,2,0,0,0,0|2,0,0]=4 8342 B12R1.16 COCN(C)c1ccc(cc1)Br 269982a_100000219623_100000766300 [0,2,0,0,0,0|2,0,0]=4 8343 B12R1.16 COCN(C)c1ccc(cc1)C 2230a_100000219977_100000766300 [0,2,0,0,0,0|2,0,0]=4 8344 B12R1.16 COCN(C)c1ccc(cc1)C 269982a_100000219977_100000766300 [0,2,0,0,0,0|2,0,0]=4 8345 B12R1.16 COCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000766300 [0,2,0,0,0,0|2,0,0]=4 8346 B12R1.16 COCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000766300 [0,2,0,0,0,0|2,0,0]=4 8347 B12R1.16 COCN(C)c1ccc(cc1)F 2230a_100000219829_100000766300 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.16 COCN(C)c1ccc(cc1)F 269982a_100000219829_100000766300 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.16 COCN(C)c1ccc(cc1)I 2230a_100000743151_100000766300 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.16 COCN(C)c1ccc(cc1)I 269982a_100000743151_100000766300 [0,2,0,0,0,0|2,0,0]=4 8351 B12R1.16 COCN(C)c1ccc(cc1)O 269982a_100000182112_100000766300 [0,2,0,0,0,0|1,0,0]=3 8352 B12R1.16 COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200000210301 [0,2,0,0,0,0|2,0,0]=4 8353 B12R1.16 COC[C@H](N)c1ccc(cc1)C 34a_100009818840_200000210301 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.16 COC[C@H](O)c1ccc(cc1)F 34a_100138415774_100000720402 [0,2,0,0,0,0|2,0,0]=4 8355 B12R1.16 CSCC(=O)c1ccc(cc1)Br 62a_100000188085_200000210301 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_100000211441_200000210301 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_200000210301_100000211441 [0,2,0,0,0,0|2,0,0]=4 8358 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200000210301 [0,2,0,0,0,0|2,0,0]=4 8359 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_200000210301_100000211071 [0,2,0,0,0,0|2,0,0]=4 8360 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_100000211279_200000210301 [0,2,0,0,0,0|2,0,0]=4 8361 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_200000210301_100000211279 [0,2,0,0,0,0|2,0,0]=4 8362 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_100011216261_200000210301 [0,2,0,0,0,0|2,0,0]=4 8363 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_200000210301_100011216261 [0,2,0,0,0,0|2,0,0]=4 8364 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [0,2,0,0,0,0|1,0,0]=3 8365 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [0,2,0,0,0,0|1,0,0]=3 8366 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200000210301_200011996143 [0,2,0,0,0,0|2,0,0]=4 8367 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200011996143_200000210301 [0,2,0,0,0,0|2,0,0]=4 8368 B12R1.16 CSCN(C)c1ccc(cc1)Br 2230a_100000219623_100011218213 [0,2,0,0,0,0|2,0,0]=4 8369 B12R1.16 CSCN(C)c1ccc(cc1)Br 269982a_100000219623_100011218213 [0,2,0,0,0,0|2,0,0]=4 8370 B12R1.16 CSCN(C)c1ccc(cc1)Br 34a_100000219623_100011218213 [0,2,0,0,0,0|2,0,0]=4 8371 B12R1.16 CSCN(C)c1ccc(cc1)C 2230a_100000219977_100011218213 [0,2,0,0,0,0|2,0,0]=4 8372 B12R1.16 CSCN(C)c1ccc(cc1)C 269982a_100000219977_100011218213 [0,2,0,0,0,0|2,0,0]=4 8373 B12R1.16 CSCN(C)c1ccc(cc1)C 34a_100000219977_100011218213 [0,2,0,0,0,0|2,0,0]=4 8374 B12R1.16 CSCN(C)c1ccc(cc1)Cl 2230a_100020629279_100011218213 [0,2,0,0,0,0|2,0,0]=4 8375 B12R1.16 CSCN(C)c1ccc(cc1)Cl 269982a_100020629279_100011218213 [0,2,0,0,0,0|2,0,0]=4 8376 B12R1.16 CSCN(C)c1ccc(cc1)Cl 34a_100020629279_100011218213 [0,2,0,0,0,0|2,0,0]=4 8377 B12R1.16 CSCN(C)c1ccc(cc1)F 2230a_100000219829_100011218213 [0,2,0,0,0,0|2,0,0]=4 8378 B12R1.16 CSCN(C)c1ccc(cc1)F 269982a_100000219829_100011218213 [0,2,0,0,0,0|2,0,0]=4 8379 B12R1.16 CSCN(C)c1ccc(cc1)F 34a_100000219829_100011218213 [0,2,0,0,0,0|2,0,0]=4 8380 B12R1.16 CSCN(C)c1ccc(cc1)I 2230a_100000743151_100011218213 [0,2,0,0,0,0|2,0,0]=4 8381 B12R1.16 CSCN(C)c1ccc(cc1)I 269982a_100000743151_100011218213 [0,2,0,0,0,0|2,0,0]=4 8382 B12R1.16 CSCN(C)c1ccc(cc1)I 34a_100000743151_100011218213 [0,2,0,0,0,0|2,0,0]=4 8383 B12R1.16 CSCN(C)c1ccc(cc1)O 269982a_100000182112_100011218213 [0,2,0,0,0,0|1,0,0]=3 8384 B12R1.16 CSCN(C)c1ccc(cc1)O 34a_100000182112_100011218213 [0,2,0,0,0,0|1,0,0]=3 8385 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_100000720402_200000210301 [0,2,0,0,0,0|2,0,0]=4 8386 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_200000210301_100000720402 [0,2,0,0,0,0|2,0,0]=4 8387 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 34a_100011852131_100015361967 [0,2,0,0,0,0|2,0,0]=4 8388 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 7a_100011852131_100015361967 [0,2,0,0,0,0|2,0,0]=4 8389 B12R1.16 Cc1ccc(cc1)C(=O)CCF 1458a_100000188618_100011217306 [0,2,0,0,0,0|2,0,0]=4 8390 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [0,2,0,0,0,0|2,0,0]=4 8391 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_100000211441_200025704644 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000211441 [0,2,0,0,0,0|2,0,0]=4 8393 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 2230a_200020610344_200025704644 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 34a_200020610344_200025704644 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.16 Cc1ccc(cc1)N(C)CCF 2230a_100000219977_100011217306 [0,2,0,0,0,0|2,0,0]=4 8396 B12R1.16 Cc1ccc(cc1)N(C)CCF 269982a_100000219977_100011217306 [0,2,0,0,0,0|2,0,0]=4 8397 B12R1.16 Cc1ccc(cc1)N(C)CCF 34a_100000219977_100011217306 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.16 Cc1ccc(cc1)N(C)CCO 2230a_100000219977_100000211926 [0,2,0,0,0,0|2,0,0]=4 8399 B12R1.16 Cc1ccc(cc1)N(C)CCO 269982a_100000219977_100000211926 [0,2,0,0,0,0|2,0,0]=4 8400 B12R1.16 Cc1ccc(cc1)N(C)CCO 34a_100000219977_100000211926 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 34a_100000690690_100015361967 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 7a_100000690690_100015361967 [0,2,0,0,0,0|2,0,0]=4 8403 B12R1.16 Cc1ccc(cc1)[C@@H](N)CO[13CH3] 34a_100009818840_200025704644 [0,2,0,0,0,0|2,0,0]=4 8404 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [0,2,0,0,0,0|1,0,1]=4 8405 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [0,2,0,0,0,0|1,0,1]=4 8406 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [0,2,0,0,0,0|1,0,0]=3 8407 B12R1.16 O=C(CCF)c1ccc(cc1)Br 1458a_100000185839_100011217306 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.16 O=C(CCF)c1ccc(cc1)Cl 1458a_100000210187_100011217306 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.16 O=C(CCF)c1ccc(cc1)F 1458a_100000187176_100011217306 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.16 O=C(CCF)c1ccc(cc1)I 1458a_100000187904_100011217306 [0,2,0,0,0,0|2,0,0]=4 8411 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [0,2,0,0,0,0|1,0,0]=3 8412 B12R1.16 O=C(CCO)c1ccc(cc1)Br 1458a_100000185839_100000211926 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.16 O=C(CCO)c1ccc(cc1)Cl 1458a_100000210187_100000211926 [0,2,0,0,0,0|2,0,0]=4 8414 B12R1.16 O=C(CCO)c1ccc(cc1)F 1458a_100000187176_100000211926 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.16 O=C(CCO)c1ccc(cc1)I 1458a_100000187904_100000211926 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [0,2,0,0,0,0|1,0,0]=3 8417 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 2230a_100020626992_200025704644 [0,2,0,0,0,0|2,0,0]=4 8418 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 34a_100020626992_200025704644 [0,2,0,0,0,0|2,0,0]=4 8419 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 2230a_100000736658_200025704644 [0,2,0,0,0,0|2,0,0]=4 8420 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 34a_100000736658_200025704644 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [0,2,0,0,0,0|1,0,0]=3 8422 B12R1.16 [13CH3]OCC(=O)c1ccc(cc1)F 34a_100000246311_200025704644 [0,2,0,0,0,0|2,0,0]=4 8423 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)Br 34a_100000734186_200025704644 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)F 34a_100000705410_200025704644 [0,2,0,0,0,0|2,0,0]=4 8425 B12R1.16 [13CH3]OC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200025704644 [0,2,0,0,0,0|2,0,0]=4 8426 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Br 62a_100000188085_200025704644 [0,2,0,0,0,0|2,0,0]=4 8427 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_100000211071_200025704644 [0,2,0,0,0,0|2,0,0]=4 8428 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_200025704644_100000211071 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_100000211279_200025704644 [0,2,0,0,0,0|2,0,0]=4 8430 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_200025704644_100000211279 [0,2,0,0,0,0|2,0,0]=4 8431 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_100011216261_200025704644 [0,2,0,0,0,0|2,0,0]=4 8432 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_200025704644_100011216261 [0,2,0,0,0,0|2,0,0]=4 8433 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [0,2,0,0,0,0|1,0,0]=3 8434 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [0,2,0,0,0,0|1,0,0]=3 8435 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200011996143_200025704644 [0,2,0,0,0,0|2,0,0]=4 8436 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200025704644_200011996143 [0,2,0,0,0,0|2,0,0]=4 8437 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_100000720402_200025704644 [0,2,0,0,0,0|2,0,0]=4 8438 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_200025704644_100000720402 [0,2,0,0,0,0|2,0,0]=4 8439 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 34a_217856618577_100000210202 [0,2,0,0,0,0|1,0,0]=3 8440 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 7a_217856618577_100000210202 [0,2,0,0,0,0|1,0,0]=3 8441 B12R1.16 [2H]C(OCF)c1ccc(cc1)F 34a_217856618577_100015361967 [0,2,0,0,0,0|2,0,0]=4 8442 B12R1.16 [2H]C(OCF)c1ccc(cc1)F 7a_217856618577_100015361967 [0,2,0,0,0,0|2,0,0]=4 8443 B12R1.21 C=C(C)CNc1ccc(cc1)Br 2230a_100000210018_100000748629 [0,2,0,0,0,0|2,0,0]=4 8444 B12R1.21 C=C(C)CNc1ccc(cc1)Br 34a_100000210018_100000748629 [0,2,0,0,0,0|2,0,0]=4 8445 B12R1.21 C=C(C)CNc1ccc(cc1)C 34a_100000124888_100000748629 [0,2,0,0,0,0|2,0,0]=4 8446 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000748629 [0,2,0,0,0,0|2,0,0]=4 8447 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 34a_100000210052_100000748629 [0,2,0,0,0,0|2,0,0]=4 8448 B12R1.21 C=C(C)CNc1ccc(cc1)F 34a_100000185862_100000748629 [0,2,0,0,0,0|2,0,0]=4 8449 B12R1.21 C=C(C)CNc1ccc(cc1)I 34a_100000185761_100000748629 [0,2,0,0,0,0|2,0,0]=4 8450 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [0,2,0,0,0,0|1,0,0]=3 8451 B12R1.21 C=C(C)COc1ccc(=O)[nH]c1 34a_100000075641_100000748629 [0,2,0,0,0,0|1,0,1]=4 8452 B12R1.21 C=C(C)COc1ccc(cc1)Br 34a_100000185759_100000748629 [0,2,0,0,0,0|1,0,0]=3 8453 B12R1.21 C=C(C)COc1ccc(cc1)Br 7a_100000185759_100000748629 [0,2,0,0,0,0|1,0,0]=3 8454 B12R1.21 C=C(C)COc1ccc(cc1)C 34a_100000210336_100000748629 [0,2,0,0,0,0|1,0,0]=3 8455 B12R1.21 C=C(C)COc1ccc(cc1)C 7a_100000210336_100000748629 [0,2,0,0,0,0|1,0,0]=3 8456 B12R1.21 C=C(C)COc1ccc(cc1)Cl 34a_100000210216_100000748629 [0,2,0,0,0,0|1,0,0]=3 8457 B12R1.21 C=C(C)COc1ccc(cc1)Cl 7a_100000210216_100000748629 [0,2,0,0,0,0|1,0,0]=3 8458 B12R1.21 C=C(C)COc1ccc(cc1)F 34a_100000210339_100000748629 [0,2,0,0,0,0|1,0,0]=3 8459 B12R1.21 C=C(C)COc1ccc(cc1)I 34a_100000212066_100000748629 [0,2,0,0,0,0|1,0,0]=3 8460 B12R1.21 C=C(C)COc1ccc(cc1)I 7a_100000212066_100000748629 [0,2,0,0,0,0|1,0,0]=3 8461 B12R1.21 C=C(C)COc1ccc(cc1)N 34a_100000185829_100000748629 [0,2,0,0,0,0|1,0,0]=3 8462 B12R1.21 C=C(C)COc1ccc(cn1)C 34a_100000759353_100000748629 [0,2,0,0,0,0|2,0,0]=4 8463 B12R1.21 C=C(C)COc1ccc(cn1)Cl 34a_100011215309_100000748629 [0,2,0,0,0,0|2,0,0]=4 8464 B12R1.21 C=C(C)COc1ccc(cn1)F 34a_100000742473_100000748629 [0,2,0,0,0,0|2,0,0]=4 8465 B12R1.21 C=C(C)COc1ccc(cn1)N 34a_100000729260_100000748629 [0,2,0,0,0,0|2,0,0]=4 8466 B12R1.21 C=C(C)COc1ccc(nc1)Br 34a_100000685995_100000748629 [0,2,0,0,0,0|2,0,0]=4 8467 B12R1.21 C=C(C)COc1ccc(nc1)Br 7a_100000685995_100000748629 [0,2,0,0,0,0|2,0,0]=4 8468 B12R1.21 C=C(C)COc1ccc(nc1)C 34a_100000745506_100000748629 [0,2,0,0,0,0|2,0,0]=4 8469 B12R1.21 C=C(C)COc1ccc(nc1)C 7a_100000745506_100000748629 [0,2,0,0,0,0|2,0,0]=4 8470 B12R1.21 C=C(C)COc1ccc(nc1)Cl 34a_100000744096_100000748629 [0,2,0,0,0,0|2,0,0]=4 8471 B12R1.21 C=C(C)COc1ccc(nc1)Cl 7a_100000744096_100000748629 [0,2,0,0,0,0|2,0,0]=4 8472 B12R1.21 C=C(C)COc1ccc(nc1)F 34a_100000688820_100000748629 [0,2,0,0,0,0|2,0,0]=4 8473 B12R1.21 C=C(C)COc1ccc(nc1)F 7a_100000688820_100000748629 [0,2,0,0,0,0|2,0,0]=4 8474 B12R1.21 C=C(C)COc1ccc(nc1)I 34a_100000687607_100000748629 [0,2,0,0,0,0|2,0,0]=4 8475 B12R1.21 C=C(C)COc1ccc(nc1)I 7a_100000687607_100000748629 [0,2,0,0,0,0|2,0,0]=4 8476 B12R1.21 C=C(C)COc1ccc(nc1)N 34a_100015188713_100000748629 [0,2,0,0,0,0|2,0,0]=4 8477 B12R1.21 C=C(C)COc1ccc(nc1)N 7a_100015188713_100000748629 [0,2,0,0,0,0|2,0,0]=4 8478 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000748629_100000752885 [0,2,0,0,0,0|1,1,0]=4 8479 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000752885_100000211660 [0,2,0,0,0,0|1,1,0]=4 8480 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000186775_100000211660 [0,2,0,0,0,0|1,1,0]=4 8481 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000748629_100000186775 [0,2,0,0,0,0|1,1,0]=4 8482 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000748629_100000755918 [0,2,0,0,0,0|1,1,0]=4 8483 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000755918_100000211660 [0,2,0,0,0,0|1,1,0]=4 8484 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000211213_100000211660 [0,2,0,0,0,0|1,1,0]=4 8485 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000748629_100000211213 [0,2,0,0,0,0|1,1,0]=4 8486 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000185761_100000211660 [0,2,0,0,0,0|1,1,0]=4 8487 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000748629_100000185761 [0,2,0,0,0,0|1,1,0]=4 8488 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [0,2,0,0,0,0|0,1,0]=3 8489 B12R1.21 C=C(C)CSc1ccc(cn1)O 62a_100000685995_100000211660 [0,2,0,0,0,0|1,1,0]=4 8490 B12R1.21 C=C(C)CSc1ccc(cn1)O 62a_100000748629_100000744096 [0,2,0,0,0,0|1,1,0]=4 8491 B12R1.21 C=C(F)CNc1ccc(cc1)O 34a_100000185829_100009893438 [0,2,0,0,0,0|1,0,1]=4 8492 B12R1.21 C=C(F)COc1ccc(cc1)Br 34a_100000185759_100009893438 [0,2,0,0,0,0|1,0,1]=4 8493 B12R1.21 C=C(F)COc1ccc(cc1)Br 7a_100000185759_100000042424 [0,2,0,0,0,0|1,0,1]=4 8494 B12R1.21 C=C(F)COc1ccc(cc1)C 34a_100000210336_100009893438 [0,2,0,0,0,0|1,0,1]=4 8495 B12R1.21 C=C(F)COc1ccc(cc1)C 7a_100000210336_100000042424 [0,2,0,0,0,0|1,0,1]=4 8496 B12R1.21 C=C(F)COc1ccc(cc1)Cl 34a_100000210216_100009893438 [0,2,0,0,0,0|1,0,1]=4 8497 B12R1.21 C=C(F)COc1ccc(cc1)Cl 7a_100000210216_100000042424 [0,2,0,0,0,0|1,0,1]=4 8498 B12R1.21 C=C(F)COc1ccc(cc1)F 34a_100000210339_100009893438 [0,2,0,0,0,0|1,0,1]=4 8499 B12R1.21 C=C(F)COc1ccc(cc1)I 34a_100000212066_100009893438 [0,2,0,0,0,0|1,0,1]=4 8500 B12R1.21 C=C(F)COc1ccc(cc1)I 7a_100000212066_100000042424 [0,2,0,0,0,0|1,0,1]=4 8501 B12R1.21 C=C(F)COc1ccc(cc1)N 34a_100000185829_100009893438 [0,2,0,0,0,0|1,0,1]=4 8502 B12R1.21 C=C(F)CSc1ccc(cc1)O 62a_100000042424_100000185759 [0,2,0,0,0,0|0,1,1]=4 8503 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [0,2,0,0,0,0|1,0,1]=4 8504 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [0,2,0,0,0,0|2,0,0]=4 8505 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [0,2,0,0,0,0|2,0,0]=4 8506 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [0,2,0,0,0,0|2,0,0]=4 8507 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [0,2,0,0,0,0|2,0,0]=4 8508 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [0,2,0,0,0,0|2,0,0]=4 8509 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [0,2,0,0,0,0|2,0,0]=4 8510 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [0,2,0,0,0,0|2,0,0]=4 8511 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [0,2,0,0,0,0|2,0,0]=4 8512 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [0,2,0,0,0,0|2,0,0]=4 8513 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [0,2,0,0,0,0|1,0,0]=3 8514 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [0,2,0,0,0,0|1,0,0]=3 8515 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [0,2,0,0,0,0|1,0,0]=3 8516 B12R1.21 CC(=O)COc1ccc(cc1)Br 1458a_100000182358_200000210301 [0,2,0,0,0,0|1,0,0]=3 8517 B12R1.21 CC(=O)COc1ccc(cc1)C 1458a_100000182360_200000210301 [0,2,0,0,0,0|1,0,0]=3 8518 B12R1.21 CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_200000210301 [0,2,0,0,0,0|1,0,0]=3 8519 B12R1.21 CC(=O)COc1ccc(cc1)F 1458a_100000184765_200000210301 [0,2,0,0,0,0|1,0,0]=3 8520 B12R1.21 CC(=O)COc1ccc(cc1)I 1458a_100000184369_200000210301 [0,2,0,0,0,0|1,0,0]=3 8521 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [0,2,0,0,0,0|0,0,0]=2 8522 B12R1.21 CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_200000210301 [0,2,0,0,0,0|1,1,0]=4 8523 B12R1.21 CC(=O)CSc1ccc(cc1)C 1458a_100000179497_200000210301 [0,2,0,0,0,0|1,1,0]=4 8524 B12R1.21 CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200000210301 [0,2,0,0,0,0|1,1,0]=4 8525 B12R1.21 CC(=O)CSc1ccc(cc1)F 1458a_100000691584_200000210301 [0,2,0,0,0,0|1,1,0]=4 8526 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [0,2,0,0,0,0|1,0,1]=4 8527 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [0,2,0,0,0,0|1,0,1]=4 8528 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [0,2,0,0,0,0|1,0,1]=4 8529 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [0,2,0,0,0,0|1,0,1]=4 8530 B12R1.21 CC(C)C=Cc1ccc(cc1)Br 271570a_100016257149_100000752885 [0,2,0,0,0,0|2,0,0]=4 8531 B12R1.21 CC(C)C=Cc1ccc(cc1)Cl 271570a_100016257149_100000755918 [0,2,0,0,0,0|2,0,0]=4 8532 B12R1.21 CC(C)C=Cc1ccc(cc1)F 271570a_100016257149_100000211213 [0,2,0,0,0,0|2,0,0]=4 8533 B12R1.21 CC(C)C=Cc1ccc(cc1)N 271570a_100016257149_100000185761 [0,2,0,0,0,0|2,0,0]=4 8534 B12R1.21 CC(C)C=Cc1ccc(cc1)O 271570a_100016257149_100000185759 [0,2,0,0,0,0|1,0,0]=3 8535 B12R1.21 CC(C)C=Cc1ccc(cn1)O 271570a_100016257149_100000685995 [0,2,0,0,0,0|2,0,0]=4 8536 B12R1.21 CC(C)CNc1ccc(cc1)Br 2230a_100000210018_100000210760 [0,2,0,0,0,0|2,0,0]=4 8537 B12R1.21 CC(C)CNc1ccc(cc1)Br 34a_100000210018_100000210624 [0,2,0,0,0,0|2,0,0]=4 8538 B12R1.21 CC(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000210760 [0,2,0,0,0,0|2,0,0]=4 8539 B12R1.21 CC(C)CNc1ccc(cc1)Cl 34a_100000210052_100000210624 [0,2,0,0,0,0|2,0,0]=4 8540 B12R1.21 CC(C)CNc1ccc(cc1)F 34a_100000185862_100000210624 [0,2,0,0,0,0|2,0,0]=4 8541 B12R1.21 CC(C)CNc1ccc(cc1)I 34a_100000185761_100000210624 [0,2,0,0,0,0|2,0,0]=4 8542 B12R1.21 CC(C)CNc1ccc(cc1)O 271570a_203496583355_200011231703 [0,2,0,0,0,0|1,0,0]=3 8543 B12R1.21 CC(C)CNc1ccc(cc1)O 34a_100000185829_100000210624 [0,2,0,0,0,0|1,0,0]=3 8544 B12R1.21 CC(C)COc1ccc(=O)[nH]c1 34a_100000075641_100000210624 [0,2,0,0,0,0|1,0,1]=4 8545 B12R1.21 CC(C)COc1ccc(cc1)Br 34a_100000185759_100000210624 [0,2,0,0,0,0|1,0,0]=3 8546 B12R1.21 CC(C)COc1ccc(cc1)Br 7a_100000185759_100000210760 [0,2,0,0,0,0|1,0,0]=3 8547 B12R1.21 CC(C)COc1ccc(cc1)Cl 34a_100000210216_100000210624 [0,2,0,0,0,0|1,0,0]=3 8548 B12R1.21 CC(C)COc1ccc(cc1)Cl 7a_100000210216_100000210760 [0,2,0,0,0,0|1,0,0]=3 8549 B12R1.21 CC(C)COc1ccc(cc1)F 34a_100000210339_100000210624 [0,2,0,0,0,0|1,0,0]=3 8550 B12R1.21 CC(C)COc1ccc(cc1)I 34a_100000212066_100000210624 [0,2,0,0,0,0|1,0,0]=3 8551 B12R1.21 CC(C)COc1ccc(cc1)I 7a_100000212066_100000210760 [0,2,0,0,0,0|1,0,0]=3 8552 B12R1.21 CC(C)COc1ccc(cc1)N 34a_100000185829_100000210624 [0,2,0,0,0,0|1,0,0]=3 8553 B12R1.21 CC(C)COc1ccc(cc1)O 271570a_203496583355_200000169949 [0,2,0,0,0,0|0,0,0]=2 8554 B12R1.21 CC(C)COc1ccc(cn1)Cl 34a_100011215309_100000210624 [0,2,0,0,0,0|2,0,0]=4 8555 B12R1.21 CC(C)COc1ccc(cn1)F 34a_100000742473_100000210624 [0,2,0,0,0,0|2,0,0]=4 8556 B12R1.21 CC(C)COc1ccc(cn1)N 34a_100000729260_100000210624 [0,2,0,0,0,0|2,0,0]=4 8557 B12R1.21 CC(C)COc1ccc(nc1)Br 34a_100000685995_100000210624 [0,2,0,0,0,0|2,0,0]=4 8558 B12R1.21 CC(C)COc1ccc(nc1)Br 7a_100000685995_100000210760 [0,2,0,0,0,0|2,0,0]=4 8559 B12R1.21 CC(C)COc1ccc(nc1)Cl 34a_100000744096_100000210624 [0,2,0,0,0,0|2,0,0]=4 8560 B12R1.21 CC(C)COc1ccc(nc1)Cl 7a_100000744096_100000210760 [0,2,0,0,0,0|2,0,0]=4 8561 B12R1.21 CC(C)COc1ccc(nc1)F 34a_100000688820_100000210624 [0,2,0,0,0,0|2,0,0]=4 8562 B12R1.21 CC(C)COc1ccc(nc1)F 7a_100000688820_100000210760 [0,2,0,0,0,0|2,0,0]=4 8563 B12R1.21 CC(C)COc1ccc(nc1)I 34a_100000687607_100000210624 [0,2,0,0,0,0|2,0,0]=4 8564 B12R1.21 CC(C)COc1ccc(nc1)I 7a_100000687607_100000210760 [0,2,0,0,0,0|2,0,0]=4 8565 B12R1.21 CC(C)COc1ccc(nc1)N 34a_100015188713_100000210624 [0,2,0,0,0,0|2,0,0]=4 8566 B12R1.21 CC(C)COc1ccc(nc1)N 7a_100015188713_100000210760 [0,2,0,0,0,0|2,0,0]=4 8567 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000210624_100000752885 [0,2,0,0,0,0|1,1,0]=4 8568 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000752885_100000210760 [0,2,0,0,0,0|1,1,0]=4 8569 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000210624_100000755918 [0,2,0,0,0,0|1,1,0]=4 8570 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000755918_100000210760 [0,2,0,0,0,0|1,1,0]=4 8571 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000210624_100000211213 [0,2,0,0,0,0|1,1,0]=4 8572 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000211213_100000210760 [0,2,0,0,0,0|1,1,0]=4 8573 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000185761_100000210760 [0,2,0,0,0,0|1,1,0]=4 8574 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000210624_100000185761 [0,2,0,0,0,0|1,1,0]=4 8575 B12R1.21 CC(C)CSc1ccc(cc1)O 62a_100000210624_100000185759 [0,2,0,0,0,0|0,1,0]=3 8576 B12R1.21 CC(C)CSc1ccc(cn1)O 62a_100000210624_100000744096 [0,2,0,0,0,0|1,1,0]=4 8577 B12R1.21 CC(C)CSc1ccc(cn1)O 62a_100000685995_100000210760 [0,2,0,0,0,0|1,1,0]=4 8578 B12R1.21 CC(C)NCc1ccc(cc1)Br 207a_100138425928_100000186029 [0,2,0,0,0,0|2,0,0]=4 8579 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100000174875_100000210206 [0,2,0,0,0,0|2,0,0]=4 8580 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100138425928_100011217064 [0,2,0,0,0,0|2,0,0]=4 8581 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100000174875_100000210206 [0,2,0,0,0,0|2,0,0]=4 8582 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100138425928_100000189115 [0,2,0,0,0,0|2,0,0]=4 8583 B12R1.21 CC(C)NCc1ccc(cc1)Cl 207a_100138425928_100000189385 [0,2,0,0,0,0|2,0,0]=4 8584 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100000174871_100000210206 [0,2,0,0,0,0|2,0,0]=4 8585 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100138425928_100000694040 [0,2,0,0,0,0|2,0,0]=4 8586 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100000174871_100000210206 [0,2,0,0,0,0|2,0,0]=4 8587 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100138425928_100000694040 [0,2,0,0,0,0|2,0,0]=4 8588 B12R1.21 CC(C)NCc1ccc(cc1)F 207a_100138425928_100000210084 [0,2,0,0,0,0|2,0,0]=4 8589 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100000174882_100000210206 [0,2,0,0,0,0|2,0,0]=4 8590 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100138425928_100000198546 [0,2,0,0,0,0|2,0,0]=4 8591 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100000174882_100000210206 [0,2,0,0,0,0|2,0,0]=4 8592 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100138425928_100000198546 [0,2,0,0,0,0|2,0,0]=4 8593 B12R1.21 CC(C)NCc1ccc(cc1)I 207a_100138425928_100000188517 [0,2,0,0,0,0|2,0,0]=4 8594 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100016989417_100000210206 [0,2,0,0,0,0|2,0,0]=4 8595 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100138425928_100000189116 [0,2,0,0,0,0|2,0,0]=4 8596 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100016989417_100000210206 [0,2,0,0,0,0|2,0,0]=4 8597 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100138425928_100000189116 [0,2,0,0,0,0|2,0,0]=4 8598 B12R1.21 CC(C)NCc1ccc(cc1)O 271570a_203496583355_100000195760 [0,2,0,0,0,0|1,0,0]=3 8599 B12R1.21 CC(C)NCc1ccc(cc1)O 34a_100000185549_100000210206 [0,2,0,0,0,0|1,0,0]=3 8600 B12R1.21 CC(C)NCc1ccc(nc1)O 207a_100138425928_100011361521 [0,2,0,0,0,0|2,0,0]=4 8601 B12R1.21 CC(C)NCc1ccc(nc1)O 2230a_100000757128_100000210206 [0,2,0,0,0,0|2,0,0]=4 8602 B12R1.21 CC(C)NCc1ccc(nc1)O 271570a_203496583355_100016992178 [0,2,0,0,0,0|2,0,0]=4 8603 B12R1.21 CC(C)OCc1cc[n+](cc1)C 34a_100009831711_100000210206 [0,2,0,0,0,0|2,0,0]=4 8604 B12R1.21 CC(C)OCc1cc[n+](cc1)[O-] 34a_100000031831_100000210206 [0,2,0,0,0,0|1,0,1]=4 8605 B12R1.21 CC(C)OCc1cc[n+](cc1)[O-] 7a_100000031831_100000210206 [0,2,0,0,0,0|1,0,1]=4 8606 B12R1.21 CC(C)OCc1ccc(=O)[nH]c1 34a_100011999846_100000210206 [0,2,0,0,0,0|1,0,1]=4 8607 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000212225_100000189115 [0,2,0,0,0,0|1,0,0]=3 8608 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000695286_100000210206 [0,2,0,0,0,0|1,0,0]=3 8609 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000211118_100000210206 [0,2,0,0,0,0|1,0,0]=3 8610 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000212225_100000694040 [0,2,0,0,0,0|1,0,0]=3 8611 B12R1.21 CC(C)OCc1ccc(cc1)Cl 7a_100000211118_100000210206 [0,2,0,0,0,0|1,0,0]=3 8612 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000210977_100000210206 [0,2,0,0,0,0|1,0,0]=3 8613 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000212225_100000198546 [0,2,0,0,0,0|1,0,0]=3 8614 B12R1.21 CC(C)OCc1ccc(cc1)F 7a_100000210977_100000210206 [0,2,0,0,0,0|1,0,0]=3 8615 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000212225_100000189116 [0,2,0,0,0,0|1,0,0]=3 8616 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000690907_100000210206 [0,2,0,0,0,0|1,0,0]=3 8617 B12R1.21 CC(C)OCc1ccc(cc1)I 7a_100000690907_100000210206 [0,2,0,0,0,0|1,0,0]=3 8618 B12R1.21 CC(C)OCc1ccc(cc1)N 34a_100011215238_100000210206 [0,2,0,0,0,0|1,0,0]=3 8619 B12R1.21 CC(C)OCc1ccc(cc1)O 271570a_203496583355_100000758563 [0,2,0,0,0,0|0,0,0]=2 8620 B12R1.21 CC(C)OCc1ccc(cn1)Br 34a_100000212225_100000702658 [0,2,0,0,0,0|2,0,0]=4 8621 B12R1.21 CC(C)OCc1ccc(cn1)Br 34a_100000754261_100000210206 [0,2,0,0,0,0|2,0,0]=4 8622 B12R1.21 CC(C)OCc1ccc(cn1)Cl 34a_100000212225_100012066911 [0,2,0,0,0,0|2,0,0]=4 8623 B12R1.21 CC(C)OCc1ccc(cn1)Cl 34a_100000703999_100000210206 [0,2,0,0,0,0|2,0,0]=4 8624 B12R1.21 CC(C)OCc1ccc(cn1)F 34a_100000212225_100000703193 [0,2,0,0,0,0|2,0,0]=4 8625 B12R1.21 CC(C)OCc1ccc(cn1)F 34a_100011999454_100000210206 [0,2,0,0,0,0|2,0,0]=4 8626 B12R1.21 CC(C)OCc1ccc(cn1)N 34a_100011998161_100000210206 [0,2,0,0,0,0|2,0,0]=4 8627 B12R1.21 CC(C)OCc1ccc(nc1)Br 34a_100000212225_100009831999 [0,2,0,0,0,0|2,0,0]=4 8628 B12R1.21 CC(C)OCc1ccc(nc1)Br 34a_100009816760_100000210206 [0,2,0,0,0,0|2,0,0]=4 8629 B12R1.21 CC(C)OCc1ccc(nc1)Br 7a_100009816760_100000210206 [0,2,0,0,0,0|2,0,0]=4 8630 B12R1.21 CC(C)OCc1ccc(nc1)Cl 34a_100000212225_100000735431 [0,2,0,0,0,0|2,0,0]=4 8631 B12R1.21 CC(C)OCc1ccc(nc1)Cl 34a_100000755211_100000210206 [0,2,0,0,0,0|2,0,0]=4 8632 B12R1.21 CC(C)OCc1ccc(nc1)Cl 7a_100000755211_100000210206 [0,2,0,0,0,0|2,0,0]=4 8633 B12R1.21 CC(C)OCc1ccc(nc1)F 34a_100000079959_100000210206 [0,2,0,0,0,0|2,0,0]=4 8634 B12R1.21 CC(C)OCc1ccc(nc1)F 34a_100000212225_100000099788 [0,2,0,0,0,0|2,0,0]=4 8635 B12R1.21 CC(C)OCc1ccc(nc1)N 34a_100000704267_100000210206 [0,2,0,0,0,0|2,0,0]=4 8636 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000189115_100000210206 [0,2,0,0,0,0|1,1,0]=4 8637 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000210206_100000189115 [0,2,0,0,0,0|1,1,0]=4 8638 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000187161_100000210206 [0,2,0,0,0,0|1,1,0]=4 8639 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000210206_100000187161 [0,2,0,0,0,0|1,1,0]=4 8640 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000198546_100000210206 [0,2,0,0,0,0|1,1,0]=4 8641 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000210206_100000187164 [0,2,0,0,0,0|1,1,0]=4 8642 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000189116_100000210206 [0,2,0,0,0,0|1,1,0]=4 8643 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000210206_100000189116 [0,2,0,0,0,0|1,1,0]=4 8644 B12R1.21 CC(C)SCc1ccc(cc1)O 271570a_203496583355_100000173087 [0,2,0,0,0,0|0,1,0]=3 8645 B12R1.21 CC(O)C=Cc1ccc(cc1)Br 271570a_200011019289_100000752885 [0,2,0,0,0,0|2,0,0]=4 8646 B12R1.21 CC(O)C=Cc1ccc(cc1)Cl 271570a_200011019289_100000755918 [0,2,0,0,0,0|2,0,0]=4 8647 B12R1.21 CC(O)C=Cc1ccc(cc1)F 271570a_200011019289_100000211213 [0,2,0,0,0,0|2,0,0]=4 8648 B12R1.21 CC(O)C=Cc1ccc(cc1)N 271570a_200011019289_100000185761 [0,2,0,0,0,0|2,0,0]=4 8649 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [0,2,0,0,0,0|1,0,0]=3 8650 B12R1.21 CC(O)C=Cc1ccc(cn1)O 271570a_200011019289_100000685995 [0,2,0,0,0,0|2,0,0]=4 8651 B12R1.21 CC(O)CNc1ccc(cc1)Br 2230a_100000210018_100011218427 [0,2,0,0,0,0|2,0,0]=4 8652 B12R1.21 CC(O)CNc1ccc(cc1)Br 34a_100000210018_100011218427 [0,2,0,0,0,0|2,0,0]=4 8653 B12R1.21 CC(O)CNc1ccc(cc1)Cl 2230a_100000210052_100011218427 [0,2,0,0,0,0|2,0,0]=4 8654 B12R1.21 CC(O)CNc1ccc(cc1)Cl 34a_100000210052_100011218427 [0,2,0,0,0,0|2,0,0]=4 8655 B12R1.21 CC(O)CNc1ccc(cc1)F 34a_100000185862_100011218427 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.21 CC(O)CNc1ccc(cc1)I 34a_100000185761_100011218427 [0,2,0,0,0,0|2,0,0]=4 8657 B12R1.21 CC(O)CNc1ccc(cc1)O 34a_100000185829_100011218427 [0,2,0,0,0,0|1,0,0]=3 8658 B12R1.21 CC(O)COc1ccc(=O)[nH]c1 34a_100000075641_100011218427 [0,2,0,0,0,0|1,0,1]=4 8659 B12R1.21 CC(O)COc1ccc(cc1)Br 34a_100000185759_100011218427 [0,2,0,0,0,0|1,0,0]=3 8660 B12R1.21 CC(O)COc1ccc(cc1)Br 7a_100000185759_100011218427 [0,2,0,0,0,0|1,0,0]=3 8661 B12R1.21 CC(O)COc1ccc(cc1)Cl 34a_100000210216_100011218427 [0,2,0,0,0,0|1,0,0]=3 8662 B12R1.21 CC(O)COc1ccc(cc1)Cl 7a_100000210216_100011218427 [0,2,0,0,0,0|1,0,0]=3 8663 B12R1.21 CC(O)COc1ccc(cc1)F 34a_100000210339_100011218427 [0,2,0,0,0,0|1,0,0]=3 8664 B12R1.21 CC(O)COc1ccc(cc1)I 34a_100000212066_100011218427 [0,2,0,0,0,0|1,0,0]=3 8665 B12R1.21 CC(O)COc1ccc(cc1)I 7a_100000212066_100011218427 [0,2,0,0,0,0|1,0,0]=3 8666 B12R1.21 CC(O)COc1ccc(cc1)N 34a_100000185829_100011218427 [0,2,0,0,0,0|1,0,0]=3 8667 B12R1.21 CC(O)COc1ccc(cn1)Cl 34a_100011215309_100011218427 [0,2,0,0,0,0|2,0,0]=4 8668 B12R1.21 CC(O)COc1ccc(cn1)F 34a_100000742473_100011218427 [0,2,0,0,0,0|2,0,0]=4 8669 B12R1.21 CC(O)COc1ccc(cn1)N 34a_100000729260_100011218427 [0,2,0,0,0,0|2,0,0]=4 8670 B12R1.21 CC(O)COc1ccc(nc1)Br 34a_100000685995_100011218427 [0,2,0,0,0,0|2,0,0]=4 8671 B12R1.21 CC(O)COc1ccc(nc1)Br 7a_100000685995_100011218427 [0,2,0,0,0,0|2,0,0]=4 8672 B12R1.21 CC(O)COc1ccc(nc1)Cl 34a_100000744096_100011218427 [0,2,0,0,0,0|2,0,0]=4 8673 B12R1.21 CC(O)COc1ccc(nc1)Cl 7a_100000744096_100011218427 [0,2,0,0,0,0|2,0,0]=4 8674 B12R1.21 CC(O)COc1ccc(nc1)F 34a_100000688820_100011218427 [0,2,0,0,0,0|2,0,0]=4 8675 B12R1.21 CC(O)COc1ccc(nc1)F 7a_100000688820_100011218427 [0,2,0,0,0,0|2,0,0]=4 8676 B12R1.21 CC(O)COc1ccc(nc1)I 34a_100000687607_100011218427 [0,2,0,0,0,0|2,0,0]=4 8677 B12R1.21 CC(O)COc1ccc(nc1)I 7a_100000687607_100011218427 [0,2,0,0,0,0|2,0,0]=4 8678 B12R1.21 CC(O)COc1ccc(nc1)N 34a_100015188713_100011218427 [0,2,0,0,0,0|2,0,0]=4 8679 B12R1.21 CC(O)COc1ccc(nc1)N 7a_100015188713_100011218427 [0,2,0,0,0,0|2,0,0]=4 8680 B12R1.21 CC(O)CSc1ccc(cc1)Br 62a_100000752885_100011218427 [0,2,0,0,0,0|1,1,0]=4 8681 B12R1.21 CC(O)CSc1ccc(cc1)Br 62a_100011218427_100000752885 [0,2,0,0,0,0|1,1,0]=4 8682 B12R1.21 CC(O)CSc1ccc(cc1)Cl 62a_100000755918_100011218427 [0,2,0,0,0,0|1,1,0]=4 8683 B12R1.21 CC(O)CSc1ccc(cc1)Cl 62a_100011218427_100000755918 [0,2,0,0,0,0|1,1,0]=4 8684 B12R1.21 CC(O)CSc1ccc(cc1)F 62a_100000211213_100011218427 [0,2,0,0,0,0|1,1,0]=4 8685 B12R1.21 CC(O)CSc1ccc(cc1)F 62a_100011218427_100000211213 [0,2,0,0,0,0|1,1,0]=4 8686 B12R1.21 CC(O)CSc1ccc(cc1)N 62a_100000185761_100011218427 [0,2,0,0,0,0|1,1,0]=4 8687 B12R1.21 CC(O)CSc1ccc(cc1)N 62a_100011218427_100000185761 [0,2,0,0,0,0|1,1,0]=4 8688 B12R1.21 CC(O)CSc1ccc(cc1)O 62a_100011218427_100000185759 [0,2,0,0,0,0|0,1,0]=3 8689 B12R1.21 CC(O)CSc1ccc(cn1)O 62a_100000685995_100011218427 [0,2,0,0,0,0|1,1,0]=4 8690 B12R1.21 CC(O)CSc1ccc(cn1)O 62a_100011218427_100000744096 [0,2,0,0,0,0|1,1,0]=4 8691 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100000752880_200000210301 [0,2,0,0,0,0|2,0,0]=4 8692 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100102631434_100011740612 [0,2,0,0,0,0|2,0,0]=4 8693 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100000752880_200000210301 [0,2,0,0,0,0|2,0,0]=4 8694 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100102631434_100011740612 [0,2,0,0,0,0|2,0,0]=4 8695 B12R1.21 CN(C)CCc1ccc(cc1)Br 34a_100000752880_200000210301 [0,2,0,0,0,0|2,0,0]=4 8696 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100000698262_200000210301 [0,2,0,0,0,0|2,0,0]=4 8697 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100102631434_100011713675 [0,2,0,0,0,0|2,0,0]=4 8698 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100000698262_200000210301 [0,2,0,0,0,0|2,0,0]=4 8699 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100102631434_100011713675 [0,2,0,0,0,0|2,0,0]=4 8700 B12R1.21 CN(C)CCc1ccc(cc1)Cl 34a_100000698262_200000210301 [0,2,0,0,0,0|2,0,0]=4 8701 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102631434_100011217392 [0,2,0,0,0,0|2,0,0]=4 8702 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102946585_200000210301 [0,2,0,0,0,0|2,0,0]=4 8703 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102631434_100011217392 [0,2,0,0,0,0|2,0,0]=4 8704 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102946585_200000210301 [0,2,0,0,0,0|2,0,0]=4 8705 B12R1.21 CN(C)CCc1ccc(cc1)F 34a_100102946585_200000210301 [0,2,0,0,0,0|2,0,0]=4 8706 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [0,2,0,0,0,0|1,0,0]=3 8707 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [0,2,0,0,0,0|1,0,0]=3 8708 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [0,2,0,0,0,0|1,0,0]=3 8709 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [0,2,0,0,0,0|1,0,0]=3 8710 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [0,2,0,0,0,0|1,0,0]=3 8711 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 2230a_100000752880_200025704644 [0,2,0,0,0,0|2,0,0]=4 8712 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 269982a_100000752880_200025704644 [0,2,0,0,0,0|2,0,0]=4 8713 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 34a_100000752880_200025704644 [0,2,0,0,0,0|2,0,0]=4 8714 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 2230a_100000698262_200025704644 [0,2,0,0,0,0|2,0,0]=4 8715 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 269982a_100000698262_200025704644 [0,2,0,0,0,0|2,0,0]=4 8716 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 34a_100000698262_200025704644 [0,2,0,0,0,0|2,0,0]=4 8717 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 2230a_100102946585_200025704644 [0,2,0,0,0,0|2,0,0]=4 8718 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 269982a_100102946585_200025704644 [0,2,0,0,0,0|2,0,0]=4 8719 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 34a_100102946585_200025704644 [0,2,0,0,0,0|2,0,0]=4 8720 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [0,2,0,0,0,0|1,0,0]=3 8721 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [0,2,0,0,0,0|1,0,0]=3 8722 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [0,2,0,0,0,0|1,0,0]=3 8723 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2230a_100000210018_100009817552 [0,2,0,0,0,0|2,0,0]=4 8724 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 34a_100000210018_100009817552 [0,2,0,0,0,0|2,0,0]=4 8725 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Cl 2230a_100000210052_100009817552 [0,2,0,0,0,0|2,0,0]=4 8726 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Cl 34a_100000210052_100009817552 [0,2,0,0,0,0|2,0,0]=4 8727 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F 34a_100000185862_100009817552 [0,2,0,0,0,0|2,0,0]=4 8728 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I 34a_100000185761_100009817552 [0,2,0,0,0,0|2,0,0]=4 8729 B12R1.21 C[C@@H](O)CNc1ccc(cc1)O 34a_100000185829_100009817552 [0,2,0,0,0,0|1,0,0]=3 8730 B12R1.21 C[C@@H](O)COc1ccc(=O)[nH]c1 34a_100000075641_100009817552 [0,2,0,0,0,0|1,0,1]=4 8731 B12R1.21 C[C@@H](O)COc1ccc(cc1)Br 34a_100000185759_100009817552 [0,2,0,0,0,0|1,0,0]=3 8732 B12R1.21 C[C@@H](O)COc1ccc(cc1)Br 7a_100000185759_100009817552 [0,2,0,0,0,0|1,0,0]=3 8733 B12R1.21 C[C@@H](O)COc1ccc(cc1)Cl 34a_100000210216_100009817552 [0,2,0,0,0,0|1,0,0]=3 8734 B12R1.21 C[C@@H](O)COc1ccc(cc1)Cl 7a_100000210216_100009817552 [0,2,0,0,0,0|1,0,0]=3 8735 B12R1.21 C[C@@H](O)COc1ccc(cc1)F 34a_100000210339_100009817552 [0,2,0,0,0,0|1,0,0]=3 8736 B12R1.21 C[C@@H](O)COc1ccc(cc1)I 34a_100000212066_100009817552 [0,2,0,0,0,0|1,0,0]=3 8737 B12R1.21 C[C@@H](O)COc1ccc(cc1)I 7a_100000212066_100009817552 [0,2,0,0,0,0|1,0,0]=3 8738 B12R1.21 C[C@@H](O)COc1ccc(cc1)N 34a_100000185829_100009817552 [0,2,0,0,0,0|1,0,0]=3 8739 B12R1.21 C[C@@H](O)COc1ccc(cn1)Cl 34a_100011215309_100009817552 [0,2,0,0,0,0|2,0,0]=4 8740 B12R1.21 C[C@@H](O)COc1ccc(cn1)F 34a_100000742473_100009817552 [0,2,0,0,0,0|2,0,0]=4 8741 B12R1.21 C[C@@H](O)COc1ccc(cn1)N 34a_100000729260_100009817552 [0,2,0,0,0,0|2,0,0]=4 8742 B12R1.21 C[C@@H](O)COc1ccc(nc1)Br 34a_100000685995_100009817552 [0,2,0,0,0,0|2,0,0]=4 8743 B12R1.21 C[C@@H](O)COc1ccc(nc1)Br 7a_100000685995_100009817552 [0,2,0,0,0,0|2,0,0]=4 8744 B12R1.21 C[C@@H](O)COc1ccc(nc1)Cl 34a_100000744096_100009817552 [0,2,0,0,0,0|2,0,0]=4 8745 B12R1.21 C[C@@H](O)COc1ccc(nc1)Cl 7a_100000744096_100009817552 [0,2,0,0,0,0|2,0,0]=4 8746 B12R1.21 C[C@@H](O)COc1ccc(nc1)F 34a_100000688820_100009817552 [0,2,0,0,0,0|2,0,0]=4 8747 B12R1.21 C[C@@H](O)COc1ccc(nc1)F 7a_100000688820_100009817552 [0,2,0,0,0,0|2,0,0]=4 8748 B12R1.21 C[C@@H](O)COc1ccc(nc1)I 34a_100000687607_100009817552 [0,2,0,0,0,0|2,0,0]=4 8749 B12R1.21 C[C@@H](O)COc1ccc(nc1)I 7a_100000687607_100009817552 [0,2,0,0,0,0|2,0,0]=4 8750 B12R1.21 C[C@@H](O)COc1ccc(nc1)N 34a_100015188713_100009817552 [0,2,0,0,0,0|2,0,0]=4 8751 B12R1.21 C[C@@H](O)COc1ccc(nc1)N 7a_100015188713_100009817552 [0,2,0,0,0,0|2,0,0]=4 8752 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Br 62a_100000752885_100009817552 [0,2,0,0,0,0|1,1,0]=4 8753 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Br 62a_100009817552_100000752885 [0,2,0,0,0,0|1,1,0]=4 8754 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Cl 62a_100000755918_100009817552 [0,2,0,0,0,0|1,1,0]=4 8755 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Cl 62a_100009817552_100000755918 [0,2,0,0,0,0|1,1,0]=4 8756 B12R1.21 C[C@@H](O)CSc1ccc(cc1)F 62a_100000211213_100009817552 [0,2,0,0,0,0|1,1,0]=4 8757 B12R1.21 C[C@@H](O)CSc1ccc(cc1)F 62a_100009817552_100000211213 [0,2,0,0,0,0|1,1,0]=4 8758 B12R1.21 C[C@@H](O)CSc1ccc(cc1)N 62a_100000185761_100009817552 [0,2,0,0,0,0|1,1,0]=4 8759 B12R1.21 C[C@@H](O)CSc1ccc(cc1)N 62a_100009817552_100000185761 [0,2,0,0,0,0|1,1,0]=4 8760 B12R1.21 C[C@@H](O)CSc1ccc(cc1)O 62a_100009817552_100000185759 [0,2,0,0,0,0|0,1,0]=3 8761 B12R1.21 C[C@@H](O)CSc1ccc(cn1)O 62a_100000685995_100009817552 [0,2,0,0,0,0|1,1,0]=4 8762 B12R1.21 C[C@@H](O)CSc1ccc(cn1)O 62a_100009817552_100000744096 [0,2,0,0,0,0|1,1,0]=4 8763 B12R1.21 Cc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000186775 [0,2,0,0,0,0|2,0,0]=4 8764 B12R1.21 Cc1ccc(cc1)C=CC(C)O 271570a_200011019289_100000186775 [0,2,0,0,0,0|2,0,0]=4 8765 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [0,2,0,0,0,0|2,0,0]=4 8766 B12R1.21 Cc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713686 [0,2,0,0,0,0|2,0,0]=4 8767 B12R1.21 Cc1ccc(cc1)CCN(C)C 269982a_100102631434_100011713686 [0,2,0,0,0,0|2,0,0]=4 8768 B12R1.21 Cc1ccc(cc1)CNC(C)C 207a_100138425928_100000211033 [0,2,0,0,0,0|2,0,0]=4 8769 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100000174908_100000210206 [0,2,0,0,0,0|2,0,0]=4 8770 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100138425928_100000210814 [0,2,0,0,0,0|2,0,0]=4 8771 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100000174908_100000210206 [0,2,0,0,0,0|2,0,0]=4 8772 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100138425928_100000210814 [0,2,0,0,0,0|2,0,0]=4 8773 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100000212225_100000210814 [0,2,0,0,0,0|1,0,0]=3 8774 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100011215236_100000210206 [0,2,0,0,0,0|1,0,0]=3 8775 B12R1.21 Cc1ccc(cc1)COC(C)C 7a_100011215236_100000210206 [0,2,0,0,0,0|1,0,0]=3 8776 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210206_100000210814 [0,2,0,0,0,0|1,1,0]=4 8777 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210814_100000210206 [0,2,0,0,0,0|1,1,0]=4 8778 B12R1.21 Cc1ccc(cc1)NCC(C)C 34a_100000124888_100000210624 [0,2,0,0,0,0|2,0,0]=4 8779 B12R1.21 Cc1ccc(cc1)NCC(C)O 34a_100000124888_100011218427 [0,2,0,0,0,0|2,0,0]=4 8780 B12R1.21 Cc1ccc(cc1)NCC(F)F 34a_100000124888_100011934356 [0,2,0,0,0,0|2,0,0]=4 8781 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O 34a_100000124888_100009817552 [0,2,0,0,0,0|2,0,0]=4 8782 B12R1.21 Cc1ccc(cc1)OCC(=O)N 34a_100000210336_100000187820 [0,2,0,0,0,0|1,0,1]=4 8783 B12R1.21 Cc1ccc(cc1)OCC(=O)N 7a_100000210336_100000187820 [0,2,0,0,0,0|1,0,1]=4 8784 B12R1.21 Cc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182360_200025704644 [0,2,0,0,0,0|1,0,0]=3 8785 B12R1.21 Cc1ccc(cc1)OCC(=O)[O-] 34a_100000210336_100020667443 [0,2,0,0,0,0|1,0,1]=4 8786 B12R1.21 Cc1ccc(cc1)OCC(C)C 34a_100000210336_100000210624 [0,2,0,0,0,0|1,0,0]=3 8787 B12R1.21 Cc1ccc(cc1)OCC(C)C 7a_100000210336_100000210760 [0,2,0,0,0,0|1,0,0]=3 8788 B12R1.21 Cc1ccc(cc1)OCC(C)O 34a_100000210336_100011218427 [0,2,0,0,0,0|1,0,0]=3 8789 B12R1.21 Cc1ccc(cc1)OCC(C)O 7a_100000210336_100011218427 [0,2,0,0,0,0|1,0,0]=3 8790 B12R1.21 Cc1ccc(cc1)OCC(F)F 34a_100000210336_100011934356 [0,2,0,0,0,0|1,0,0]=3 8791 B12R1.21 Cc1ccc(cc1)OCC(F)F 7a_100000210336_100011934356 [0,2,0,0,0,0|1,0,0]=3 8792 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 34a_100000210336_100009817552 [0,2,0,0,0,0|1,0,0]=3 8793 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 7a_100000210336_100009817552 [0,2,0,0,0,0|1,0,0]=3 8794 B12R1.21 Cc1ccc(cc1)OC[N+](=O)[O-] 34a_100000210336_100000761209 [0,2,0,0,0,0|2,0,0]=4 8795 B12R1.21 Cc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000179497_200025704644 [0,2,0,0,0,0|1,1,0]=4 8796 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000186775_100000210760 [0,2,0,0,0,0|1,1,0]=4 8797 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000186775 [0,2,0,0,0,0|1,1,0]=4 8798 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100000186775_100011218427 [0,2,0,0,0,0|1,1,0]=4 8799 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100011218427_100000186775 [0,2,0,0,0,0|1,1,0]=4 8800 B12R1.21 Cc1ccc(cc1)SCC(F)F 62a_100000186775_100011934356 [0,2,0,0,0,0|1,1,0]=4 8801 B12R1.21 Cc1ccc(cc1)SCC(F)F 62a_100011934356_100000186775 [0,2,0,0,0,0|1,1,0]=4 8802 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100000186775_100009817552 [0,2,0,0,0,0|1,1,0]=4 8803 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000186775 [0,2,0,0,0,0|1,1,0]=4 8804 B12R1.21 Cc1ccc(cn1)COC(C)C 34a_100000212225_100016987292 [0,2,0,0,0,0|2,0,0]=4 8805 B12R1.21 Cc1ccc(cn1)COC(C)C 34a_100011248133_100000210206 [0,2,0,0,0,0|2,0,0]=4 8806 B12R1.21 Cc1ccc(cn1)OCC(C)C 34a_100000745506_100000210624 [0,2,0,0,0,0|2,0,0]=4 8807 B12R1.21 Cc1ccc(cn1)OCC(C)C 7a_100000745506_100000210760 [0,2,0,0,0,0|2,0,0]=4 8808 B12R1.21 Cc1ccc(cn1)OCC(C)O 34a_100000745506_100011218427 [0,2,0,0,0,0|2,0,0]=4 8809 B12R1.21 Cc1ccc(cn1)OCC(C)O 7a_100000745506_100011218427 [0,2,0,0,0,0|2,0,0]=4 8810 B12R1.21 Cc1ccc(cn1)OCC(F)F 34a_100000745506_100011934356 [0,2,0,0,0,0|2,0,0]=4 8811 B12R1.21 Cc1ccc(cn1)OCC(F)F 7a_100000745506_100011934356 [0,2,0,0,0,0|2,0,0]=4 8812 B12R1.21 Cc1ccc(cn1)OC[C@@H](C)O 34a_100000745506_100009817552 [0,2,0,0,0,0|2,0,0]=4 8813 B12R1.21 Cc1ccc(cn1)OC[C@@H](C)O 7a_100000745506_100009817552 [0,2,0,0,0,0|2,0,0]=4 8814 B12R1.21 Cc1ccc(nc1)COC(C)C 34a_100000212225_100000691093 [0,2,0,0,0,0|2,0,0]=4 8815 B12R1.21 Cc1ccc(nc1)COC(C)C 34a_100012001401_100000210206 [0,2,0,0,0,0|2,0,0]=4 8816 B12R1.21 Cc1ccc(nc1)OCC(C)C 34a_100000759353_100000210624 [0,2,0,0,0,0|2,0,0]=4 8817 B12R1.21 Cc1ccc(nc1)OCC(C)O 34a_100000759353_100011218427 [0,2,0,0,0,0|2,0,0]=4 8818 B12R1.21 Cc1ccc(nc1)OCC(F)F 34a_100000759353_100011934356 [0,2,0,0,0,0|2,0,0]=4 8819 B12R1.21 Cc1ccc(nc1)OC[C@@H](C)O 34a_100000759353_100009817552 [0,2,0,0,0,0|2,0,0]=4 8820 B12R1.21 FC(F)CNc1ccc(cc1)Br 2230a_100000210018_100011934356 [0,2,0,0,0,0|2,0,0]=4 8821 B12R1.21 FC(F)CNc1ccc(cc1)Br 34a_100000210018_100011934356 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.21 FC(F)CNc1ccc(cc1)Cl 2230a_100000210052_100011934356 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.21 FC(F)CNc1ccc(cc1)Cl 34a_100000210052_100011934356 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.21 FC(F)CNc1ccc(cc1)I 34a_100000185761_100011934356 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.21 FC(F)COc1ccc(cc1)Br 34a_100000185759_100011934356 [0,2,0,0,0,0|1,0,0]=3 8826 B12R1.21 FC(F)COc1ccc(cc1)Br 7a_100000185759_100011934356 [0,2,0,0,0,0|1,0,0]=3 8827 B12R1.21 FC(F)COc1ccc(cc1)Cl 34a_100000210216_100011934356 [0,2,0,0,0,0|1,0,0]=3 8828 B12R1.21 FC(F)COc1ccc(cc1)Cl 7a_100000210216_100011934356 [0,2,0,0,0,0|1,0,0]=3 8829 B12R1.21 FC(F)COc1ccc(cc1)I 34a_100000212066_100011934356 [0,2,0,0,0,0|1,0,0]=3 8830 B12R1.21 FC(F)COc1ccc(cc1)I 7a_100000212066_100011934356 [0,2,0,0,0,0|1,0,0]=3 8831 B12R1.21 FC(F)COc1ccc(cn1)Cl 34a_100011215309_100011934356 [0,2,0,0,0,0|2,0,0]=4 8832 B12R1.21 FC(F)COc1ccc(nc1)Br 34a_100000685995_100011934356 [0,2,0,0,0,0|2,0,0]=4 8833 B12R1.21 FC(F)COc1ccc(nc1)Br 7a_100000685995_100011934356 [0,2,0,0,0,0|2,0,0]=4 8834 B12R1.21 FC(F)COc1ccc(nc1)Cl 34a_100000744096_100011934356 [0,2,0,0,0,0|2,0,0]=4 8835 B12R1.21 FC(F)COc1ccc(nc1)Cl 7a_100000744096_100011934356 [0,2,0,0,0,0|2,0,0]=4 8836 B12R1.21 FC(F)COc1ccc(nc1)I 34a_100000687607_100011934356 [0,2,0,0,0,0|2,0,0]=4 8837 B12R1.21 FC(F)COc1ccc(nc1)I 7a_100000687607_100011934356 [0,2,0,0,0,0|2,0,0]=4 8838 B12R1.21 FC(F)CSc1ccc(cc1)Br 62a_100000752885_100011934356 [0,2,0,0,0,0|1,1,0]=4 8839 B12R1.21 FC(F)CSc1ccc(cc1)Br 62a_100011934356_100000752885 [0,2,0,0,0,0|1,1,0]=4 8840 B12R1.21 FC(F)CSc1ccc(cc1)Cl 62a_100000755918_100011934356 [0,2,0,0,0,0|1,1,0]=4 8841 B12R1.21 FC(F)CSc1ccc(cc1)Cl 62a_100011934356_100000755918 [0,2,0,0,0,0|1,1,0]=4 8842 B12R1.21 Fc1ccc(cc1)NCC(F)F 34a_100000185862_100011934356 [0,2,0,0,0,0|2,0,0]=4 8843 B12R1.21 Fc1ccc(cc1)OCC(F)F 34a_100000210339_100011934356 [0,2,0,0,0,0|1,0,0]=3 8844 B12R1.21 Fc1ccc(cc1)SCC(F)F 62a_100000211213_100011934356 [0,2,0,0,0,0|1,1,0]=4 8845 B12R1.21 Fc1ccc(cc1)SCC(F)F 62a_100011934356_100000211213 [0,2,0,0,0,0|1,1,0]=4 8846 B12R1.21 Fc1ccc(cn1)OCC(F)F 34a_100000688820_100011934356 [0,2,0,0,0,0|2,0,0]=4 8847 B12R1.21 Fc1ccc(cn1)OCC(F)F 7a_100000688820_100011934356 [0,2,0,0,0,0|2,0,0]=4 8848 B12R1.21 Fc1ccc(nc1)OCC(F)F 34a_100000742473_100011934356 [0,2,0,0,0,0|2,0,0]=4 8849 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [0,2,0,0,0,0|1,0,1]=4 8850 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [0,2,0,0,0,0|1,0,1]=4 8851 B12R1.21 NC(=O)COc1ccc(cc1)Br 34a_100000185759_100000187820 [0,2,0,0,0,0|1,0,1]=4 8852 B12R1.21 NC(=O)COc1ccc(cc1)Br 7a_100000185759_100000187820 [0,2,0,0,0,0|1,0,1]=4 8853 B12R1.21 NC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000187820 [0,2,0,0,0,0|1,0,1]=4 8854 B12R1.21 NC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000187820 [0,2,0,0,0,0|1,0,1]=4 8855 B12R1.21 NC(=O)COc1ccc(cc1)F 34a_100000210339_100000187820 [0,2,0,0,0,0|1,0,1]=4 8856 B12R1.21 NC(=O)COc1ccc(cc1)I 34a_100000212066_100000187820 [0,2,0,0,0,0|1,0,1]=4 8857 B12R1.21 NC(=O)COc1ccc(cc1)I 7a_100000212066_100000187820 [0,2,0,0,0,0|1,0,1]=4 8858 B12R1.21 NC(=O)COc1ccc(cc1)N 34a_100000185829_100000187820 [0,2,0,0,0,0|1,0,1]=4 8859 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [0,2,0,0,0,0|0,1,1]=4 8860 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [0,2,0,0,0,0|0,1,1]=4 8861 B12R1.21 Nc1ccc(cc1)OCC(=O)[O-] 34a_100000185829_100020667443 [0,2,0,0,0,0|1,0,1]=4 8862 B12R1.21 Nc1ccc(cc1)OCC(F)F 34a_100000185829_100011934356 [0,2,0,0,0,0|1,0,0]=3 8863 B12R1.21 Nc1ccc(cc1)OC[N+](=O)[O-] 34a_100000185829_100000761209 [0,2,0,0,0,0|2,0,0]=4 8864 B12R1.21 Nc1ccc(cc1)SCC(F)F 62a_100000185761_100011934356 [0,2,0,0,0,0|1,1,0]=4 8865 B12R1.21 Nc1ccc(cc1)SCC(F)F 62a_100011934356_100000185761 [0,2,0,0,0,0|1,1,0]=4 8866 B12R1.21 Nc1ccc(cn1)OCC(F)F 34a_100015188713_100011934356 [0,2,0,0,0,0|2,0,0]=4 8867 B12R1.21 Nc1ccc(cn1)OCC(F)F 7a_100015188713_100011934356 [0,2,0,0,0,0|2,0,0]=4 8868 B12R1.21 Nc1ccc(nc1)OCC(F)F 34a_100000729260_100011934356 [0,2,0,0,0,0|2,0,0]=4 8869 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [0,2,0,0,0,0|1,0,1]=4 8870 B12R1.21 O=C([O-])COc1ccc(cc1)Br 34a_100000185759_100020667443 [0,2,0,0,0,0|1,0,1]=4 8871 B12R1.21 O=C([O-])COc1ccc(cc1)Cl 34a_100000210216_100020667443 [0,2,0,0,0,0|1,0,1]=4 8872 B12R1.21 O=C([O-])COc1ccc(cc1)F 34a_100000210339_100020667443 [0,2,0,0,0,0|1,0,1]=4 8873 B12R1.21 O=C([O-])COc1ccc(cc1)I 34a_100000212066_100020667443 [0,2,0,0,0,0|1,0,1]=4 8874 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [0,2,0,0,0,0|0,1,1]=4 8875 B12R1.21 O=[N+]([O-])CNc1ccc(cc1)O 34a_100000185829_100000761209 [0,2,0,0,0,0|2,0,0]=4 8876 B12R1.21 O=[N+]([O-])COc1ccc(cc1)Br 34a_100000185759_100000761209 [0,2,0,0,0,0|2,0,0]=4 8877 B12R1.21 O=[N+]([O-])COc1ccc(cc1)Cl 34a_100000210216_100000761209 [0,2,0,0,0,0|2,0,0]=4 8878 B12R1.21 O=[N+]([O-])COc1ccc(cc1)F 34a_100000210339_100000761209 [0,2,0,0,0,0|2,0,0]=4 8879 B12R1.21 O=[N+]([O-])COc1ccc(cc1)I 34a_100000212066_100000761209 [0,2,0,0,0,0|2,0,0]=4 8880 B12R1.21 O=c1ccc(c[nH]1)OCC(F)F 34a_100000075641_100011934356 [0,2,0,0,0,0|1,0,1]=4 8881 B12R1.21 Oc1ccc(cc1)NCC(F)F 34a_100000185829_100011934356 [0,2,0,0,0,0|1,0,0]=3 8882 B12R1.21 Oc1ccc(cc1)SCC(F)F 62a_100011934356_100000185759 [0,2,0,0,0,0|0,1,0]=3 8883 B12R1.21 Oc1ccc(nc1)SCC(F)F 62a_100000685995_100011934356 [0,2,0,0,0,0|1,1,0]=4 8884 B12R1.21 Oc1ccc(nc1)SCC(F)F 62a_100011934356_100000744096 [0,2,0,0,0,0|1,1,0]=4 8885 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [0,2,0,0,0,0|2,0,0]=4 8886 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [0,2,0,0,0,0|2,0,0]=4 8887 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [0,2,0,0,0,0|2,0,0]=4 8888 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [0,2,0,0,0,0|2,0,0]=4 8889 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [0,2,0,0,0,0|1,0,0]=3 8890 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Br 1458a_100000182358_200025704644 [0,2,0,0,0,0|1,0,0]=3 8891 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Cl 1458a_100016990877_200025704644 [0,2,0,0,0,0|1,0,0]=3 8892 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)F 1458a_100000184765_200025704644 [0,2,0,0,0,0|1,0,0]=3 8893 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)I 1458a_100000184369_200025704644 [0,2,0,0,0,0|1,0,0]=3 8894 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [0,2,0,0,0,0|0,0,0]=2 8895 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Br 1458a_100000179496_200025704644 [0,2,0,0,0,0|1,1,0]=4 8896 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200025704644 [0,2,0,0,0,0|1,1,0]=4 8897 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)F 1458a_100000691584_200025704644 [0,2,0,0,0,0|1,1,0]=4 8898 B12R1.49 C#CC(C)Nc1ccc(cc1)Br 34a_100000210018_200000035995 [0,2,0,0,0,0|2,0,0]=4 8899 B12R1.49 C#CC(C)Nc1ccc(cc1)C 34a_100000124888_200000035995 [0,2,0,0,0,0|2,0,0]=4 8900 B12R1.49 C#CC(C)Nc1ccc(cc1)Cl 34a_100000210052_200000035995 [0,2,0,0,0,0|2,0,0]=4 8901 B12R1.49 C#CC(C)Nc1ccc(cc1)F 34a_100000185862_200000035995 [0,2,0,0,0,0|2,0,0]=4 8902 B12R1.49 C#CC(C)Nc1ccc(cc1)I 34a_100000185761_200000035995 [0,2,0,0,0,0|2,0,0]=4 8903 B12R1.49 C#CC(C)Nc1ccc(cc1)O 34a_100000185829_200000035995 [0,2,0,0,0,0|1,0,0]=3 8904 B12R1.49 C#CC(C)Oc1ccc(=O)[nH]c1 34a_100000075641_200000035995 [0,2,0,0,0,0|1,0,1]=4 8905 B12R1.49 C#CC(C)Oc1ccc(cc1)Br 34a_100000185759_200000035995 [0,2,0,0,0,0|1,0,0]=3 8906 B12R1.49 C#CC(C)Oc1ccc(cc1)C 34a_100000210336_200000035995 [0,2,0,0,0,0|1,0,0]=3 8907 B12R1.49 C#CC(C)Oc1ccc(cc1)Cl 34a_100000210216_200000035995 [0,2,0,0,0,0|1,0,0]=3 8908 B12R1.49 C#CC(C)Oc1ccc(cc1)F 34a_100000210339_200000035995 [0,2,0,0,0,0|1,0,0]=3 8909 B12R1.49 C#CC(C)Oc1ccc(cc1)I 34a_100000212066_200000035995 [0,2,0,0,0,0|1,0,0]=3 8910 B12R1.49 C#CC(C)Oc1ccc(cc1)N 34a_100000185829_200000035995 [0,2,0,0,0,0|1,0,0]=3 8911 B12R1.49 C#CC(C)Oc1ccc(cn1)C 34a_100000759353_200000035995 [0,2,0,0,0,0|2,0,0]=4 8912 B12R1.49 C#CC(C)Oc1ccc(cn1)Cl 34a_100011215309_200000035995 [0,2,0,0,0,0|2,0,0]=4 8913 B12R1.49 C#CC(C)Oc1ccc(cn1)F 34a_100000742473_200000035995 [0,2,0,0,0,0|2,0,0]=4 8914 B12R1.49 C#CC(C)Oc1ccc(cn1)N 34a_100000729260_200000035995 [0,2,0,0,0,0|2,0,0]=4 8915 B12R1.49 C#CC(C)Oc1ccc(nc1)Br 34a_100000685995_200000035995 [0,2,0,0,0,0|2,0,0]=4 8916 B12R1.49 C#CC(C)Oc1ccc(nc1)C 34a_100000745506_200000035995 [0,2,0,0,0,0|2,0,0]=4 8917 B12R1.49 C#CC(C)Oc1ccc(nc1)Cl 34a_100000744096_200000035995 [0,2,0,0,0,0|2,0,0]=4 8918 B12R1.49 C#CC(C)Oc1ccc(nc1)F 34a_100000688820_200000035995 [0,2,0,0,0,0|2,0,0]=4 8919 B12R1.49 C#CC(C)Oc1ccc(nc1)I 34a_100000687607_200000035995 [0,2,0,0,0,0|2,0,0]=4 8920 B12R1.49 C#CC(C)Oc1ccc(nc1)N 34a_100015188713_200000035995 [0,2,0,0,0,0|2,0,0]=4 8921 B12R1.49 C#CC(C)Sc1ccc(cc1)Br 62a_200000035995_100000752885 [0,2,0,0,0,0|1,1,0]=4 8922 B12R1.49 C#CC(C)Sc1ccc(cc1)C 62a_200000035995_100000186775 [0,2,0,0,0,0|1,1,0]=4 8923 B12R1.49 C#CC(C)Sc1ccc(cc1)Cl 62a_200000035995_100000755918 [0,2,0,0,0,0|1,1,0]=4 8924 B12R1.49 C#CC(C)Sc1ccc(cc1)F 62a_200000035995_100000211213 [0,2,0,0,0,0|1,1,0]=4 8925 B12R1.49 C#CC(C)Sc1ccc(cc1)N 62a_200000035995_100000185761 [0,2,0,0,0,0|1,1,0]=4 8926 B12R1.49 C#CC(C)Sc1ccc(cc1)O 62a_200000035995_100000185759 [0,2,0,0,0,0|0,1,0]=3 8927 B12R1.49 C#CC(C)Sc1ccc(cn1)O 62a_200000035995_100000744096 [0,2,0,0,0,0|1,1,0]=4 8928 B12R1.49 C=CC(C)Sc1ccc(cc1)Br 62a_100011215867_100000752885 [0,2,0,0,0,0|1,1,0]=4 8929 B12R1.49 C=CC(C)Sc1ccc(cc1)C 62a_100011215867_100000186775 [0,2,0,0,0,0|1,1,0]=4 8930 B12R1.49 C=CC(C)Sc1ccc(cc1)Cl 62a_100011215867_100000755918 [0,2,0,0,0,0|1,1,0]=4 8931 B12R1.49 C=CC(C)Sc1ccc(cc1)F 62a_100011215867_100000211213 [0,2,0,0,0,0|1,1,0]=4 8932 B12R1.49 C=CC(C)Sc1ccc(cc1)N 62a_100011215867_100000185761 [0,2,0,0,0,0|1,1,0]=4 8933 B12R1.49 C=CC(C)Sc1ccc(cc1)O 62a_100011215867_100000185759 [0,2,0,0,0,0|0,1,0]=3 8934 B12R1.49 C=CC(C)Sc1ccc(cn1)O 62a_100011215867_100000744096 [0,2,0,0,0,0|1,1,0]=4 8935 B12R1.49 CC(C#N)Nc1ccc(cc1)Br 2230a_100000210018_100000184139 [0,2,0,0,0,0|2,0,0]=4 8936 B12R1.49 CC(C#N)Nc1ccc(cc1)Cl 2230a_100000210052_100000184139 [0,2,0,0,0,0|2,0,0]=4 8937 B12R1.49 CC(C#N)Oc1ccc(cc1)Br 7a_100000185759_100000703298 [0,2,0,0,0,0|1,0,0]=3 8938 B12R1.49 CC(C#N)Oc1ccc(cc1)Cl 7a_100000210216_100000703298 [0,2,0,0,0,0|1,0,0]=3 8939 B12R1.49 CC(C#N)Oc1ccc(cc1)I 7a_100000212066_100000703298 [0,2,0,0,0,0|1,0,0]=3 8940 B12R1.49 CC(C#N)Oc1ccc(nc1)Br 7a_100000685995_100000703298 [0,2,0,0,0,0|2,0,0]=4 8941 B12R1.49 CC(C#N)Oc1ccc(nc1)Cl 7a_100000744096_100000703298 [0,2,0,0,0,0|2,0,0]=4 8942 B12R1.49 CC(C#N)Oc1ccc(nc1)F 7a_100000688820_100000703298 [0,2,0,0,0,0|2,0,0]=4 8943 B12R1.49 CC(C#N)Oc1ccc(nc1)I 7a_100000687607_100000703298 [0,2,0,0,0,0|2,0,0]=4 8944 B12R1.49 CC(C#N)Oc1ccc(nc1)N 7a_100015188713_100000703298 [0,2,0,0,0,0|2,0,0]=4 8945 B12R1.49 CC(C#N)Sc1ccc(cc1)Br 62a_100000703298_100000752885 [0,2,0,0,0,0|1,1,0]=4 8946 B12R1.49 CC(C#N)Sc1ccc(cc1)Br 62a_100000752885_100000703298 [0,2,0,0,0,0|1,1,0]=4 8947 B12R1.49 CC(C#N)Sc1ccc(cc1)Cl 62a_100000703298_100000755918 [0,2,0,0,0,0|1,1,0]=4 8948 B12R1.49 CC(C#N)Sc1ccc(cc1)Cl 62a_100000755918_100000703298 [0,2,0,0,0,0|1,1,0]=4 8949 B12R1.49 CC(C#N)Sc1ccc(cc1)F 62a_100000211213_100000703298 [0,2,0,0,0,0|1,1,0]=4 8950 B12R1.49 CC(C#N)Sc1ccc(cc1)F 62a_100000703298_100000211213 [0,2,0,0,0,0|1,1,0]=4 8951 B12R1.49 CC(C#N)Sc1ccc(cc1)N 62a_100000185761_100000703298 [0,2,0,0,0,0|1,1,0]=4 8952 B12R1.49 CC(C#N)Sc1ccc(cc1)N 62a_100000703298_100000185761 [0,2,0,0,0,0|1,1,0]=4 8953 B12R1.49 CC(C#N)Sc1ccc(cc1)O 62a_100000703298_100000185759 [0,2,0,0,0,0|0,1,0]=3 8954 B12R1.49 CC(C#N)Sc1ccc(cn1)O 62a_100000685995_100000703298 [0,2,0,0,0,0|1,1,0]=4 8955 B12R1.49 CC(C#N)Sc1ccc(cn1)O 62a_100000703298_100000744096 [0,2,0,0,0,0|1,1,0]=4 8956 B12R1.49 CC(CO)Nc1ccc(cc1)Br 2230a_100000210018_100012180447 [0,2,0,0,0,0|2,0,0]=4 8957 B12R1.49 CC(CO)Nc1ccc(cc1)Br 34a_100000210018_100012180447 [0,2,0,0,0,0|2,0,0]=4 8958 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 2230a_100000210052_100012180447 [0,2,0,0,0,0|2,0,0]=4 8959 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 34a_100000210052_100012180447 [0,2,0,0,0,0|2,0,0]=4 8960 B12R1.49 CC(CO)Nc1ccc(cc1)F 34a_100000185862_100012180447 [0,2,0,0,0,0|2,0,0]=4 8961 B12R1.49 CC(CO)Nc1ccc(cc1)I 34a_100000185761_100012180447 [0,2,0,0,0,0|2,0,0]=4 8962 B12R1.49 CC(CO)Nc1ccc(cc1)O 34a_100000185829_100012180447 [0,2,0,0,0,0|1,0,0]=3 8963 B12R1.49 CC(CO)Oc1ccc(=O)[nH]c1 34a_100000075641_100012180447 [0,2,0,0,0,0|1,0,1]=4 8964 B12R1.49 CC(CO)Oc1ccc(cc1)Br 34a_100000185759_100012180447 [0,2,0,0,0,0|1,0,0]=3 8965 B12R1.49 CC(CO)Oc1ccc(cc1)Br 7a_100000185759_100012180447 [0,2,0,0,0,0|1,0,0]=3 8966 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 34a_100000210216_100012180447 [0,2,0,0,0,0|1,0,0]=3 8967 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 7a_100000210216_100012180447 [0,2,0,0,0,0|1,0,0]=3 8968 B12R1.49 CC(CO)Oc1ccc(cc1)F 34a_100000210339_100012180447 [0,2,0,0,0,0|1,0,0]=3 8969 B12R1.49 CC(CO)Oc1ccc(cc1)I 34a_100000212066_100012180447 [0,2,0,0,0,0|1,0,0]=3 8970 B12R1.49 CC(CO)Oc1ccc(cc1)I 7a_100000212066_100012180447 [0,2,0,0,0,0|1,0,0]=3 8971 B12R1.49 CC(CO)Oc1ccc(cc1)N 34a_100000185829_100012180447 [0,2,0,0,0,0|1,0,0]=3 8972 B12R1.49 CC(CO)Oc1ccc(cn1)Cl 34a_100011215309_100012180447 [0,2,0,0,0,0|2,0,0]=4 8973 B12R1.49 CC(CO)Oc1ccc(cn1)F 34a_100000742473_100012180447 [0,2,0,0,0,0|2,0,0]=4 8974 B12R1.49 CC(CO)Oc1ccc(cn1)N 34a_100000729260_100012180447 [0,2,0,0,0,0|2,0,0]=4 8975 B12R1.49 CC(CO)Oc1ccc(nc1)Br 34a_100000685995_100012180447 [0,2,0,0,0,0|2,0,0]=4 8976 B12R1.49 CC(CO)Oc1ccc(nc1)Br 7a_100000685995_100012180447 [0,2,0,0,0,0|2,0,0]=4 8977 B12R1.49 CC(CO)Oc1ccc(nc1)Cl 34a_100000744096_100012180447 [0,2,0,0,0,0|2,0,0]=4 8978 B12R1.49 CC(CO)Oc1ccc(nc1)Cl 7a_100000744096_100012180447 [0,2,0,0,0,0|2,0,0]=4 8979 B12R1.49 CC(CO)Oc1ccc(nc1)F 34a_100000688820_100012180447 [0,2,0,0,0,0|2,0,0]=4 8980 B12R1.49 CC(CO)Oc1ccc(nc1)F 7a_100000688820_100012180447 [0,2,0,0,0,0|2,0,0]=4 8981 B12R1.49 CC(CO)Oc1ccc(nc1)I 34a_100000687607_100012180447 [0,2,0,0,0,0|2,0,0]=4 8982 B12R1.49 CC(CO)Oc1ccc(nc1)I 7a_100000687607_100012180447 [0,2,0,0,0,0|2,0,0]=4 8983 B12R1.49 CC(CO)Oc1ccc(nc1)N 34a_100015188713_100012180447 [0,2,0,0,0,0|2,0,0]=4 8984 B12R1.49 CC(CO)Oc1ccc(nc1)N 7a_100015188713_100012180447 [0,2,0,0,0,0|2,0,0]=4 8985 B12R1.49 CC(CO)Sc1ccc(cc1)Br 62a_100012180447_100000752885 [0,2,0,0,0,0|1,1,0]=4 8986 B12R1.49 CC(CO)Sc1ccc(cc1)Cl 62a_100012180447_100000755918 [0,2,0,0,0,0|1,1,0]=4 8987 B12R1.49 CC(CO)Sc1ccc(cc1)F 62a_100012180447_100000211213 [0,2,0,0,0,0|1,1,0]=4 8988 B12R1.49 CC(CO)Sc1ccc(cc1)N 62a_100012180447_100000185761 [0,2,0,0,0,0|1,1,0]=4 8989 B12R1.49 CC(CO)Sc1ccc(cc1)O 62a_100012180447_100000185759 [0,2,0,0,0,0|0,1,0]=3 8990 B12R1.49 CC(CO)Sc1ccc(cn1)O 62a_100012180447_100000744096 [0,2,0,0,0,0|1,1,0]=4 8991 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 34a_100011351027_200025704644 [0,2,0,0,0,0|2,0,0]=4 8992 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 7a_100011351027_200025704644 [0,2,0,0,0,0|2,0,0]=4 8993 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [0,2,0,0,0,0|1,0,0]=3 8994 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [0,2,0,0,0,0|1,0,0]=3 8995 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [0,2,0,0,0,0|2,0,0]=4 8996 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [0,2,0,0,0,0|2,0,0]=4 8997 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [0,2,0,0,0,0|2,0,0]=4 8998 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [0,2,0,0,0,0|2,0,0]=4 8999 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [0,2,0,0,0,0|2,0,0]=4 9000 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [0,2,0,0,0,0|2,0,0]=4 9001 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [0,2,0,0,0,0|2,0,0]=4 9002 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [0,2,0,0,0,0|2,0,0]=4 9003 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [0,2,0,0,0,0|2,0,0]=4 9004 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [0,2,0,0,0,0|2,0,0]=4 9005 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,2,0,0,0,0|1,0,0]=3 9006 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 9007 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 9008 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 9009 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 9010 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 9011 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 9012 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 9013 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 9014 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 9015 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 9016 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 9017 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 9018 B12R1.49 CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 9019 B12R1.49 CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 9020 B12R1.49 CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 9021 B12R1.49 CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 9022 B12R1.49 CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 9023 B12R1.49 CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 9024 B12R1.49 CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 9025 B12R1.49 CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 9026 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,2,0,0,0,0|1,0,0]=3 9027 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,2,0,0,0,0|0,0,0]=2 9028 B12R1.49 CCC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000758301 [0,2,0,0,0,0|2,0,0]=4 9029 B12R1.49 CCC(C)Nc1ccc(cc1)Br 34a_100000210018_100011215416 [0,2,0,0,0,0|2,0,0]=4 9030 B12R1.49 CCC(C)Nc1ccc(cc1)C 34a_100000124888_100011215416 [0,2,0,0,0,0|2,0,0]=4 9031 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000758301 [0,2,0,0,0,0|2,0,0]=4 9032 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 34a_100000210052_100011215416 [0,2,0,0,0,0|2,0,0]=4 9033 B12R1.49 CCC(C)Nc1ccc(cc1)F 34a_100000185862_100011215416 [0,2,0,0,0,0|2,0,0]=4 9034 B12R1.49 CCC(C)Nc1ccc(cc1)I 34a_100000185761_100011215416 [0,2,0,0,0,0|2,0,0]=4 9035 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [0,2,0,0,0,0|1,0,0]=3 9036 B12R1.49 CCC(C)Oc1ccc(=O)[nH]c1 34a_100000075641_100011215416 [0,2,0,0,0,0|1,0,1]=4 9037 B12R1.49 CCC(C)Oc1ccc(cc1)Br 34a_100000185759_100011215416 [0,2,0,0,0,0|1,0,0]=3 9038 B12R1.49 CCC(C)Oc1ccc(cc1)Br 7a_100000185759_100000758301 [0,2,0,0,0,0|1,0,0]=3 9039 B12R1.49 CCC(C)Oc1ccc(cc1)C 34a_100000210336_100011215416 [0,2,0,0,0,0|1,0,0]=3 9040 B12R1.49 CCC(C)Oc1ccc(cc1)C 7a_100000210336_100000758301 [0,2,0,0,0,0|1,0,0]=3 9041 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 34a_100000210216_100011215416 [0,2,0,0,0,0|1,0,0]=3 9042 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000758301 [0,2,0,0,0,0|1,0,0]=3 9043 B12R1.49 CCC(C)Oc1ccc(cc1)F 34a_100000210339_100011215416 [0,2,0,0,0,0|1,0,0]=3 9044 B12R1.49 CCC(C)Oc1ccc(cc1)I 34a_100000212066_100011215416 [0,2,0,0,0,0|1,0,0]=3 9045 B12R1.49 CCC(C)Oc1ccc(cc1)I 7a_100000212066_100000758301 [0,2,0,0,0,0|1,0,0]=3 9046 B12R1.49 CCC(C)Oc1ccc(cc1)N 34a_100000185829_100011215416 [0,2,0,0,0,0|1,0,0]=3 9047 B12R1.49 CCC(C)Oc1ccc(cn1)C 34a_100000759353_100011215416 [0,2,0,0,0,0|2,0,0]=4 9048 B12R1.49 CCC(C)Oc1ccc(cn1)Cl 34a_100011215309_100011215416 [0,2,0,0,0,0|2,0,0]=4 9049 B12R1.49 CCC(C)Oc1ccc(cn1)F 34a_100000742473_100011215416 [0,2,0,0,0,0|2,0,0]=4 9050 B12R1.49 CCC(C)Oc1ccc(cn1)N 34a_100000729260_100011215416 [0,2,0,0,0,0|2,0,0]=4 9051 B12R1.49 CCC(C)Oc1ccc(nc1)Br 34a_100000685995_100011215416 [0,2,0,0,0,0|2,0,0]=4 9052 B12R1.49 CCC(C)Oc1ccc(nc1)Br 7a_100000685995_100000758301 [0,2,0,0,0,0|2,0,0]=4 9053 B12R1.49 CCC(C)Oc1ccc(nc1)C 34a_100000745506_100011215416 [0,2,0,0,0,0|2,0,0]=4 9054 B12R1.49 CCC(C)Oc1ccc(nc1)C 7a_100000745506_100000758301 [0,2,0,0,0,0|2,0,0]=4 9055 B12R1.49 CCC(C)Oc1ccc(nc1)Cl 34a_100000744096_100011215416 [0,2,0,0,0,0|2,0,0]=4 9056 B12R1.49 CCC(C)Oc1ccc(nc1)Cl 7a_100000744096_100000758301 [0,2,0,0,0,0|2,0,0]=4 9057 B12R1.49 CCC(C)Oc1ccc(nc1)F 34a_100000688820_100011215416 [0,2,0,0,0,0|2,0,0]=4 9058 B12R1.49 CCC(C)Oc1ccc(nc1)F 7a_100000688820_100000758301 [0,2,0,0,0,0|2,0,0]=4 9059 B12R1.49 CCC(C)Oc1ccc(nc1)I 34a_100000687607_100011215416 [0,2,0,0,0,0|2,0,0]=4 9060 B12R1.49 CCC(C)Oc1ccc(nc1)I 7a_100000687607_100000758301 [0,2,0,0,0,0|2,0,0]=4 9061 B12R1.49 CCC(C)Oc1ccc(nc1)N 34a_100015188713_100011215416 [0,2,0,0,0,0|2,0,0]=4 9062 B12R1.49 CCC(C)Oc1ccc(nc1)N 7a_100015188713_100000758301 [0,2,0,0,0,0|2,0,0]=4 9063 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000752885_100000758301 [0,2,0,0,0,0|1,1,0]=4 9064 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000758301_100000752885 [0,2,0,0,0,0|1,1,0]=4 9065 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000186775_100000758301 [0,2,0,0,0,0|1,1,0]=4 9066 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000758301_100000186775 [0,2,0,0,0,0|1,1,0]=4 9067 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000758301 [0,2,0,0,0,0|1,1,0]=4 9068 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000758301_100000755918 [0,2,0,0,0,0|1,1,0]=4 9069 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000211213_100000758301 [0,2,0,0,0,0|1,1,0]=4 9070 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000758301_100000211213 [0,2,0,0,0,0|1,1,0]=4 9071 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000185761_100000758301 [0,2,0,0,0,0|1,1,0]=4 9072 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000758301_100000185761 [0,2,0,0,0,0|1,1,0]=4 9073 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [0,2,0,0,0,0|0,1,0]=3 9074 B12R1.49 CCC(C)Sc1ccc(cn1)O 62a_100000685995_100000758301 [0,2,0,0,0,0|1,1,0]=4 9075 B12R1.49 CCC(C)Sc1ccc(cn1)O 62a_100000758301_100000744096 [0,2,0,0,0,0|1,1,0]=4 9076 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100000210202 [0,2,0,0,0,0|2,0,0]=4 9077 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000187385_200000210301 [0,2,0,0,0,0|2,0,0]=4 9078 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000225621_100011217064 [0,2,0,0,0,0|2,0,0]=4 9079 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000204670 [0,2,0,0,0,0|2,0,0]=4 9080 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000187385_200000210301 [0,2,0,0,0,0|2,0,0]=4 9081 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000225621_100011217064 [0,2,0,0,0,0|2,0,0]=4 9082 B12R1.49 CCN(C)Cc1ccc(cc1)Br 26a_100000225621_100000185759 [0,2,0,0,0,0|2,0,0]=4 9083 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000180869_200000210301 [0,2,0,0,0,0|2,0,0]=4 9084 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000225621_100000210814 [0,2,0,0,0,0|2,0,0]=4 9085 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210202 [0,2,0,0,0,0|2,0,0]=4 9086 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000180869_200000210301 [0,2,0,0,0,0|2,0,0]=4 9087 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000225621_100000210814 [0,2,0,0,0,0|2,0,0]=4 9088 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000204670 [0,2,0,0,0,0|2,0,0]=4 9089 B12R1.49 CCN(C)Cc1ccc(cc1)C 26a_100000225621_200020625495 [0,2,0,0,0,0|2,0,0]=4 9090 B12R1.49 CCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210202 [0,2,0,0,0,0|2,0,0]=4 9091 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000180830_200000210301 [0,2,0,0,0,0|2,0,0]=4 9092 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210202 [0,2,0,0,0,0|2,0,0]=4 9093 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000225621_100000694040 [0,2,0,0,0,0|2,0,0]=4 9094 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000180830_200000210301 [0,2,0,0,0,0|2,0,0]=4 9095 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000204670 [0,2,0,0,0,0|2,0,0]=4 9096 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000225621_100000187161 [0,2,0,0,0,0|2,0,0]=4 9097 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100000210202 [0,2,0,0,0,0|2,0,0]=4 9098 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100000184576_100000210202 [0,2,0,0,0,0|2,0,0]=4 9099 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100000225621_100000198546 [0,2,0,0,0,0|2,0,0]=4 9100 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100015183324_200000210301 [0,2,0,0,0,0|2,0,0]=4 9101 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000204670 [0,2,0,0,0,0|2,0,0]=4 9102 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100000225621_100000198546 [0,2,0,0,0,0|2,0,0]=4 9103 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100015183324_200000210301 [0,2,0,0,0,0|2,0,0]=4 9104 B12R1.49 CCN(C)Cc1ccc(cc1)F 34a_100000184576_100000210202 [0,2,0,0,0,0|2,0,0]=4 9105 B12R1.49 CCN(C)Cc1ccc(cc1)F 34a_100015183324_200000210301 [0,2,0,0,0,0|2,0,0]=4 9106 B12R1.49 CCN(C)Cc1ccc(cc1)I 2230a_100000225621_100000189116 [0,2,0,0,0,0|2,0,0]=4 9107 B12R1.49 CCN(C)Cc1ccc(cc1)I 269982a_100000225621_100000189116 [0,2,0,0,0,0|2,0,0]=4 9108 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [0,2,0,0,0,0|1,0,0]=3 9109 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [0,2,0,0,0,0|1,0,0]=3 9110 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [0,2,0,0,0,0|1,0,0]=3 9111 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Br 2230a_100000187385_200025704644 [0,2,0,0,0,0|2,0,0]=4 9112 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Br 269982a_100000187385_200025704644 [0,2,0,0,0,0|2,0,0]=4 9113 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 2230a_100000180869_200025704644 [0,2,0,0,0,0|2,0,0]=4 9114 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 269982a_100000180869_200025704644 [0,2,0,0,0,0|2,0,0]=4 9115 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Cl 2230a_100000180830_200025704644 [0,2,0,0,0,0|2,0,0]=4 9116 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Cl 269982a_100000180830_200025704644 [0,2,0,0,0,0|2,0,0]=4 9117 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 2230a_100015183324_200025704644 [0,2,0,0,0,0|2,0,0]=4 9118 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 269982a_100015183324_200025704644 [0,2,0,0,0,0|2,0,0]=4 9119 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 34a_100015183324_200025704644 [0,2,0,0,0,0|2,0,0]=4 9120 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [0,2,0,0,0,0|1,0,0]=3 9121 B12R1.49 CN(CF)Cc1ccc(cc1)O 269982a_100000207500_100015361967 [0,2,0,0,0,0|2,0,0]=4 9122 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [0,2,0,0,0,0|1,0,1]=4 9123 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [0,2,0,0,0,0|1,0,1]=4 9124 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [0,2,0,0,0,0|1,0,1]=4 9125 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [0,2,0,0,0,0|1,0,1]=4 9126 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [0,2,0,0,0,0|1,0,1]=4 9127 B12R1.49 CNC(C)Cc1ccc(cc1)Br 270004a_106832991635_100000691760 [0,2,0,0,0,0|2,0,0]=4 9128 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [0,2,0,0,0,0|2,0,0]=4 9129 B12R1.49 CNC(C)Cc1ccc(cc1)Cl 270004a_106832991635_100000747806 [0,2,0,0,0,0|2,0,0]=4 9130 B12R1.49 CNC(C)Cc1ccc(cc1)F 270004a_106832991635_100000745281 [0,2,0,0,0,0|2,0,0]=4 9131 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [0,2,0,0,0,0|1,0,0]=3 9132 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [0,2,0,0,0,0|1,0,0]=3 9133 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [0,2,0,0,0,0|1,0,0]=3 9134 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [0,2,0,0,0,0|1,0,1]=4 9135 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [0,2,0,0,0,0|1,0,1]=4 9136 B12R1.49 COC(C)Cc1ccc(cc1)F 34a_100011351027_200000210301 [0,2,0,0,0,0|2,0,0]=4 9137 B12R1.49 COC(C)Cc1ccc(cc1)F 7a_100011351027_200000210301 [0,2,0,0,0,0|2,0,0]=4 9138 B12R1.49 COC(C)Sc1ccc(cc1)Br 62a_100000752885_100009879195 [0,2,0,0,0,0|1,1,0]=4 9139 B12R1.49 COC(C)Sc1ccc(cc1)Br 62a_100009879195_100000752885 [0,2,0,0,0,0|1,1,0]=4 9140 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100000186775_100009879195 [0,2,0,0,0,0|1,1,0]=4 9141 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100009879195_100000186775 [0,2,0,0,0,0|1,1,0]=4 9142 B12R1.49 COC(C)Sc1ccc(cc1)Cl 62a_100000755918_100009879195 [0,2,0,0,0,0|1,1,0]=4 9143 B12R1.49 COC(C)Sc1ccc(cc1)Cl 62a_100009879195_100000755918 [0,2,0,0,0,0|1,1,0]=4 9144 B12R1.49 COC(C)Sc1ccc(cc1)F 62a_100000211213_100009879195 [0,2,0,0,0,0|1,1,0]=4 9145 B12R1.49 COC(C)Sc1ccc(cc1)F 62a_100009879195_100000211213 [0,2,0,0,0,0|1,1,0]=4 9146 B12R1.49 COC(C)Sc1ccc(cc1)N 62a_100000185761_100009879195 [0,2,0,0,0,0|1,1,0]=4 9147 B12R1.49 COC(C)Sc1ccc(cc1)N 62a_100009879195_100000185761 [0,2,0,0,0,0|1,1,0]=4 9148 B12R1.49 COC(C)Sc1ccc(cc1)O 62a_100009879195_100000185759 [0,2,0,0,0,0|0,1,0]=3 9149 B12R1.49 COC(C)Sc1ccc(cn1)O 62a_100000685995_100009879195 [0,2,0,0,0,0|1,1,0]=4 9150 B12R1.49 COC(C)Sc1ccc(cn1)O 62a_100009879195_100000744096 [0,2,0,0,0,0|1,1,0]=4 9151 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100000752885_100016084084 [0,2,0,0,0,0|1,1,0]=4 9152 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100016084084_100000752885 [0,2,0,0,0,0|1,1,0]=4 9153 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100000755918_100016084084 [0,2,0,0,0,0|1,1,0]=4 9154 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100016084084_100000755918 [0,2,0,0,0,0|1,1,0]=4 9155 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100000211213_100016084084 [0,2,0,0,0,0|1,1,0]=4 9156 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100016084084_100000211213 [0,2,0,0,0,0|1,1,0]=4 9157 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100000185761_100016084084 [0,2,0,0,0,0|1,1,0]=4 9158 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100016084084_100000185761 [0,2,0,0,0,0|1,1,0]=4 9159 B12R1.49 C[C@H](CO)Sc1ccc(cc1)O 62a_100016084084_100000185759 [0,2,0,0,0,0|0,1,0]=3 9160 B12R1.49 C[C@H](CO)Sc1ccc(cn1)O 62a_100000685995_100016084084 [0,2,0,0,0,0|1,1,0]=4 9161 B12R1.49 C[C@H](CO)Sc1ccc(cn1)O 62a_100016084084_100000744096 [0,2,0,0,0,0|1,1,0]=4 9162 B12R1.49 Cc1ccc(cc1)NC(C)CO 34a_100000124888_100012180447 [0,2,0,0,0,0|2,0,0]=4 9163 B12R1.49 Cc1ccc(cc1)OC(C)C#N 7a_100000210336_100000703298 [0,2,0,0,0,0|1,0,0]=3 9164 B12R1.49 Cc1ccc(cc1)OC(C)CO 34a_100000210336_100012180447 [0,2,0,0,0,0|1,0,0]=3 9165 B12R1.49 Cc1ccc(cc1)OC(C)CO 7a_100000210336_100012180447 [0,2,0,0,0,0|1,0,0]=3 9166 B12R1.49 Cc1ccc(cc1)SC(C)C#N 62a_100000186775_100000703298 [0,2,0,0,0,0|1,1,0]=4 9167 B12R1.49 Cc1ccc(cc1)SC(C)C#N 62a_100000703298_100000186775 [0,2,0,0,0,0|1,1,0]=4 9168 B12R1.49 Cc1ccc(cc1)SC(C)CO 62a_100012180447_100000186775 [0,2,0,0,0,0|1,1,0]=4 9169 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100000186775_100016084084 [0,2,0,0,0,0|1,1,0]=4 9170 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000186775 [0,2,0,0,0,0|1,1,0]=4 9171 B12R1.49 Cc1ccc(cn1)OC(C)C#N 7a_100000745506_100000703298 [0,2,0,0,0,0|2,0,0]=4 9172 B12R1.49 Cc1ccc(cn1)OC(C)CO 34a_100000745506_100012180447 [0,2,0,0,0,0|2,0,0]=4 9173 B12R1.49 Cc1ccc(cn1)OC(C)CO 7a_100000745506_100012180447 [0,2,0,0,0,0|2,0,0]=4 9174 B12R1.49 Cc1ccc(nc1)OC(C)CO 34a_100000759353_100012180447 [0,2,0,0,0,0|2,0,0]=4 9175 B12R1.49 N#CC(F)Sc1ccc(cc1)O 62a_200000117898_100000185759 [0,2,0,0,0,0|0,1,1]=4 9176 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,2,0,0,0,0|1,0,1]=4 9177 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,2,0,0,0,0|1,0,1]=4 9178 B12R1.69 C#CCNc1ccc(cc1Br)O 34a_100012001276_100000184674 [0,2,0,0,0,0|1,0,1]=4 9179 B12R1.69 C#CCNc1ccc(cc1C)O 34a_100000756630_100000184674 [0,2,0,0,0,0|1,0,1]=4 9180 B12R1.69 C#CCNc1ccc(cc1Cl)O 34a_100011215599_100000184674 [0,2,0,0,0,0|1,0,1]=4 9181 B12R1.69 C#CCNc1ccc(cc1F)O 34a_100000759473_100000184674 [0,2,0,0,0,0|1,0,1]=4 9182 B12R1.69 C#CCNc1ccc(cc1I)O 34a_100010084370_100000184674 [0,2,0,0,0,0|1,0,1]=4 9183 B12R1.69 C#CCNc1ccc(cc1O)O 34a_100000106777_100000184674 [0,2,0,0,0,0|1,0,1]=4 9184 B12R1.69 C#CCOc1ccc(cc1Br)Br 34a_100000188717_100000184674 [0,2,0,0,0,0|1,0,1]=4 9185 B12R1.69 C#CCOc1ccc(cc1Br)Br 7a_100000188717_100000038162 [0,2,0,0,0,0|1,0,1]=4 9186 B12R1.69 C#CCOc1ccc(cc1Br)C 34a_100000210800_100000184674 [0,2,0,0,0,0|1,0,1]=4 9187 B12R1.69 C#CCOc1ccc(cc1Br)C 7a_100000210800_100000038162 [0,2,0,0,0,0|1,0,1]=4 9188 B12R1.69 C#CCOc1ccc(cc1Br)Cl 34a_100000211998_100000184674 [0,2,0,0,0,0|1,0,1]=4 9189 B12R1.69 C#CCOc1ccc(cc1Br)Cl 7a_100000211998_100000038162 [0,2,0,0,0,0|1,0,1]=4 9190 B12R1.69 C#CCOc1ccc(cc1Br)F 34a_100000211999_100000184674 [0,2,0,0,0,0|1,0,1]=4 9191 B12R1.69 C#CCOc1ccc(cc1Br)F 7a_100000211999_100000038162 [0,2,0,0,0,0|1,0,1]=4 9192 B12R1.69 C#CCOc1ccc(cc1Br)I 34a_100012361655_100000184674 [0,2,0,0,0,0|1,0,1]=4 9193 B12R1.69 C#CCOc1ccc(cc1Br)I 7a_100012361655_100000038162 [0,2,0,0,0,0|1,0,1]=4 9194 B12R1.69 C#CCOc1ccc(cc1Br)N 34a_100011534360_100000184674 [0,2,0,0,0,0|1,0,1]=4 9195 B12R1.69 C#CCOc1ccc(cc1Br)N 7a_100011534360_100000038162 [0,2,0,0,0,0|1,0,1]=4 9196 B12R1.69 C#CCOc1ccc(cc1C)Br 34a_100000186361_100000184674 [0,2,0,0,0,0|1,0,1]=4 9197 B12R1.69 C#CCOc1ccc(cc1C)Br 7a_100000186361_100000038162 [0,2,0,0,0,0|1,0,1]=4 9198 B12R1.69 C#CCOc1ccc(cc1C)C 34a_100000211776_100000184674 [0,2,0,0,0,0|1,0,1]=4 9199 B12R1.69 C#CCOc1ccc(cc1C)C 7a_100000211776_100000038162 [0,2,0,0,0,0|1,0,1]=4 9200 B12R1.69 C#CCOc1ccc(cc1C)Cl 34a_100000211091_100000184674 [0,2,0,0,0,0|1,0,1]=4 9201 B12R1.69 C#CCOc1ccc(cc1C)Cl 7a_100000211091_100000038162 [0,2,0,0,0,0|1,0,1]=4 9202 B12R1.69 C#CCOc1ccc(cc1C)F 34a_100000764316_100000184674 [0,2,0,0,0,0|1,0,1]=4 9203 B12R1.69 C#CCOc1ccc(cc1C)F 7a_100000764316_100000038162 [0,2,0,0,0,0|1,0,1]=4 9204 B12R1.69 C#CCOc1ccc(cc1C)I 34a_100011218673_100000184674 [0,2,0,0,0,0|1,0,1]=4 9205 B12R1.69 C#CCOc1ccc(cc1C)I 7a_100011218673_100000038162 [0,2,0,0,0,0|1,0,1]=4 9206 B12R1.69 C#CCOc1ccc(cc1C)N 34a_100011218179_100000184674 [0,2,0,0,0,0|1,0,1]=4 9207 B12R1.69 C#CCOc1ccc(cc1C)N 7a_100011218179_100000038162 [0,2,0,0,0,0|1,0,1]=4 9208 B12R1.69 C#CCOc1ccc(cc1Cl)Br 34a_100000186472_100000184674 [0,2,0,0,0,0|1,0,1]=4 9209 B12R1.69 C#CCOc1ccc(cc1Cl)Br 7a_100000186472_100000038162 [0,2,0,0,0,0|1,0,1]=4 9210 B12R1.69 C#CCOc1ccc(cc1Cl)C 34a_100000749699_100000184674 [0,2,0,0,0,0|1,0,1]=4 9211 B12R1.69 C#CCOc1ccc(cc1Cl)C 7a_100000749699_100000038162 [0,2,0,0,0,0|1,0,1]=4 9212 B12R1.69 C#CCOc1ccc(cc1Cl)Cl 34a_100015191787_100000184674 [0,2,0,0,0,0|1,0,1]=4 9213 B12R1.69 C#CCOc1ccc(cc1Cl)Cl 7a_100015191787_100000038162 [0,2,0,0,0,0|1,0,1]=4 9214 B12R1.69 C#CCOc1ccc(cc1Cl)F 34a_100000212004_100000184674 [0,2,0,0,0,0|1,0,1]=4 9215 B12R1.69 C#CCOc1ccc(cc1Cl)F 7a_100000212004_100000038162 [0,2,0,0,0,0|1,0,1]=4 9216 B12R1.69 C#CCOc1ccc(cc1Cl)I 34a_100012360047_100000184674 [0,2,0,0,0,0|1,0,1]=4 9217 B12R1.69 C#CCOc1ccc(cc1Cl)I 7a_100012360047_100000038162 [0,2,0,0,0,0|1,0,1]=4 9218 B12R1.69 C#CCOc1ccc(cc1Cl)N 34a_100000744943_100000184674 [0,2,0,0,0,0|1,0,1]=4 9219 B12R1.69 C#CCOc1ccc(cc1Cl)N 7a_100000744943_100000038162 [0,2,0,0,0,0|1,0,1]=4 9220 B12R1.69 C#CCOc1ccc(cc1F)Br 34a_100000185481_100000184674 [0,2,0,0,0,0|1,0,1]=4 9221 B12R1.69 C#CCOc1ccc(cc1F)Br 7a_100000185481_100000038162 [0,2,0,0,0,0|1,0,1]=4 9222 B12R1.69 C#CCOc1ccc(cc1F)C 34a_100011216688_100000184674 [0,2,0,0,0,0|1,0,1]=4 9223 B12R1.69 C#CCOc1ccc(cc1F)C 7a_100011216688_100000038162 [0,2,0,0,0,0|1,0,1]=4 9224 B12R1.69 C#CCOc1ccc(cc1F)Cl 34a_100000230166_100000184674 [0,2,0,0,0,0|1,0,1]=4 9225 B12R1.69 C#CCOc1ccc(cc1F)Cl 7a_100000230166_100000038162 [0,2,0,0,0,0|1,0,1]=4 9226 B12R1.69 C#CCOc1ccc(cc1F)F 34a_100000230127_100000184674 [0,2,0,0,0,0|1,0,1]=4 9227 B12R1.69 C#CCOc1ccc(cc1F)F 7a_100000230127_100000038162 [0,2,0,0,0,0|1,0,1]=4 9228 B12R1.69 C#CCOc1ccc(cc1F)I 34a_100011356965_100000184674 [0,2,0,0,0,0|1,0,1]=4 9229 B12R1.69 C#CCOc1ccc(cc1F)I 7a_100011356965_100000038162 [0,2,0,0,0,0|1,0,1]=4 9230 B12R1.69 C#CCOc1ccc(cc1F)N 34a_100011220035_100000184674 [0,2,0,0,0,0|1,0,1]=4 9231 B12R1.69 C#CCOc1ccc(cc1F)N 7a_100011220035_100000038162 [0,2,0,0,0,0|1,0,1]=4 9232 B12R1.69 C#CCOc1ccc(cc1I)Br 34a_100012355227_100000184674 [0,2,0,0,0,0|1,0,1]=4 9233 B12R1.69 C#CCOc1ccc(cc1I)Br 7a_100012355227_100000038162 [0,2,0,0,0,0|1,0,1]=4 9234 B12R1.69 C#CCOc1ccc(cc1I)C 34a_100000765521_100000184674 [0,2,0,0,0,0|1,0,1]=4 9235 B12R1.69 C#CCOc1ccc(cc1I)C 7a_100000765521_100000038162 [0,2,0,0,0,0|1,0,1]=4 9236 B12R1.69 C#CCOc1ccc(cc1I)Cl 34a_100011356953_100000184674 [0,2,0,0,0,0|1,0,1]=4 9237 B12R1.69 C#CCOc1ccc(cc1I)Cl 7a_100011356953_100000038162 [0,2,0,0,0,0|1,0,1]=4 9238 B12R1.69 C#CCOc1ccc(cc1I)F 34a_100012355409_100000184674 [0,2,0,0,0,0|1,0,1]=4 9239 B12R1.69 C#CCOc1ccc(cc1I)F 7a_100012355409_100000038162 [0,2,0,0,0,0|1,0,1]=4 9240 B12R1.69 C#CCOc1ccc(cc1I)I 7a_100010001573_100000038162 [0,2,0,0,0,0|1,0,1]=4 9241 B12R1.69 C#CCOc1ccc(cc1N)Br 34a_100000752626_100000184674 [0,2,0,0,0,0|1,0,1]=4 9242 B12R1.69 C#CCOc1ccc(cc1N)Br 7a_100000752626_100000038162 [0,2,0,0,0,0|1,0,1]=4 9243 B12R1.69 C#CCOc1ccc(cc1N)C 34a_100011215204_100000184674 [0,2,0,0,0,0|1,0,1]=4 9244 B12R1.69 C#CCOc1ccc(cc1N)C 7a_100011215204_100000038162 [0,2,0,0,0,0|1,0,1]=4 9245 B12R1.69 C#CCOc1ccc(cc1N)Cl 34a_100000210500_100000184674 [0,2,0,0,0,0|1,0,1]=4 9246 B12R1.69 C#CCOc1ccc(cc1N)Cl 7a_100000210500_100000038162 [0,2,0,0,0,0|1,0,1]=4 9247 B12R1.69 C#CCOc1ccc(cc1N)F 34a_100000759472_100000184674 [0,2,0,0,0,0|1,0,1]=4 9248 B12R1.69 C#CCOc1ccc(cc1N)F 7a_100000759472_100000038162 [0,2,0,0,0,0|1,0,1]=4 9249 B12R1.69 C#CCOc1ccc(cc1N)I 34a_100000753495_100000184674 [0,2,0,0,0,0|1,0,1]=4 9250 B12R1.69 C#CCOc1ccc(cc1N)I 7a_100000753495_100000038162 [0,2,0,0,0,0|1,0,1]=4 9251 B12R1.69 C#CCOc1ccc(cc1N)N 34a_100000725306_100000184674 [0,2,0,0,0,0|1,0,1]=4 9252 B12R1.69 C#CCSc1ccc(cc1Br)O 62a_100000038162_100000701344 [0,2,0,0,0,0|0,1,1]=4 9253 B12R1.69 C#CCSc1ccc(cc1C)O 62a_100000038162_100000690111 [0,2,0,0,0,0|0,1,1]=4 9254 B12R1.69 C#CCSc1ccc(cc1Cl)O 62a_100000038162_100000047559 [0,2,0,0,0,0|0,1,1]=4 9255 B12R1.69 C#CCSc1ccc(cc1F)O 62a_100000038162_100000755031 [0,2,0,0,0,0|0,1,1]=4 9256 B12R1.69 C#CCSc1ccc(cc1N)O 62a_100000038162_100011999798 [0,2,0,0,0,0|0,1,1]=4 9257 B12R1.69 C#CCSc1ccc(cc1O)O 62a_100000038162_100009813921 [0,2,0,0,0,0|0,1,1]=4 9258 B12R1.69 C=CCNc1ccc(cc1Br)O 34a_100012001276_100015514636 [0,2,0,0,0,0|1,0,1]=4 9259 B12R1.69 C=CCNc1ccc(cc1C)O 34a_100000756630_100015514636 [0,2,0,0,0,0|1,0,1]=4 9260 B12R1.69 C=CCNc1ccc(cc1Cl)O 34a_100011215599_100015514636 [0,2,0,0,0,0|1,0,1]=4 9261 B12R1.69 C=CCNc1ccc(cc1F)O 34a_100000759473_100015514636 [0,2,0,0,0,0|1,0,1]=4 9262 B12R1.69 C=CCNc1ccc(cc1I)O 34a_100010084370_100015514636 [0,2,0,0,0,0|1,0,1]=4 9263 B12R1.69 C=CCNc1ccc(cc1O)O 34a_100000106777_100015514636 [0,2,0,0,0,0|1,0,1]=4 9264 B12R1.69 C=CCOc1ccc(cc1Br)Br 34a_100000188717_100015514636 [0,2,0,0,0,0|1,0,1]=4 9265 B12R1.69 C=CCOc1ccc(cc1Br)Br 7a_100000188717_100015514636 [0,2,0,0,0,0|1,0,1]=4 9266 B12R1.69 C=CCOc1ccc(cc1Br)C 34a_100000210800_100015514636 [0,2,0,0,0,0|1,0,1]=4 9267 B12R1.69 C=CCOc1ccc(cc1Br)C 7a_100000210800_100015514636 [0,2,0,0,0,0|1,0,1]=4 9268 B12R1.69 C=CCOc1ccc(cc1Br)Cl 34a_100000211998_100015514636 [0,2,0,0,0,0|1,0,1]=4 9269 B12R1.69 C=CCOc1ccc(cc1Br)Cl 7a_100000211998_100015514636 [0,2,0,0,0,0|1,0,1]=4 9270 B12R1.69 C=CCOc1ccc(cc1Br)F 34a_100000211999_100015514636 [0,2,0,0,0,0|1,0,1]=4 9271 B12R1.69 C=CCOc1ccc(cc1Br)F 7a_100000211999_100015514636 [0,2,0,0,0,0|1,0,1]=4 9272 B12R1.69 C=CCOc1ccc(cc1Br)I 34a_100012361655_100015514636 [0,2,0,0,0,0|1,0,1]=4 9273 B12R1.69 C=CCOc1ccc(cc1Br)I 7a_100012361655_100015514636 [0,2,0,0,0,0|1,0,1]=4 9274 B12R1.69 C=CCOc1ccc(cc1Br)N 34a_100011534360_100015514636 [0,2,0,0,0,0|1,0,1]=4 9275 B12R1.69 C=CCOc1ccc(cc1Br)N 7a_100011534360_100015514636 [0,2,0,0,0,0|1,0,1]=4 9276 B12R1.69 C=CCOc1ccc(cc1C)Br 34a_100000186361_100015514636 [0,2,0,0,0,0|1,0,1]=4 9277 B12R1.69 C=CCOc1ccc(cc1C)Br 7a_100000186361_100015514636 [0,2,0,0,0,0|1,0,1]=4 9278 B12R1.69 C=CCOc1ccc(cc1C)C 34a_100000211776_100015514636 [0,2,0,0,0,0|1,0,1]=4 9279 B12R1.69 C=CCOc1ccc(cc1C)C 7a_100000211776_100015514636 [0,2,0,0,0,0|1,0,1]=4 9280 B12R1.69 C=CCOc1ccc(cc1C)Cl 34a_100000211091_100015514636 [0,2,0,0,0,0|1,0,1]=4 9281 B12R1.69 C=CCOc1ccc(cc1C)Cl 7a_100000211091_100015514636 [0,2,0,0,0,0|1,0,1]=4 9282 B12R1.69 C=CCOc1ccc(cc1C)F 34a_100000764316_100015514636 [0,2,0,0,0,0|1,0,1]=4 9283 B12R1.69 C=CCOc1ccc(cc1C)F 7a_100000764316_100015514636 [0,2,0,0,0,0|1,0,1]=4 9284 B12R1.69 C=CCOc1ccc(cc1C)I 34a_100011218673_100015514636 [0,2,0,0,0,0|1,0,1]=4 9285 B12R1.69 C=CCOc1ccc(cc1C)I 7a_100011218673_100015514636 [0,2,0,0,0,0|1,0,1]=4 9286 B12R1.69 C=CCOc1ccc(cc1C)N 34a_100011218179_100015514636 [0,2,0,0,0,0|1,0,1]=4 9287 B12R1.69 C=CCOc1ccc(cc1C)N 7a_100011218179_100015514636 [0,2,0,0,0,0|1,0,1]=4 9288 B12R1.69 C=CCOc1ccc(cc1Cl)Br 34a_100000186472_100015514636 [0,2,0,0,0,0|1,0,1]=4 9289 B12R1.69 C=CCOc1ccc(cc1Cl)Br 7a_100000186472_100015514636 [0,2,0,0,0,0|1,0,1]=4 9290 B12R1.69 C=CCOc1ccc(cc1Cl)C 34a_100000749699_100015514636 [0,2,0,0,0,0|1,0,1]=4 9291 B12R1.69 C=CCOc1ccc(cc1Cl)C 7a_100000749699_100015514636 [0,2,0,0,0,0|1,0,1]=4 9292 B12R1.69 C=CCOc1ccc(cc1Cl)Cl 34a_100015191787_100015514636 [0,2,0,0,0,0|1,0,1]=4 9293 B12R1.69 C=CCOc1ccc(cc1Cl)Cl 7a_100015191787_100015514636 [0,2,0,0,0,0|1,0,1]=4 9294 B12R1.69 C=CCOc1ccc(cc1Cl)F 34a_100000212004_100015514636 [0,2,0,0,0,0|1,0,1]=4 9295 B12R1.69 C=CCOc1ccc(cc1Cl)F 7a_100000212004_100015514636 [0,2,0,0,0,0|1,0,1]=4 9296 B12R1.69 C=CCOc1ccc(cc1Cl)I 34a_100012360047_100015514636 [0,2,0,0,0,0|1,0,1]=4 9297 B12R1.69 C=CCOc1ccc(cc1Cl)I 7a_100012360047_100015514636 [0,2,0,0,0,0|1,0,1]=4 9298 B12R1.69 C=CCOc1ccc(cc1Cl)N 34a_100000744943_100015514636 [0,2,0,0,0,0|1,0,1]=4 9299 B12R1.69 C=CCOc1ccc(cc1Cl)N 7a_100000744943_100015514636 [0,2,0,0,0,0|1,0,1]=4 9300 B12R1.69 C=CCOc1ccc(cc1F)Br 34a_100000185481_100015514636 [0,2,0,0,0,0|1,0,1]=4 9301 B12R1.69 C=CCOc1ccc(cc1F)Br 7a_100000185481_100015514636 [0,2,0,0,0,0|1,0,1]=4 9302 B12R1.69 C=CCOc1ccc(cc1F)C 34a_100011216688_100015514636 [0,2,0,0,0,0|1,0,1]=4 9303 B12R1.69 C=CCOc1ccc(cc1F)C 7a_100011216688_100015514636 [0,2,0,0,0,0|1,0,1]=4 9304 B12R1.69 C=CCOc1ccc(cc1F)Cl 34a_100000230166_100015514636 [0,2,0,0,0,0|1,0,1]=4 9305 B12R1.69 C=CCOc1ccc(cc1F)Cl 7a_100000230166_100015514636 [0,2,0,0,0,0|1,0,1]=4 9306 B12R1.69 C=CCOc1ccc(cc1F)F 34a_100000230127_100015514636 [0,2,0,0,0,0|1,0,1]=4 9307 B12R1.69 C=CCOc1ccc(cc1F)F 7a_100000230127_100015514636 [0,2,0,0,0,0|1,0,1]=4 9308 B12R1.69 C=CCOc1ccc(cc1F)I 34a_100011356965_100015514636 [0,2,0,0,0,0|1,0,1]=4 9309 B12R1.69 C=CCOc1ccc(cc1F)I 7a_100011356965_100015514636 [0,2,0,0,0,0|1,0,1]=4 9310 B12R1.69 C=CCOc1ccc(cc1F)N 34a_100011220035_100015514636 [0,2,0,0,0,0|1,0,1]=4 9311 B12R1.69 C=CCOc1ccc(cc1F)N 7a_100011220035_100015514636 [0,2,0,0,0,0|1,0,1]=4 9312 B12R1.69 C=CCOc1ccc(cc1I)Br 34a_100012355227_100015514636 [0,2,0,0,0,0|1,0,1]=4 9313 B12R1.69 C=CCOc1ccc(cc1I)Br 7a_100012355227_100015514636 [0,2,0,0,0,0|1,0,1]=4 9314 B12R1.69 C=CCOc1ccc(cc1I)C 34a_100000765521_100015514636 [0,2,0,0,0,0|1,0,1]=4 9315 B12R1.69 C=CCOc1ccc(cc1I)C 7a_100000765521_100015514636 [0,2,0,0,0,0|1,0,1]=4 9316 B12R1.69 C=CCOc1ccc(cc1I)Cl 34a_100011356953_100015514636 [0,2,0,0,0,0|1,0,1]=4 9317 B12R1.69 C=CCOc1ccc(cc1I)Cl 7a_100011356953_100015514636 [0,2,0,0,0,0|1,0,1]=4 9318 B12R1.69 C=CCOc1ccc(cc1I)F 34a_100012355409_100015514636 [0,2,0,0,0,0|1,0,1]=4 9319 B12R1.69 C=CCOc1ccc(cc1I)F 7a_100012355409_100015514636 [0,2,0,0,0,0|1,0,1]=4 9320 B12R1.69 C=CCOc1ccc(cc1I)I 7a_100010001573_100015514636 [0,2,0,0,0,0|1,0,1]=4 9321 B12R1.69 C=CCOc1ccc(cc1N)Br 34a_100000752626_100015514636 [0,2,0,0,0,0|1,0,1]=4 9322 B12R1.69 C=CCOc1ccc(cc1N)Br 7a_100000752626_100015514636 [0,2,0,0,0,0|1,0,1]=4 9323 B12R1.69 C=CCOc1ccc(cc1N)C 34a_100011215204_100015514636 [0,2,0,0,0,0|1,0,1]=4 9324 B12R1.69 C=CCOc1ccc(cc1N)C 7a_100011215204_100015514636 [0,2,0,0,0,0|1,0,1]=4 9325 B12R1.69 C=CCOc1ccc(cc1N)Cl 34a_100000210500_100015514636 [0,2,0,0,0,0|1,0,1]=4 9326 B12R1.69 C=CCOc1ccc(cc1N)Cl 7a_100000210500_100015514636 [0,2,0,0,0,0|1,0,1]=4 9327 B12R1.69 C=CCOc1ccc(cc1N)F 34a_100000759472_100015514636 [0,2,0,0,0,0|1,0,1]=4 9328 B12R1.69 C=CCOc1ccc(cc1N)F 7a_100000759472_100015514636 [0,2,0,0,0,0|1,0,1]=4 9329 B12R1.69 C=CCOc1ccc(cc1N)I 34a_100000753495_100015514636 [0,2,0,0,0,0|1,0,1]=4 9330 B12R1.69 C=CCOc1ccc(cc1N)I 7a_100000753495_100015514636 [0,2,0,0,0,0|1,0,1]=4 9331 B12R1.69 C=CCOc1ccc(cc1N)N 34a_100000725306_100015514636 [0,2,0,0,0,0|1,0,1]=4 9332 B12R1.69 C=CCSc1ccc(cc1Br)O 62a_100000210623_100000701344 [0,2,0,0,0,0|0,1,1]=4 9333 B12R1.69 C=CCSc1ccc(cc1Br)O 62a_100000701344_100000210623 [0,2,0,0,0,0|0,1,1]=4 9334 B12R1.69 C=CCSc1ccc(cc1C)O 62a_100000210623_100000690111 [0,2,0,0,0,0|0,1,1]=4 9335 B12R1.69 C=CCSc1ccc(cc1Cl)O 62a_100000047559_100000210623 [0,2,0,0,0,0|0,1,1]=4 9336 B12R1.69 C=CCSc1ccc(cc1Cl)O 62a_100000210623_100000047559 [0,2,0,0,0,0|0,1,1]=4 9337 B12R1.69 C=CCSc1ccc(cc1F)O 62a_100000210623_100000755031 [0,2,0,0,0,0|0,1,1]=4 9338 B12R1.69 C=CCSc1ccc(cc1F)O 62a_100000755031_100000210623 [0,2,0,0,0,0|0,1,1]=4 9339 B12R1.69 C=CCSc1ccc(cc1N)O 62a_100000210623_100011999798 [0,2,0,0,0,0|0,1,1]=4 9340 B12R1.69 C=CCSc1ccc(cc1N)O 62a_100011999798_100000210623 [0,2,0,0,0,0|0,1,1]=4 9341 B12R1.69 C=CCSc1ccc(cc1O)O 62a_100000210623_100009813921 [0,2,0,0,0,0|0,1,1]=4 9342 B12R1.69 CCCCc1ccc(cc1Br)Br 271570a_100020621405_100011484698 [0,2,0,0,0,0|2,0,0]=4 9343 B12R1.69 CCCCc1ccc(cc1Br)C 271570a_100020621405_100009813563 [0,2,0,0,0,0|2,0,0]=4 9344 B12R1.69 CCCCc1ccc(cc1Br)Cl 271570a_100020621405_100011219703 [0,2,0,0,0,0|2,0,0]=4 9345 B12R1.69 CCCCc1ccc(cc1Br)F 271570a_100020621405_100011217111 [0,2,0,0,0,0|2,0,0]=4 9346 B12R1.69 CCCCc1ccc(cc1Br)N 271570a_100020621405_100000750458 [0,2,0,0,0,0|2,0,0]=4 9347 B12R1.69 CCCCc1ccc(cc1Br)O 271570a_100020621405_100000701344 [0,2,0,0,0,0|1,0,0]=3 9348 B12R1.69 CCCCc1ccc(cc1C)Br 271570a_100020621405_100000701812 [0,2,0,0,0,0|2,0,0]=4 9349 B12R1.69 CCCCc1ccc(cc1C)C 271570a_100020621405_100011217332 [0,2,0,0,0,0|2,0,0]=4 9350 B12R1.69 CCCCc1ccc(cc1C)Cl 271570a_100020621405_100011219607 [0,2,0,0,0,0|2,0,0]=4 9351 B12R1.69 CCCCc1ccc(cc1C)F 271570a_100020621405_100011205405 [0,2,0,0,0,0|2,0,0]=4 9352 B12R1.69 CCCCc1ccc(cc1C)N 271570a_100020621405_100000210723 [0,2,0,0,0,0|2,0,0]=4 9353 B12R1.69 CCCCc1ccc(cc1C)O 271570a_100020621405_100000729255 [0,2,0,0,0,0|1,0,0]=3 9354 B12R1.69 CCCCc1ccc(cc1Cl)Br 271570a_100020621405_100011216062 [0,2,0,0,0,0|2,0,0]=4 9355 B12R1.69 CCCCc1ccc(cc1Cl)C 271570a_100020621405_100011263221 [0,2,0,0,0,0|2,0,0]=4 9356 B12R1.69 CCCCc1ccc(cc1Cl)Cl 271570a_100020621405_100000699841 [0,2,0,0,0,0|2,0,0]=4 9357 B12R1.69 CCCCc1ccc(cc1Cl)F 271570a_100020621405_100000733362 [0,2,0,0,0,0|2,0,0]=4 9358 B12R1.69 CCCCc1ccc(cc1Cl)N 271570a_100020621405_100000761885 [0,2,0,0,0,0|2,0,0]=4 9359 B12R1.69 CCCCc1ccc(cc1Cl)O 271570a_100020621405_100000047559 [0,2,0,0,0,0|1,0,0]=3 9360 B12R1.69 CCCCc1ccc(cc1F)Br 271570a_100020621405_100009814013 [0,2,0,0,0,0|2,0,0]=4 9361 B12R1.69 CCCCc1ccc(cc1F)C 271570a_100020621405_100011216119 [0,2,0,0,0,0|2,0,0]=4 9362 B12R1.69 CCCCc1ccc(cc1F)Cl 271570a_100020621405_100011216042 [0,2,0,0,0,0|2,0,0]=4 9363 B12R1.69 CCCCc1ccc(cc1F)F 271570a_100020621405_100000750030 [0,2,0,0,0,0|2,0,0]=4 9364 B12R1.69 CCCCc1ccc(cc1F)N 271570a_100020621405_100011356925 [0,2,0,0,0,0|2,0,0]=4 9365 B12R1.69 CCCCc1ccc(cc1F)O 271570a_100020621405_100000755031 [0,2,0,0,0,0|1,0,0]=3 9366 B12R1.69 CCCCc1ccc(cc1N)Br 271570a_100020621405_100000743836 [0,2,0,0,0,0|2,0,0]=4 9367 B12R1.69 CCCCc1ccc(cc1N)C 271570a_100020621405_100011216686 [0,2,0,0,0,0|2,0,0]=4 9368 B12R1.69 CCCCc1ccc(cc1N)Cl 271570a_100020621405_100000761886 [0,2,0,0,0,0|2,0,0]=4 9369 B12R1.69 CCCCc1ccc(cc1N)F 271570a_100020621405_100011218093 [0,2,0,0,0,0|2,0,0]=4 9370 B12R1.69 CCCCc1ccc(cc1N)N 271570a_100020621405_200012175722 [0,2,0,0,0,0|2,0,0]=4 9371 B12R1.69 CCCCc1ccc(cc1N)O 271570a_100020621405_100011999798 [0,2,0,0,0,0|1,0,0]=3 9372 B12R1.69 CCCCc1ccc(cc1O)Br 271570a_100020621405_100012344904 [0,2,0,0,0,0|2,0,0]=4 9373 B12R1.69 CCCCc1ccc(cc1O)C 271570a_100020621405_100012002257 [0,2,0,0,0,0|2,0,0]=4 9374 B12R1.69 CCCCc1ccc(cc1O)Cl 271570a_100020621405_100000050036 [0,2,0,0,0,0|2,0,0]=4 9375 B12R1.69 CCCCc1ccc(cc1O)F 271570a_100020621405_100000690578 [0,2,0,0,0,0|2,0,0]=4 9376 B12R1.69 CCCCc1ccc(cc1O)O 271570a_100020621405_100009813921 [0,2,0,0,0,0|1,0,0]=3 9377 B12R1.69 CCCCc1ccc(nc1C)O 271570a_100020621405_100000691680 [0,2,0,0,0,0|2,0,0]=4 9378 B12R1.69 CCCCc1ccc(nc1F)O 271570a_100020621405_100009879308 [0,2,0,0,0,0|2,0,0]=4 9379 B12R1.69 CCCCc1cnc(cc1C)O 271570a_100020621405_100010114363 [0,2,0,0,0,0|2,0,0]=4 9380 B12R1.69 CCCCc1ncc(cc1C)O 271570a_100020621405_100012000486 [0,2,0,0,0,0|2,0,0]=4 9381 B12R1.69 CCCCc1ncc(cc1F)O 271570a_100020621405_100000063512 [0,2,0,0,0,0|2,0,0]=4 9382 B12R1.69 CCCNc1ccc(cc1Br)Br 34a_100000211012_100000210303 [0,2,0,0,0,0|2,0,0]=4 9383 B12R1.69 CCCNc1ccc(cc1Br)C 34a_100000210942_100000210303 [0,2,0,0,0,0|2,0,0]=4 9384 B12R1.69 CCCNc1ccc(cc1Br)Cl 34a_100000752454_100000210303 [0,2,0,0,0,0|2,0,0]=4 9385 B12R1.69 CCCNc1ccc(cc1Br)F 34a_100000738039_100000210303 [0,2,0,0,0,0|2,0,0]=4 9386 B12R1.69 CCCNc1ccc(cc1Br)O 34a_100012001276_100000210303 [0,2,0,0,0,0|1,0,0]=3 9387 B12R1.69 CCCNc1ccc(cc1C)Br 34a_100000211769_100000210303 [0,2,0,0,0,0|2,0,0]=4 9388 B12R1.69 CCCNc1ccc(cc1C)Br 7a_100000211769_100000210303 [0,2,0,0,0,0|2,0,0]=4 9389 B12R1.69 CCCNc1ccc(cc1C)C 34a_100000736561_100000210303 [0,2,0,0,0,0|2,0,0]=4 9390 B12R1.69 CCCNc1ccc(cc1C)C 7a_100000736561_100000210303 [0,2,0,0,0,0|2,0,0]=4 9391 B12R1.69 CCCNc1ccc(cc1C)Cl 34a_100000210418_100000210303 [0,2,0,0,0,0|2,0,0]=4 9392 B12R1.69 CCCNc1ccc(cc1C)Cl 7a_100000210418_100000210303 [0,2,0,0,0,0|2,0,0]=4 9393 B12R1.69 CCCNc1ccc(cc1C)F 34a_100000211637_100000210303 [0,2,0,0,0,0|2,0,0]=4 9394 B12R1.69 CCCNc1ccc(cc1C)F 7a_100000211637_100000210303 [0,2,0,0,0,0|2,0,0]=4 9395 B12R1.69 CCCNc1ccc(cc1C)I 34a_100000184554_100000210303 [0,2,0,0,0,0|2,0,0]=4 9396 B12R1.69 CCCNc1ccc(cc1C)I 7a_100000184554_100000210303 [0,2,0,0,0,0|2,0,0]=4 9397 B12R1.69 CCCNc1ccc(cc1C)O 34a_100000756630_100000210303 [0,2,0,0,0,0|1,0,0]=3 9398 B12R1.69 CCCNc1ccc(cc1Cl)Br 34a_100000211467_100000210303 [0,2,0,0,0,0|2,0,0]=4 9399 B12R1.69 CCCNc1ccc(cc1Cl)C 34a_100000210522_100000210303 [0,2,0,0,0,0|2,0,0]=4 9400 B12R1.69 CCCNc1ccc(cc1Cl)Cl 34a_100000185861_100000210303 [0,2,0,0,0,0|2,0,0]=4 9401 B12R1.69 CCCNc1ccc(cc1Cl)F 34a_100000212003_100000210303 [0,2,0,0,0,0|2,0,0]=4 9402 B12R1.69 CCCNc1ccc(cc1Cl)I 34a_100011218065_100000210303 [0,2,0,0,0,0|2,0,0]=4 9403 B12R1.69 CCCNc1ccc(cc1Cl)O 34a_100011215599_100000210303 [0,2,0,0,0,0|1,0,0]=3 9404 B12R1.69 CCCNc1ccc(cc1F)Br 34a_100000210722_100000210303 [0,2,0,0,0,0|2,0,0]=4 9405 B12R1.69 CCCNc1ccc(cc1F)C 34a_100000211023_100000210303 [0,2,0,0,0,0|2,0,0]=4 9406 B12R1.69 CCCNc1ccc(cc1F)Cl 34a_100000211020_100000210303 [0,2,0,0,0,0|2,0,0]=4 9407 B12R1.69 CCCNc1ccc(cc1F)F 34a_100000210720_100000210303 [0,2,0,0,0,0|2,0,0]=4 9408 B12R1.69 CCCNc1ccc(cc1F)I 34a_100011215594_100000210303 [0,2,0,0,0,0|2,0,0]=4 9409 B12R1.69 CCCNc1ccc(cc1F)O 34a_100000759473_100000210303 [0,2,0,0,0,0|1,0,0]=3 9410 B12R1.69 CCCNc1ccc(cc1I)Br 34a_100000187925_100000210303 [0,2,0,0,0,0|2,0,0]=4 9411 B12R1.69 CCCNc1ccc(cc1I)C 34a_100011356834_100000210303 [0,2,0,0,0,0|2,0,0]=4 9412 B12R1.69 CCCNc1ccc(cc1I)Cl 34a_100000761889_100000210303 [0,2,0,0,0,0|2,0,0]=4 9413 B12R1.69 CCCNc1ccc(cc1I)F 34a_100000760547_100000210303 [0,2,0,0,0,0|2,0,0]=4 9414 B12R1.69 CCCNc1ccc(cc1I)O 34a_100010084370_100000210303 [0,2,0,0,0,0|1,0,0]=3 9415 B12R1.69 CCCNc1ccc(cc1O)Br 34a_100000739049_100000210303 [0,2,0,0,0,0|2,0,0]=4 9416 B12R1.69 CCCNc1ccc(cc1O)C 34a_100000211527_100000210303 [0,2,0,0,0,0|2,0,0]=4 9417 B12R1.69 CCCNc1ccc(cc1O)Cl 34a_100000185728_100000210303 [0,2,0,0,0,0|2,0,0]=4 9418 B12R1.69 CCCNc1ccc(cc1O)F 34a_100000753323_100000210303 [0,2,0,0,0,0|2,0,0]=4 9419 B12R1.69 CCCNc1ccc(cc1O)O 34a_100000106777_100000210303 [0,2,0,0,0,0|1,0,0]=3 9420 B12R1.69 CCCOc1ccc(cc1Br)Br 34a_100000188717_100000210303 [0,2,0,0,0,0|1,0,0]=3 9421 B12R1.69 CCCOc1ccc(cc1Br)Br 7a_100000188717_100000210303 [0,2,0,0,0,0|1,0,0]=3 9422 B12R1.69 CCCOc1ccc(cc1Br)C 34a_100000210800_100000210303 [0,2,0,0,0,0|1,0,0]=3 9423 B12R1.69 CCCOc1ccc(cc1Br)C 7a_100000210800_100000210303 [0,2,0,0,0,0|1,0,0]=3 9424 B12R1.69 CCCOc1ccc(cc1Br)Cl 34a_100000211998_100000210303 [0,2,0,0,0,0|1,0,0]=3 9425 B12R1.69 CCCOc1ccc(cc1Br)Cl 7a_100000211998_100000210303 [0,2,0,0,0,0|1,0,0]=3 9426 B12R1.69 CCCOc1ccc(cc1Br)F 34a_100000211999_100000210303 [0,2,0,0,0,0|1,0,0]=3 9427 B12R1.69 CCCOc1ccc(cc1Br)F 7a_100000211999_100000210303 [0,2,0,0,0,0|1,0,0]=3 9428 B12R1.69 CCCOc1ccc(cc1Br)I 34a_100012361655_100000210303 [0,2,0,0,0,0|1,0,0]=3 9429 B12R1.69 CCCOc1ccc(cc1Br)I 7a_100012361655_100000210303 [0,2,0,0,0,0|1,0,0]=3 9430 B12R1.69 CCCOc1ccc(cc1Br)N 34a_100011534360_100000210303 [0,2,0,0,0,0|1,0,0]=3 9431 B12R1.69 CCCOc1ccc(cc1Br)N 7a_100011534360_100000210303 [0,2,0,0,0,0|1,0,0]=3 9432 B12R1.69 CCCOc1ccc(cc1C)Br 34a_100000186361_100000210303 [0,2,0,0,0,0|1,0,0]=3 9433 B12R1.69 CCCOc1ccc(cc1C)Br 7a_100000186361_100000210303 [0,2,0,0,0,0|1,0,0]=3 9434 B12R1.69 CCCOc1ccc(cc1C)C 34a_100000211776_100000210303 [0,2,0,0,0,0|1,0,0]=3 9435 B12R1.69 CCCOc1ccc(cc1C)C 7a_100000211776_100000210303 [0,2,0,0,0,0|1,0,0]=3 9436 B12R1.69 CCCOc1ccc(cc1C)Cl 34a_100000211091_100000210303 [0,2,0,0,0,0|1,0,0]=3 9437 B12R1.69 CCCOc1ccc(cc1C)Cl 7a_100000211091_100000210303 [0,2,0,0,0,0|1,0,0]=3 9438 B12R1.69 CCCOc1ccc(cc1C)F 34a_100000764316_100000210303 [0,2,0,0,0,0|1,0,0]=3 9439 B12R1.69 CCCOc1ccc(cc1C)F 7a_100000764316_100000210303 [0,2,0,0,0,0|1,0,0]=3 9440 B12R1.69 CCCOc1ccc(cc1C)I 34a_100011218673_100000210303 [0,2,0,0,0,0|1,0,0]=3 9441 B12R1.69 CCCOc1ccc(cc1C)I 7a_100011218673_100000210303 [0,2,0,0,0,0|1,0,0]=3 9442 B12R1.69 CCCOc1ccc(cc1C)N 34a_100011218179_100000210303 [0,2,0,0,0,0|1,0,0]=3 9443 B12R1.69 CCCOc1ccc(cc1C)N 7a_100011218179_100000210303 [0,2,0,0,0,0|1,0,0]=3 9444 B12R1.69 CCCOc1ccc(cc1Cl)Br 34a_100000186472_100000210303 [0,2,0,0,0,0|1,0,0]=3 9445 B12R1.69 CCCOc1ccc(cc1Cl)Br 7a_100000186472_100000210303 [0,2,0,0,0,0|1,0,0]=3 9446 B12R1.69 CCCOc1ccc(cc1Cl)C 34a_100000749699_100000210303 [0,2,0,0,0,0|1,0,0]=3 9447 B12R1.69 CCCOc1ccc(cc1Cl)C 7a_100000749699_100000210303 [0,2,0,0,0,0|1,0,0]=3 9448 B12R1.69 CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000210303 [0,2,0,0,0,0|1,0,0]=3 9449 B12R1.69 CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000210303 [0,2,0,0,0,0|1,0,0]=3 9450 B12R1.69 CCCOc1ccc(cc1Cl)F 34a_100000212004_100000210303 [0,2,0,0,0,0|1,0,0]=3 9451 B12R1.69 CCCOc1ccc(cc1Cl)F 7a_100000212004_100000210303 [0,2,0,0,0,0|1,0,0]=3 9452 B12R1.69 CCCOc1ccc(cc1Cl)I 34a_100012360047_100000210303 [0,2,0,0,0,0|1,0,0]=3 9453 B12R1.69 CCCOc1ccc(cc1Cl)I 7a_100012360047_100000210303 [0,2,0,0,0,0|1,0,0]=3 9454 B12R1.69 CCCOc1ccc(cc1Cl)N 34a_100000744943_100000210303 [0,2,0,0,0,0|1,0,0]=3 9455 B12R1.69 CCCOc1ccc(cc1Cl)N 7a_100000744943_100000210303 [0,2,0,0,0,0|1,0,0]=3 9456 B12R1.69 CCCOc1ccc(cc1F)Br 34a_100000185481_100000210303 [0,2,0,0,0,0|1,0,0]=3 9457 B12R1.69 CCCOc1ccc(cc1F)Br 7a_100000185481_100000210303 [0,2,0,0,0,0|1,0,0]=3 9458 B12R1.69 CCCOc1ccc(cc1F)C 34a_100011216688_100000210303 [0,2,0,0,0,0|1,0,0]=3 9459 B12R1.69 CCCOc1ccc(cc1F)C 7a_100011216688_100000210303 [0,2,0,0,0,0|1,0,0]=3 9460 B12R1.69 CCCOc1ccc(cc1F)Cl 34a_100000230166_100000210303 [0,2,0,0,0,0|1,0,0]=3 9461 B12R1.69 CCCOc1ccc(cc1F)Cl 7a_100000230166_100000210303 [0,2,0,0,0,0|1,0,0]=3 9462 B12R1.69 CCCOc1ccc(cc1F)F 34a_100000230127_100000210303 [0,2,0,0,0,0|1,0,0]=3 9463 B12R1.69 CCCOc1ccc(cc1F)F 7a_100000230127_100000210303 [0,2,0,0,0,0|1,0,0]=3 9464 B12R1.69 CCCOc1ccc(cc1F)I 34a_100011356965_100000210303 [0,2,0,0,0,0|1,0,0]=3 9465 B12R1.69 CCCOc1ccc(cc1F)I 7a_100011356965_100000210303 [0,2,0,0,0,0|1,0,0]=3 9466 B12R1.69 CCCOc1ccc(cc1F)N 34a_100011220035_100000210303 [0,2,0,0,0,0|1,0,0]=3 9467 B12R1.69 CCCOc1ccc(cc1F)N 7a_100011220035_100000210303 [0,2,0,0,0,0|1,0,0]=3 9468 B12R1.69 CCCOc1ccc(cc1I)Br 34a_100012355227_100000210303 [0,2,0,0,0,0|1,0,0]=3 9469 B12R1.69 CCCOc1ccc(cc1I)Br 7a_100012355227_100000210303 [0,2,0,0,0,0|1,0,0]=3 9470 B12R1.69 CCCOc1ccc(cc1I)C 34a_100000765521_100000210303 [0,2,0,0,0,0|1,0,0]=3 9471 B12R1.69 CCCOc1ccc(cc1I)C 7a_100000765521_100000210303 [0,2,0,0,0,0|1,0,0]=3 9472 B12R1.69 CCCOc1ccc(cc1I)Cl 34a_100011356953_100000210303 [0,2,0,0,0,0|1,0,0]=3 9473 B12R1.69 CCCOc1ccc(cc1I)Cl 7a_100011356953_100000210303 [0,2,0,0,0,0|1,0,0]=3 9474 B12R1.69 CCCOc1ccc(cc1I)F 34a_100012355409_100000210303 [0,2,0,0,0,0|1,0,0]=3 9475 B12R1.69 CCCOc1ccc(cc1I)F 7a_100012355409_100000210303 [0,2,0,0,0,0|1,0,0]=3 9476 B12R1.69 CCCOc1ccc(cc1I)I 7a_100010001573_100000210303 [0,2,0,0,0,0|1,0,0]=3 9477 B12R1.69 CCCOc1ccc(cc1N)Br 34a_100000752626_100000210303 [0,2,0,0,0,0|1,0,0]=3 9478 B12R1.69 CCCOc1ccc(cc1N)Br 7a_100000752626_100000210303 [0,2,0,0,0,0|1,0,0]=3 9479 B12R1.69 CCCOc1ccc(cc1N)C 34a_100011215204_100000210303 [0,2,0,0,0,0|1,0,0]=3 9480 B12R1.69 CCCOc1ccc(cc1N)C 7a_100011215204_100000210303 [0,2,0,0,0,0|1,0,0]=3 9481 B12R1.69 CCCOc1ccc(cc1N)Cl 34a_100000210500_100000210303 [0,2,0,0,0,0|1,0,0]=3 9482 B12R1.69 CCCOc1ccc(cc1N)Cl 7a_100000210500_100000210303 [0,2,0,0,0,0|1,0,0]=3 9483 B12R1.69 CCCOc1ccc(cc1N)F 34a_100000759472_100000210303 [0,2,0,0,0,0|1,0,0]=3 9484 B12R1.69 CCCOc1ccc(cc1N)F 7a_100000759472_100000210303 [0,2,0,0,0,0|1,0,0]=3 9485 B12R1.69 CCCOc1ccc(cc1N)I 34a_100000753495_100000210303 [0,2,0,0,0,0|1,0,0]=3 9486 B12R1.69 CCCOc1ccc(cc1N)I 7a_100000753495_100000210303 [0,2,0,0,0,0|1,0,0]=3 9487 B12R1.69 CCCOc1ccc(cc1N)N 34a_100000725306_100000210303 [0,2,0,0,0,0|1,0,0]=3 9488 B12R1.69 CCCOc1ccc(cc1O)F 271570a_203496583355_200000171698 [0,2,0,0,0,0|1,0,0]=3 9489 B12R1.69 CCCOc1ccc(nc1Br)Br 34a_100009999766_100000210303 [0,2,0,0,0,0|2,0,0]=4 9490 B12R1.69 CCCOc1ccc(nc1Br)Br 7a_100009999766_100000210303 [0,2,0,0,0,0|2,0,0]=4 9491 B12R1.69 CCCOc1ccc(nc1Br)C 34a_100000702858_100000210303 [0,2,0,0,0,0|2,0,0]=4 9492 B12R1.69 CCCOc1ccc(nc1Br)C 7a_100000702858_100000210303 [0,2,0,0,0,0|2,0,0]=4 9493 B12R1.69 CCCOc1ccc(nc1Br)Cl 34a_100010219353_100000210303 [0,2,0,0,0,0|2,0,0]=4 9494 B12R1.69 CCCOc1ccc(nc1Br)Cl 7a_100010219353_100000210303 [0,2,0,0,0,0|2,0,0]=4 9495 B12R1.69 CCCOc1ccc(nc1Br)F 34a_100009887730_100000210303 [0,2,0,0,0,0|2,0,0]=4 9496 B12R1.69 CCCOc1ccc(nc1Br)F 7a_100009887730_100000210303 [0,2,0,0,0,0|2,0,0]=4 9497 B12R1.69 CCCOc1ccc(nc1Br)I 34a_100000725334_100000210303 [0,2,0,0,0,0|2,0,0]=4 9498 B12R1.69 CCCOc1ccc(nc1Br)I 7a_100000725334_100000210303 [0,2,0,0,0,0|2,0,0]=4 9499 B12R1.69 CCCOc1ccc(nc1C)Br 34a_100012002022_100000210303 [0,2,0,0,0,0|2,0,0]=4 9500 B12R1.69 CCCOc1ccc(nc1C)Br 7a_100012002022_100000210303 [0,2,0,0,0,0|2,0,0]=4 9501 B12R1.69 CCCOc1ccc(nc1C)C 34a_100011218912_100000210303 [0,2,0,0,0,0|2,0,0]=4 9502 B12R1.69 CCCOc1ccc(nc1C)C 7a_100011218912_100000210303 [0,2,0,0,0,0|2,0,0]=4 9503 B12R1.69 CCCOc1ccc(nc1C)Cl 34a_100012184626_100000210303 [0,2,0,0,0,0|2,0,0]=4 9504 B12R1.69 CCCOc1ccc(nc1C)Cl 7a_100012184626_100000210303 [0,2,0,0,0,0|2,0,0]=4 9505 B12R1.69 CCCOc1ccc(nc1C)F 34a_100009881036_100000210303 [0,2,0,0,0,0|2,0,0]=4 9506 B12R1.69 CCCOc1ccc(nc1C)F 7a_100009881036_100000210303 [0,2,0,0,0,0|2,0,0]=4 9507 B12R1.69 CCCOc1ccc(nc1C)I 34a_100010233687_100000210303 [0,2,0,0,0,0|2,0,0]=4 9508 B12R1.69 CCCOc1ccc(nc1C)I 7a_100010233687_100000210303 [0,2,0,0,0,0|2,0,0]=4 9509 B12R1.69 CCCOc1ccc(nc1Cl)Br 34a_100010246206_100000210303 [0,2,0,0,0,0|2,0,0]=4 9510 B12R1.69 CCCOc1ccc(nc1Cl)Br 7a_100010246206_100000210303 [0,2,0,0,0,0|2,0,0]=4 9511 B12R1.69 CCCOc1ccc(nc1Cl)C 34a_100000086286_100000210303 [0,2,0,0,0,0|2,0,0]=4 9512 B12R1.69 CCCOc1ccc(nc1Cl)C 7a_100000086286_100000210303 [0,2,0,0,0,0|2,0,0]=4 9513 B12R1.69 CCCOc1ccc(nc1Cl)Cl 34a_100000101165_100000210303 [0,2,0,0,0,0|2,0,0]=4 9514 B12R1.69 CCCOc1ccc(nc1Cl)Cl 7a_100000101165_100000210303 [0,2,0,0,0,0|2,0,0]=4 9515 B12R1.69 CCCOc1ccc(nc1Cl)I 34a_100000721234_100000210303 [0,2,0,0,0,0|2,0,0]=4 9516 B12R1.69 CCCOc1ccc(nc1Cl)I 7a_100000721234_100000210303 [0,2,0,0,0,0|2,0,0]=4 9517 B12R1.69 CCCOc1ccc(nc1F)Br 34a_100009819667_100000210303 [0,2,0,0,0,0|2,0,0]=4 9518 B12R1.69 CCCOc1ccc(nc1F)Br 7a_100009819667_100000210303 [0,2,0,0,0,0|2,0,0]=4 9519 B12R1.69 CCCOc1ccc(nc1F)C 34a_100000079963_100000210303 [0,2,0,0,0,0|2,0,0]=4 9520 B12R1.69 CCCOc1ccc(nc1F)C 7a_100000079963_100000210303 [0,2,0,0,0,0|2,0,0]=4 9521 B12R1.69 CCCOc1ccc(nc1F)Cl 34a_100009880201_100000210303 [0,2,0,0,0,0|2,0,0]=4 9522 B12R1.69 CCCOc1ccc(nc1F)Cl 7a_100009880201_100000210303 [0,2,0,0,0,0|2,0,0]=4 9523 B12R1.69 CCCOc1ccc(nc1F)F 34a_100000101184_100000210303 [0,2,0,0,0,0|2,0,0]=4 9524 B12R1.69 CCCOc1ccc(nc1F)F 7a_100000101184_100000210303 [0,2,0,0,0,0|2,0,0]=4 9525 B12R1.69 CCCOc1ccc(nc1I)Br 34a_100010253912_100000210303 [0,2,0,0,0,0|2,0,0]=4 9526 B12R1.69 CCCOc1ccc(nc1I)Br 7a_100010253912_100000210303 [0,2,0,0,0,0|2,0,0]=4 9527 B12R1.69 CCCOc1ccc(nc1I)C 34a_100000023897_100000210303 [0,2,0,0,0,0|2,0,0]=4 9528 B12R1.69 CCCOc1ccc(nc1I)C 7a_100000023897_100000210303 [0,2,0,0,0,0|2,0,0]=4 9529 B12R1.69 CCCOc1ccc(nc1I)Cl 34a_100000696390_100000210303 [0,2,0,0,0,0|2,0,0]=4 9530 B12R1.69 CCCOc1ccc(nc1I)Cl 7a_100000696390_100000210303 [0,2,0,0,0,0|2,0,0]=4 9531 B12R1.69 CCCOc1ccc(nc1I)F 34a_100010382442_100000210303 [0,2,0,0,0,0|2,0,0]=4 9532 B12R1.69 CCCOc1ccc(nc1I)F 7a_100010382442_100000210303 [0,2,0,0,0,0|2,0,0]=4 9533 B12R1.69 CCCOc1ccc(nc1N)Br 34a_100000685527_100000210303 [0,2,0,0,0,0|2,0,0]=4 9534 B12R1.69 CCCOc1ccc(nc1N)Br 7a_100000685527_100000210303 [0,2,0,0,0,0|2,0,0]=4 9535 B12R1.69 CCCOc1ccc(nc1N)C 34a_100000694039_100000210303 [0,2,0,0,0,0|2,0,0]=4 9536 B12R1.69 CCCOc1ccc(nc1N)C 7a_100000694039_100000210303 [0,2,0,0,0,0|2,0,0]=4 9537 B12R1.69 CCCOc1ccc(nc1N)Cl 34a_100000717809_100000210303 [0,2,0,0,0,0|2,0,0]=4 9538 B12R1.69 CCCOc1ccc(nc1N)Cl 7a_100000717809_100000210303 [0,2,0,0,0,0|2,0,0]=4 9539 B12R1.69 CCCOc1cnc(cc1Br)C 34a_100009843476_100000210303 [0,2,0,0,0,0|2,0,0]=4 9540 B12R1.69 CCCOc1cnc(cc1Br)C 7a_100009843476_100000210303 [0,2,0,0,0,0|2,0,0]=4 9541 B12R1.69 CCCOc1cnc(cc1C)C 34a_200000068632_100000210303 [0,2,0,0,0,0|2,0,0]=4 9542 B12R1.69 CCCOc1cnc(cc1C)C 7a_200000068632_100000210303 [0,2,0,0,0,0|2,0,0]=4 9543 B12R1.69 CCCOc1cnc(cc1C)Cl 34a_100000692680_100000210303 [0,2,0,0,0,0|2,0,0]=4 9544 B12R1.69 CCCOc1cnc(cc1C)Cl 7a_100000692680_100000210303 [0,2,0,0,0,0|2,0,0]=4 9545 B12R1.69 CCCOc1cnc(cc1C)F 34a_100009856773_100000210303 [0,2,0,0,0,0|2,0,0]=4 9546 B12R1.69 CCCOc1cnc(cc1C)F 7a_100009856773_100000210303 [0,2,0,0,0,0|2,0,0]=4 9547 B12R1.69 CCCOc1cnc(cc1Cl)Cl 34a_100009868576_100000210303 [0,2,0,0,0,0|2,0,0]=4 9548 B12R1.69 CCCOc1cnc(cc1Cl)Cl 7a_100009868576_100000210303 [0,2,0,0,0,0|2,0,0]=4 9549 B12R1.69 CCCOc1cnc(cc1F)F 34a_100009885687_100000210303 [0,2,0,0,0,0|2,0,0]=4 9550 B12R1.69 CCCOc1cnc(cc1F)F 7a_100009885687_100000210303 [0,2,0,0,0,0|2,0,0]=4 9551 B12R1.69 CCCOc1cnc(cc1I)Cl 34a_100000698892_100000210303 [0,2,0,0,0,0|2,0,0]=4 9552 B12R1.69 CCCOc1cnc(cc1I)Cl 7a_100000698892_100000210303 [0,2,0,0,0,0|2,0,0]=4 9553 B12R1.69 CCCOc1cnc(cc1N)Br 34a_100009819941_100000210303 [0,2,0,0,0,0|2,0,0]=4 9554 B12R1.69 CCCOc1cnc(cc1N)Br 7a_100009819941_100000210303 [0,2,0,0,0,0|2,0,0]=4 9555 B12R1.69 CCCOc1coc(cc1=O)C 34a_100000081520_100000210303 [0,2,0,0,0,0|2,0,0]=4 9556 B12R1.69 CCCOc1ncc(cc1Br)Br 34a_100000701035_100000210303 [0,2,0,0,0,0|2,0,0]=4 9557 B12R1.69 CCCOc1ncc(cc1Br)C 34a_100000719714_100000210303 [0,2,0,0,0,0|2,0,0]=4 9558 B12R1.69 CCCOc1ncc(cc1C)Br 34a_100000685391_100000210303 [0,2,0,0,0,0|2,0,0]=4 9559 B12R1.69 CCCOc1ncc(cc1C)O 271570a_203496583355_200012348856 [0,2,0,0,0,0|1,0,0]=3 9560 B12R1.69 CCCOc1ncc(cc1Cl)Br 34a_100012339560_100000210303 [0,2,0,0,0,0|2,0,0]=4 9561 B12R1.69 CCCOc1ncc(cc1Cl)F 34a_100009847679_100000210303 [0,2,0,0,0,0|2,0,0]=4 9562 B12R1.69 CCCOc1ncc(cc1F)Cl 34a_100011998252_100000210303 [0,2,0,0,0,0|2,0,0]=4 9563 B12R1.69 CCCOc1ncc(cc1F)F 34a_100012025737_100000210303 [0,2,0,0,0,0|2,0,0]=4 9564 B12R1.69 CCCOc1ncc(cc1N)Br 34a_100000743729_100000210303 [0,2,0,0,0,0|2,0,0]=4 9565 B12R1.69 CCCOc1ncc(cc1N)C 34a_100012000488_100000210303 [0,2,0,0,0,0|2,0,0]=4 9566 B12R1.69 CCCOc1ncc(cc1N)Cl 34a_100011998249_100000210303 [0,2,0,0,0,0|2,0,0]=4 9567 B12R1.69 CCCOc1ncc(cc1O)C 271570a_203496583355_100013847041 [0,2,0,0,0,0|2,0,0]=4 9568 B12R1.69 CCCSc1ccc(cc1Br)Br 62a_100000210303_100011484698 [0,2,0,0,0,0|1,1,0]=4 9569 B12R1.69 CCCSc1ccc(cc1Br)Br 62a_100011484698_100000210303 [0,2,0,0,0,0|1,1,0]=4 9570 B12R1.69 CCCSc1ccc(cc1Br)C 62a_100000210303_100009813563 [0,2,0,0,0,0|1,1,0]=4 9571 B12R1.69 CCCSc1ccc(cc1Br)C 62a_100009813563_100000210303 [0,2,0,0,0,0|1,1,0]=4 9572 B12R1.69 CCCSc1ccc(cc1Br)Cl 62a_100000210303_100011219703 [0,2,0,0,0,0|1,1,0]=4 9573 B12R1.69 CCCSc1ccc(cc1Br)Cl 62a_100011219703_100000210303 [0,2,0,0,0,0|1,1,0]=4 9574 B12R1.69 CCCSc1ccc(cc1Br)F 62a_100000210303_100011217111 [0,2,0,0,0,0|1,1,0]=4 9575 B12R1.69 CCCSc1ccc(cc1Br)F 62a_100011217111_100000210303 [0,2,0,0,0,0|1,1,0]=4 9576 B12R1.69 CCCSc1ccc(cc1Br)N 62a_100000210303_100000750458 [0,2,0,0,0,0|1,1,0]=4 9577 B12R1.69 CCCSc1ccc(cc1Br)N 62a_100000750458_100000210303 [0,2,0,0,0,0|1,1,0]=4 9578 B12R1.69 CCCSc1ccc(cc1Br)O 62a_100000210303_100000701344 [0,2,0,0,0,0|0,1,0]=3 9579 B12R1.69 CCCSc1ccc(cc1Br)O 62a_100000701344_100000210303 [0,2,0,0,0,0|0,1,0]=3 9580 B12R1.69 CCCSc1ccc(cc1C)Br 62a_100000210303_100000701812 [0,2,0,0,0,0|1,1,0]=4 9581 B12R1.69 CCCSc1ccc(cc1C)Br 62a_100000701812_100000210303 [0,2,0,0,0,0|1,1,0]=4 9582 B12R1.69 CCCSc1ccc(cc1C)C 62a_100000210303_100011217332 [0,2,0,0,0,0|1,1,0]=4 9583 B12R1.69 CCCSc1ccc(cc1C)C 62a_100011217332_100000210303 [0,2,0,0,0,0|1,1,0]=4 9584 B12R1.69 CCCSc1ccc(cc1C)Cl 62a_100000210303_100011219607 [0,2,0,0,0,0|1,1,0]=4 9585 B12R1.69 CCCSc1ccc(cc1C)Cl 62a_100011219607_100000210303 [0,2,0,0,0,0|1,1,0]=4 9586 B12R1.69 CCCSc1ccc(cc1C)F 62a_100000210303_100011205405 [0,2,0,0,0,0|1,1,0]=4 9587 B12R1.69 CCCSc1ccc(cc1C)F 62a_100011205405_100000210303 [0,2,0,0,0,0|1,1,0]=4 9588 B12R1.69 CCCSc1ccc(cc1C)N 62a_100000210303_100000210723 [0,2,0,0,0,0|1,1,0]=4 9589 B12R1.69 CCCSc1ccc(cc1C)N 62a_100000210723_100000210303 [0,2,0,0,0,0|1,1,0]=4 9590 B12R1.69 CCCSc1ccc(cc1C)O 62a_100000210303_100000690111 [0,2,0,0,0,0|0,1,0]=3 9591 B12R1.69 CCCSc1ccc(cc1Cl)Br 62a_100000210303_100011216062 [0,2,0,0,0,0|1,1,0]=4 9592 B12R1.69 CCCSc1ccc(cc1Cl)Br 62a_100011216062_100000210303 [0,2,0,0,0,0|1,1,0]=4 9593 B12R1.69 CCCSc1ccc(cc1Cl)C 62a_100000210303_100011263221 [0,2,0,0,0,0|1,1,0]=4 9594 B12R1.69 CCCSc1ccc(cc1Cl)C 62a_100011263221_100000210303 [0,2,0,0,0,0|1,1,0]=4 9595 B12R1.69 CCCSc1ccc(cc1Cl)Cl 62a_100000210303_100000699841 [0,2,0,0,0,0|1,1,0]=4 9596 B12R1.69 CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000210303 [0,2,0,0,0,0|1,1,0]=4 9597 B12R1.69 CCCSc1ccc(cc1Cl)F 62a_100000210303_100000733362 [0,2,0,0,0,0|1,1,0]=4 9598 B12R1.69 CCCSc1ccc(cc1Cl)F 62a_100000733362_100000210303 [0,2,0,0,0,0|1,1,0]=4 9599 B12R1.69 CCCSc1ccc(cc1Cl)N 62a_100000210303_100000761885 [0,2,0,0,0,0|1,1,0]=4 9600 B12R1.69 CCCSc1ccc(cc1Cl)N 62a_100000761885_100000210303 [0,2,0,0,0,0|1,1,0]=4 9601 B12R1.69 CCCSc1ccc(cc1Cl)O 62a_100000047559_100000210303 [0,2,0,0,0,0|0,1,0]=3 9602 B12R1.69 CCCSc1ccc(cc1Cl)O 62a_100000210303_100000047559 [0,2,0,0,0,0|0,1,0]=3 9603 B12R1.69 CCCSc1ccc(cc1F)Br 62a_100000210303_100009814013 [0,2,0,0,0,0|1,1,0]=4 9604 B12R1.69 CCCSc1ccc(cc1F)Br 62a_100009814013_100000210303 [0,2,0,0,0,0|1,1,0]=4 9605 B12R1.69 CCCSc1ccc(cc1F)C 62a_100000210303_100011216119 [0,2,0,0,0,0|1,1,0]=4 9606 B12R1.69 CCCSc1ccc(cc1F)C 62a_100011216119_100000210303 [0,2,0,0,0,0|1,1,0]=4 9607 B12R1.69 CCCSc1ccc(cc1F)Cl 62a_100000210303_100011216042 [0,2,0,0,0,0|1,1,0]=4 9608 B12R1.69 CCCSc1ccc(cc1F)Cl 62a_100011216042_100000210303 [0,2,0,0,0,0|1,1,0]=4 9609 B12R1.69 CCCSc1ccc(cc1F)F 62a_100000210303_100000750030 [0,2,0,0,0,0|1,1,0]=4 9610 B12R1.69 CCCSc1ccc(cc1F)F 62a_100000750030_100000210303 [0,2,0,0,0,0|1,1,0]=4 9611 B12R1.69 CCCSc1ccc(cc1F)N 62a_100000210303_100011356925 [0,2,0,0,0,0|1,1,0]=4 9612 B12R1.69 CCCSc1ccc(cc1F)N 62a_100011356925_100000210303 [0,2,0,0,0,0|1,1,0]=4 9613 B12R1.69 CCCSc1ccc(cc1F)O 62a_100000210303_100000755031 [0,2,0,0,0,0|0,1,0]=3 9614 B12R1.69 CCCSc1ccc(cc1F)O 62a_100000755031_100000210303 [0,2,0,0,0,0|0,1,0]=3 9615 B12R1.69 CCCSc1ccc(cc1N)Br 62a_100000210303_100000743836 [0,2,0,0,0,0|1,1,0]=4 9616 B12R1.69 CCCSc1ccc(cc1N)Br 62a_100000743836_100000210303 [0,2,0,0,0,0|1,1,0]=4 9617 B12R1.69 CCCSc1ccc(cc1N)C 62a_100000210303_100011216686 [0,2,0,0,0,0|1,1,0]=4 9618 B12R1.69 CCCSc1ccc(cc1N)C 62a_100011216686_100000210303 [0,2,0,0,0,0|1,1,0]=4 9619 B12R1.69 CCCSc1ccc(cc1N)Cl 62a_100000210303_100000761886 [0,2,0,0,0,0|1,1,0]=4 9620 B12R1.69 CCCSc1ccc(cc1N)Cl 62a_100000761886_100000210303 [0,2,0,0,0,0|1,1,0]=4 9621 B12R1.69 CCCSc1ccc(cc1N)F 62a_100000210303_100000687223 [0,2,0,0,0,0|1,1,0]=4 9622 B12R1.69 CCCSc1ccc(cc1N)F 62a_100000687223_100000210303 [0,2,0,0,0,0|1,1,0]=4 9623 B12R1.69 CCCSc1ccc(cc1N)N 62a_100000210303_200012175722 [0,2,0,0,0,0|1,1,0]=4 9624 B12R1.69 CCCSc1ccc(cc1N)N 62a_200012175722_100000210303 [0,2,0,0,0,0|1,1,0]=4 9625 B12R1.69 CCCSc1ccc(cc1N)O 62a_100000210303_100011999798 [0,2,0,0,0,0|0,1,0]=3 9626 B12R1.69 CCCSc1ccc(cc1N)O 62a_100011999798_100000210303 [0,2,0,0,0,0|0,1,0]=3 9627 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100000210303_100012344904 [0,2,0,0,0,0|1,1,0]=4 9628 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100012344904_100000210303 [0,2,0,0,0,0|1,1,0]=4 9629 B12R1.69 CCCSc1ccc(cc1O)C 62a_100000210303_100012002257 [0,2,0,0,0,0|1,1,0]=4 9630 B12R1.69 CCCSc1ccc(cc1O)C 62a_100012002257_100000210303 [0,2,0,0,0,0|1,1,0]=4 9631 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000050036_100000210303 [0,2,0,0,0,0|1,1,0]=4 9632 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000210303_100000050036 [0,2,0,0,0,0|1,1,0]=4 9633 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000210303_100000690578 [0,2,0,0,0,0|1,1,0]=4 9634 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000690578_100000210303 [0,2,0,0,0,0|1,1,0]=4 9635 B12R1.69 CCCSc1ccc(cc1O)O 62a_100000210303_100009813921 [0,2,0,0,0,0|0,1,0]=3 9636 B12R1.69 CCCSc1ccc(nc1C)O 62a_100000210303_100000691680 [0,2,0,0,0,0|1,1,0]=4 9637 B12R1.69 CCCSc1ccc(nc1C)O 62a_100000691680_100000210303 [0,2,0,0,0,0|1,1,0]=4 9638 B12R1.69 CCCSc1ccc(nc1F)O 62a_100000210303_100009879308 [0,2,0,0,0,0|1,1,0]=4 9639 B12R1.69 CCCSc1ccc(nc1F)O 62a_100009879308_100000210303 [0,2,0,0,0,0|1,1,0]=4 9640 B12R1.69 CCCSc1cnc(cc1C)O 62a_100000210303_100000766222 [0,2,0,0,0,0|1,1,0]=4 9641 B12R1.69 CCCSc1cnc(cc1C)O 62a_100000766222_100000210303 [0,2,0,0,0,0|1,1,0]=4 9642 B12R1.69 CCCSc1ncc(cc1C)O 62a_100000210303_100012000486 [0,2,0,0,0,0|1,1,0]=4 9643 B12R1.69 CCCSc1ncc(cc1C)O 62a_100012000486_100000210303 [0,2,0,0,0,0|1,1,0]=4 9644 B12R1.69 CCCSc1ncc(cc1F)O 62a_100000210303_100000063512 [0,2,0,0,0,0|1,1,0]=4 9645 B12R1.69 CCNCc1ccc(cc1Br)Br 207a_100015525214_100012351556 [0,2,0,0,0,0|2,0,0]=4 9646 B12R1.69 CCNCc1ccc(cc1Br)Br 2230a_100015525214_200012351560 [0,2,0,0,0,0|2,0,0]=4 9647 B12R1.69 CCNCc1ccc(cc1Br)Br 270004a_100015525214_100012351556 [0,2,0,0,0,0|2,0,0]=4 9648 B12R1.69 CCNCc1ccc(cc1Br)C 207a_100015525214_100000692596 [0,2,0,0,0,0|2,0,0]=4 9649 B12R1.69 CCNCc1ccc(cc1Br)C 270004a_100015525214_100000692596 [0,2,0,0,0,0|2,0,0]=4 9650 B12R1.69 CCNCc1ccc(cc1Br)Cl 207a_100015525214_100000687667 [0,2,0,0,0,0|2,0,0]=4 9651 B12R1.69 CCNCc1ccc(cc1Br)Cl 2230a_100015525214_100000755608 [0,2,0,0,0,0|2,0,0]=4 9652 B12R1.69 CCNCc1ccc(cc1Br)Cl 270004a_100015525214_100000687667 [0,2,0,0,0,0|2,0,0]=4 9653 B12R1.69 CCNCc1ccc(cc1Br)Cl 34a_100102692131_100000210202 [0,2,0,0,0,0|2,0,0]=4 9654 B12R1.69 CCNCc1ccc(cc1Br)F 207a_100015525214_100000685661 [0,2,0,0,0,0|2,0,0]=4 9655 B12R1.69 CCNCc1ccc(cc1Br)F 2230a_100015525214_100000243222 [0,2,0,0,0,0|2,0,0]=4 9656 B12R1.69 CCNCc1ccc(cc1Br)F 270004a_100015525214_100000685661 [0,2,0,0,0,0|2,0,0]=4 9657 B12R1.69 CCNCc1ccc(cc1Br)F 34a_100000708791_100000210202 [0,2,0,0,0,0|2,0,0]=4 9658 B12R1.69 CCNCc1ccc(cc1Br)I 207a_100015525214_100010185650 [0,2,0,0,0,0|2,0,0]=4 9659 B12R1.69 CCNCc1ccc(cc1Br)I 2230a_100015525214_100010146610 [0,2,0,0,0,0|2,0,0]=4 9660 B12R1.69 CCNCc1ccc(cc1C)Br 207a_100015525214_100000687586 [0,2,0,0,0,0|2,0,0]=4 9661 B12R1.69 CCNCc1ccc(cc1C)Br 2230a_100015525214_100000708836 [0,2,0,0,0,0|2,0,0]=4 9662 B12R1.69 CCNCc1ccc(cc1C)Br 270004a_100015525214_100000687586 [0,2,0,0,0,0|2,0,0]=4 9663 B12R1.69 CCNCc1ccc(cc1C)Br 34a_100000753881_100000210202 [0,2,0,0,0,0|2,0,0]=4 9664 B12R1.69 CCNCc1ccc(cc1C)C 207a_100015525214_100000211342 [0,2,0,0,0,0|2,0,0]=4 9665 B12R1.69 CCNCc1ccc(cc1C)C 2230a_100015525214_100011219618 [0,2,0,0,0,0|2,0,0]=4 9666 B12R1.69 CCNCc1ccc(cc1C)C 270004a_100015525214_100000211342 [0,2,0,0,0,0|2,0,0]=4 9667 B12R1.69 CCNCc1ccc(cc1C)C 34a_100000737523_100000210202 [0,2,0,0,0,0|2,0,0]=4 9668 B12R1.69 CCNCc1ccc(cc1C)Cl 207a_100015525214_100000766358 [0,2,0,0,0,0|2,0,0]=4 9669 B12R1.69 CCNCc1ccc(cc1C)Cl 2230a_100015525214_100012361307 [0,2,0,0,0,0|2,0,0]=4 9670 B12R1.69 CCNCc1ccc(cc1C)Cl 270004a_100015525214_100000766358 [0,2,0,0,0,0|2,0,0]=4 9671 B12R1.69 CCNCc1ccc(cc1C)Cl 34a_103436540063_100000210202 [0,2,0,0,0,0|2,0,0]=4 9672 B12R1.69 CCNCc1ccc(cc1C)F 207a_100015525214_100000745986 [0,2,0,0,0,0|2,0,0]=4 9673 B12R1.69 CCNCc1ccc(cc1C)F 2230a_100015525214_100000700533 [0,2,0,0,0,0|2,0,0]=4 9674 B12R1.69 CCNCc1ccc(cc1C)F 270004a_100015525214_100000745986 [0,2,0,0,0,0|2,0,0]=4 9675 B12R1.69 CCNCc1ccc(cc1C)F 34a_100137329023_100000210202 [0,2,0,0,0,0|2,0,0]=4 9676 B12R1.69 CCNCc1ccc(cc1Cl)Br 207a_100015525214_100000764164 [0,2,0,0,0,0|2,0,0]=4 9677 B12R1.69 CCNCc1ccc(cc1Cl)Br 2230a_100015525214_100011740631 [0,2,0,0,0,0|2,0,0]=4 9678 B12R1.69 CCNCc1ccc(cc1Cl)Br 270004a_100015525214_100000764164 [0,2,0,0,0,0|2,0,0]=4 9679 B12R1.69 CCNCc1ccc(cc1Cl)Br 34a_100020628970_100000210202 [0,2,0,0,0,0|2,0,0]=4 9680 B12R1.69 CCNCc1ccc(cc1Cl)C 207a_100015525214_100011935181 [0,2,0,0,0,0|2,0,0]=4 9681 B12R1.69 CCNCc1ccc(cc1Cl)C 2230a_100015525214_100012349684 [0,2,0,0,0,0|2,0,0]=4 9682 B12R1.69 CCNCc1ccc(cc1Cl)C 270004a_100015525214_100011935181 [0,2,0,0,0,0|2,0,0]=4 9683 B12R1.69 CCNCc1ccc(cc1Cl)C 34a_100011997539_100000210202 [0,2,0,0,0,0|2,0,0]=4 9684 B12R1.69 CCNCc1ccc(cc1Cl)Cl 207a_100015525214_100000188887 [0,2,0,0,0,0|2,0,0]=4 9685 B12R1.69 CCNCc1ccc(cc1Cl)Cl 2230a_100015525214_100000188473 [0,2,0,0,0,0|2,0,0]=4 9686 B12R1.69 CCNCc1ccc(cc1Cl)Cl 270004a_100015525214_100000188887 [0,2,0,0,0,0|2,0,0]=4 9687 B12R1.69 CCNCc1ccc(cc1Cl)Cl 34a_100000174880_100000210202 [0,2,0,0,0,0|2,0,0]=4 9688 B12R1.69 CCNCc1ccc(cc1Cl)F 207a_100015525214_100000752949 [0,2,0,0,0,0|2,0,0]=4 9689 B12R1.69 CCNCc1ccc(cc1Cl)F 2230a_100015525214_100011216360 [0,2,0,0,0,0|2,0,0]=4 9690 B12R1.69 CCNCc1ccc(cc1Cl)F 270004a_100015525214_100000752949 [0,2,0,0,0,0|2,0,0]=4 9691 B12R1.69 CCNCc1ccc(cc1Cl)F 34a_100000174946_100000210202 [0,2,0,0,0,0|2,0,0]=4 9692 B12R1.69 CCNCc1ccc(cc1Cl)I 207a_100015525214_100000727542 [0,2,0,0,0,0|2,0,0]=4 9693 B12R1.69 CCNCc1ccc(cc1Cl)O 34a_200161156549_100000210202 [0,2,0,0,0,0|1,0,0]=3 9694 B12R1.69 CCNCc1ccc(cc1F)Br 207a_100015525214_100000211676 [0,2,0,0,0,0|2,0,0]=4 9695 B12R1.69 CCNCc1ccc(cc1F)Br 2230a_100015525214_100000211606 [0,2,0,0,0,0|2,0,0]=4 9696 B12R1.69 CCNCc1ccc(cc1F)Br 270004a_100015525214_100000211676 [0,2,0,0,0,0|2,0,0]=4 9697 B12R1.69 CCNCc1ccc(cc1F)Br 34a_100000754580_100000210202 [0,2,0,0,0,0|2,0,0]=4 9698 B12R1.69 CCNCc1ccc(cc1F)C 207a_100015525214_100011217368 [0,2,0,0,0,0|2,0,0]=4 9699 B12R1.69 CCNCc1ccc(cc1F)C 2230a_100015525214_100011217900 [0,2,0,0,0,0|2,0,0]=4 9700 B12R1.69 CCNCc1ccc(cc1F)C 270004a_100015525214_100011217368 [0,2,0,0,0,0|2,0,0]=4 9701 B12R1.69 CCNCc1ccc(cc1F)C 34a_100102887089_100000210202 [0,2,0,0,0,0|2,0,0]=4 9702 B12R1.69 CCNCc1ccc(cc1F)Cl 207a_100015525214_100000697372 [0,2,0,0,0,0|2,0,0]=4 9703 B12R1.69 CCNCc1ccc(cc1F)Cl 2230a_100015525214_100000709361 [0,2,0,0,0,0|2,0,0]=4 9704 B12R1.69 CCNCc1ccc(cc1F)Cl 270004a_100015525214_100000697372 [0,2,0,0,0,0|2,0,0]=4 9705 B12R1.69 CCNCc1ccc(cc1F)Cl 34a_100000708496_100000210202 [0,2,0,0,0,0|2,0,0]=4 9706 B12R1.69 CCNCc1ccc(cc1F)F 207a_100015525214_100000211964 [0,2,0,0,0,0|2,0,0]=4 9707 B12R1.69 CCNCc1ccc(cc1F)F 2230a_100015525214_100000748237 [0,2,0,0,0,0|2,0,0]=4 9708 B12R1.69 CCNCc1ccc(cc1F)F 270004a_100015525214_100000211964 [0,2,0,0,0,0|2,0,0]=4 9709 B12R1.69 CCNCc1ccc(cc1F)F 34a_100000737868_100000210202 [0,2,0,0,0,0|2,0,0]=4 9710 B12R1.69 CCNCc1ccc(cc1F)I 207a_100015525214_100000050965 [0,2,0,0,0,0|2,0,0]=4 9711 B12R1.69 CCNCc1ccc(cc1F)I 2230a_100015525214_100010244991 [0,2,0,0,0,0|2,0,0]=4 9712 B12R1.69 CCNCc1ccc(cc1I)Br 207a_100015525214_100010146562 [0,2,0,0,0,0|2,0,0]=4 9713 B12R1.69 CCNCc1ccc(cc1I)Br 2230a_100015525214_100010146615 [0,2,0,0,0,0|2,0,0]=4 9714 B12R1.69 CCNCc1ccc(cc1I)Br 270004a_100015525214_100010146562 [0,2,0,0,0,0|2,0,0]=4 9715 B12R1.69 CCNCc1ccc(cc1I)C 207a_100015525214_100010150104 [0,2,0,0,0,0|2,0,0]=4 9716 B12R1.69 CCNCc1ccc(cc1I)C 270004a_100015525214_100010150104 [0,2,0,0,0,0|2,0,0]=4 9717 B12R1.69 CCNCc1ccc(cc1I)Cl 2230a_100015525214_100010254388 [0,2,0,0,0,0|2,0,0]=4 9718 B12R1.69 CCNCc1ccc(cc1I)F 207a_100015525214_100010254405 [0,2,0,0,0,0|2,0,0]=4 9719 B12R1.69 CCNCc1ccc(cc1I)F 2230a_100015525214_100012354799 [0,2,0,0,0,0|2,0,0]=4 9720 B12R1.69 CCOCc1ccc(cc1Br)Br 34a_100012357508_100000210202 [0,2,0,0,0,0|1,0,0]=3 9721 B12R1.69 CCOCc1ccc(cc1Br)Br 34a_100121572206_200012351560 [0,2,0,0,0,0|1,0,0]=3 9722 B12R1.69 CCOCc1ccc(cc1Br)Br 7a_100012357508_100000210202 [0,2,0,0,0,0|1,0,0]=3 9723 B12R1.69 CCOCc1ccc(cc1Br)Cl 34a_100000707881_100000210202 [0,2,0,0,0,0|1,0,0]=3 9724 B12R1.69 CCOCc1ccc(cc1Br)Cl 34a_100121572206_100000755608 [0,2,0,0,0,0|1,0,0]=3 9725 B12R1.69 CCOCc1ccc(cc1Br)Cl 7a_100000707881_100000210202 [0,2,0,0,0,0|1,0,0]=3 9726 B12R1.69 CCOCc1ccc(cc1Br)F 34a_100000744086_100000210202 [0,2,0,0,0,0|1,0,0]=3 9727 B12R1.69 CCOCc1ccc(cc1Br)F 34a_100121572206_100000243222 [0,2,0,0,0,0|1,0,0]=3 9728 B12R1.69 CCOCc1ccc(cc1Br)F 7a_100000744086_100000210202 [0,2,0,0,0,0|1,0,0]=3 9729 B12R1.69 CCOCc1ccc(cc1Br)I 34a_100121572206_100010146610 [0,2,0,0,0,0|1,0,0]=3 9730 B12R1.69 CCOCc1ccc(cc1Br)I 7a_100010240206_100000210202 [0,2,0,0,0,0|1,0,0]=3 9731 B12R1.69 CCOCc1ccc(cc1C)Br 34a_100000748258_100000210202 [0,2,0,0,0,0|1,0,0]=3 9732 B12R1.69 CCOCc1ccc(cc1C)Br 34a_100121572206_100000708836 [0,2,0,0,0,0|1,0,0]=3 9733 B12R1.69 CCOCc1ccc(cc1C)Br 7a_100000748258_100000210202 [0,2,0,0,0,0|1,0,0]=3 9734 B12R1.69 CCOCc1ccc(cc1C)C 34a_100011215341_100000210202 [0,2,0,0,0,0|1,0,0]=3 9735 B12R1.69 CCOCc1ccc(cc1C)C 34a_100121572206_100011219618 [0,2,0,0,0,0|1,0,0]=3 9736 B12R1.69 CCOCc1ccc(cc1C)C 7a_100011215341_100000210202 [0,2,0,0,0,0|1,0,0]=3 9737 B12R1.69 CCOCc1ccc(cc1C)Cl 34a_100000702939_100000210202 [0,2,0,0,0,0|1,0,0]=3 9738 B12R1.69 CCOCc1ccc(cc1C)Cl 34a_100121572206_100012361307 [0,2,0,0,0,0|1,0,0]=3 9739 B12R1.69 CCOCc1ccc(cc1C)Cl 7a_100000702939_100000210202 [0,2,0,0,0,0|1,0,0]=3 9740 B12R1.69 CCOCc1ccc(cc1C)F 34a_100000700136_100000210202 [0,2,0,0,0,0|1,0,0]=3 9741 B12R1.69 CCOCc1ccc(cc1C)F 34a_100121572206_100000700533 [0,2,0,0,0,0|1,0,0]=3 9742 B12R1.69 CCOCc1ccc(cc1C)F 7a_100000700136_100000210202 [0,2,0,0,0,0|1,0,0]=3 9743 B12R1.69 CCOCc1ccc(cc1C)N 34a_100000102464_100000210202 [0,2,0,0,0,0|1,0,0]=3 9744 B12R1.69 CCOCc1ccc(cc1C)N 7a_100000102464_100000210202 [0,2,0,0,0,0|1,0,0]=3 9745 B12R1.69 CCOCc1ccc(cc1Cl)Br 34a_100000756401_100000210202 [0,2,0,0,0,0|1,0,0]=3 9746 B12R1.69 CCOCc1ccc(cc1Cl)Br 34a_100121572206_100011740631 [0,2,0,0,0,0|1,0,0]=3 9747 B12R1.69 CCOCc1ccc(cc1Cl)Br 7a_100000756401_100000210202 [0,2,0,0,0,0|1,0,0]=3 9748 B12R1.69 CCOCc1ccc(cc1Cl)C 34a_100000720314_100000210202 [0,2,0,0,0,0|1,0,0]=3 9749 B12R1.69 CCOCc1ccc(cc1Cl)C 34a_100121572206_100012349684 [0,2,0,0,0,0|1,0,0]=3 9750 B12R1.69 CCOCc1ccc(cc1Cl)C 7a_100000720314_100000210202 [0,2,0,0,0,0|1,0,0]=3 9751 B12R1.69 CCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000210202 [0,2,0,0,0,0|1,0,0]=3 9752 B12R1.69 CCOCc1ccc(cc1Cl)Cl 34a_100121572206_100000188473 [0,2,0,0,0,0|1,0,0]=3 9753 B12R1.69 CCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000210202 [0,2,0,0,0,0|1,0,0]=3 9754 B12R1.69 CCOCc1ccc(cc1Cl)F 34a_100011219954_100000210202 [0,2,0,0,0,0|1,0,0]=3 9755 B12R1.69 CCOCc1ccc(cc1Cl)F 34a_100121572206_100011216360 [0,2,0,0,0,0|1,0,0]=3 9756 B12R1.69 CCOCc1ccc(cc1Cl)F 7a_100011219954_100000210202 [0,2,0,0,0,0|1,0,0]=3 9757 B12R1.69 CCOCc1ccc(cc1Cl)N 34a_100000689119_100000210202 [0,2,0,0,0,0|1,0,0]=3 9758 B12R1.69 CCOCc1ccc(cc1F)Br 34a_100011191541_100000210202 [0,2,0,0,0,0|1,0,0]=3 9759 B12R1.69 CCOCc1ccc(cc1F)Br 34a_100121572206_100000211606 [0,2,0,0,0,0|1,0,0]=3 9760 B12R1.69 CCOCc1ccc(cc1F)Br 7a_100011191541_100000210202 [0,2,0,0,0,0|1,0,0]=3 9761 B12R1.69 CCOCc1ccc(cc1F)C 34a_100011216587_100000210202 [0,2,0,0,0,0|1,0,0]=3 9762 B12R1.69 CCOCc1ccc(cc1F)C 34a_100121572206_100012002367 [0,2,0,0,0,0|1,0,0]=3 9763 B12R1.69 CCOCc1ccc(cc1F)C 7a_100011216587_100000210202 [0,2,0,0,0,0|1,0,0]=3 9764 B12R1.69 CCOCc1ccc(cc1F)Cl 34a_100011217562_100000210202 [0,2,0,0,0,0|1,0,0]=3 9765 B12R1.69 CCOCc1ccc(cc1F)Cl 34a_100121572206_100000709361 [0,2,0,0,0,0|1,0,0]=3 9766 B12R1.69 CCOCc1ccc(cc1F)Cl 7a_100011217562_100000210202 [0,2,0,0,0,0|1,0,0]=3 9767 B12R1.69 CCOCc1ccc(cc1F)F 34a_100011215441_100000210202 [0,2,0,0,0,0|1,0,0]=3 9768 B12R1.69 CCOCc1ccc(cc1F)F 34a_100121572206_100000748237 [0,2,0,0,0,0|1,0,0]=3 9769 B12R1.69 CCOCc1ccc(cc1F)F 7a_100011215441_100000210202 [0,2,0,0,0,0|1,0,0]=3 9770 B12R1.69 CCOCc1ccc(cc1F)I 34a_100121572206_100010244991 [0,2,0,0,0,0|1,0,0]=3 9771 B12R1.69 CCOCc1ccc(cc1F)I 34a_200010202041_100000210202 [0,2,0,0,0,0|1,0,0]=3 9772 B12R1.69 CCOCc1ccc(cc1F)I 7a_200010202041_100000210202 [0,2,0,0,0,0|1,0,0]=3 9773 B12R1.69 CCOCc1ccc(cc1I)Br 34a_100121572206_100010146615 [0,2,0,0,0,0|1,0,0]=3 9774 B12R1.69 CCOCc1ccc(cc1I)Br 7a_100010146605_100000210202 [0,2,0,0,0,0|1,0,0]=3 9775 B12R1.69 CCOCc1ccc(cc1I)Cl 34a_100000722340_100000210202 [0,2,0,0,0,0|1,0,0]=3 9776 B12R1.69 CCOCc1ccc(cc1I)Cl 34a_100121572206_100010254388 [0,2,0,0,0,0|1,0,0]=3 9777 B12R1.69 CCOCc1ccc(cc1I)Cl 7a_100000722340_100000210202 [0,2,0,0,0,0|1,0,0]=3 9778 B12R1.69 CCOCc1ccc(cc1I)F 34a_100011356828_100000210202 [0,2,0,0,0,0|1,0,0]=3 9779 B12R1.69 CCOCc1ccc(cc1I)F 34a_100121572206_100012354799 [0,2,0,0,0,0|1,0,0]=3 9780 B12R1.69 CCOCc1ccc(cc1I)F 7a_100011356828_100000210202 [0,2,0,0,0,0|1,0,0]=3 9781 B12R1.69 CCOCc1ccc(cc1N)Br 34a_100000718831_100000210202 [0,2,0,0,0,0|1,0,0]=3 9782 B12R1.69 CCOCc1ccc(cc1N)Br 7a_100000718831_100000210202 [0,2,0,0,0,0|1,0,0]=3 9783 B12R1.69 CCOCc1ccc(cc1N)C 34a_100000087799_100000210202 [0,2,0,0,0,0|1,0,0]=3 9784 B12R1.69 CCOCc1ccc(cc1N)C 7a_100000087799_100000210202 [0,2,0,0,0,0|1,0,0]=3 9785 B12R1.69 CCOCc1ccc(cc1N)Cl 34a_100000238622_100000210202 [0,2,0,0,0,0|1,0,0]=3 9786 B12R1.69 CCOCc1ccc(cc1N)Cl 7a_100000238622_100000210202 [0,2,0,0,0,0|1,0,0]=3 9787 B12R1.69 CCOCc1ccc(cc1N)F 34a_100011996588_100000210202 [0,2,0,0,0,0|1,0,0]=3 9788 B12R1.69 CCOCc1ccc(nc1Br)Br 34a_200010005763_100000210202 [0,2,0,0,0,0|2,0,0]=4 9789 B12R1.69 CCOCc1ccc(nc1Br)Br 7a_200010005763_100000210202 [0,2,0,0,0,0|2,0,0]=4 9790 B12R1.69 CCOCc1ccc(nc1Br)C 34a_100121572206_200010064658 [0,2,0,0,0,0|2,0,0]=4 9791 B12R1.69 CCOCc1ccc(nc1C)C 34a_100011756430_100000210202 [0,2,0,0,0,0|2,0,0]=4 9792 B12R1.69 CCOCc1ccc(nc1C)C 7a_100011756430_100000210202 [0,2,0,0,0,0|2,0,0]=4 9793 B12R1.69 CCOCc1ccc(nc1C)F 34a_100000081978_100000210202 [0,2,0,0,0,0|2,0,0]=4 9794 B12R1.69 CCOCc1ccc(nc1C)F 7a_100000081978_100000210202 [0,2,0,0,0,0|2,0,0]=4 9795 B12R1.69 CCOCc1ccc(nc1Cl)C 34a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 9796 B12R1.69 CCOCc1ccc(nc1Cl)C 7a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 9797 B12R1.69 CCOCc1ccc(nc1Cl)Cl 34a_100000720492_100000210202 [0,2,0,0,0,0|2,0,0]=4 9798 B12R1.69 CCOCc1ccc(nc1Cl)Cl 34a_100121572206_100000722033 [0,2,0,0,0,0|2,0,0]=4 9799 B12R1.69 CCOCc1ccc(nc1Cl)Cl 7a_100000720492_100000210202 [0,2,0,0,0,0|2,0,0]=4 9800 B12R1.69 CCOCc1ccc(nc1F)Br 34a_100010065253_100000210202 [0,2,0,0,0,0|2,0,0]=4 9801 B12R1.69 CCOCc1ccc(nc1F)Br 7a_100010065253_100000210202 [0,2,0,0,0,0|2,0,0]=4 9802 B12R1.69 CCOCc1ccc(nc1F)Cl 34a_100009870654_100000210202 [0,2,0,0,0,0|2,0,0]=4 9803 B12R1.69 CCOCc1ccc(nc1F)Cl 7a_100009870654_100000210202 [0,2,0,0,0,0|2,0,0]=4 9804 B12R1.69 CCOCc1cnc(cc1C)Cl 34a_100010277336_100000210202 [0,2,0,0,0,0|2,0,0]=4 9805 B12R1.69 CCOCc1cnc(cc1C)Cl 7a_100010277336_100000210202 [0,2,0,0,0,0|2,0,0]=4 9806 B12R1.69 CCOCc1cnc(cc1C)F 34a_100121572206_100010382440 [0,2,0,0,0,0|2,0,0]=4 9807 B12R1.69 CCOCc1cnc(cc1Cl)Cl 34a_100000702863_100000210202 [0,2,0,0,0,0|2,0,0]=4 9808 B12R1.69 CCOCc1cnc(cc1Cl)Cl 34a_100121572206_100011997056 [0,2,0,0,0,0|2,0,0]=4 9809 B12R1.69 CCOCc1cnc(cc1Cl)Cl 7a_100000702863_100000210202 [0,2,0,0,0,0|2,0,0]=4 9810 B12R1.69 CCOCc1cnc(cc1N)C 34a_200012022818_100000210202 [0,2,0,0,0,0|2,0,0]=4 9811 B12R1.69 CCOCc1cnc(cc1N)Cl 34a_100009830438_100000210202 [0,2,0,0,0,0|2,0,0]=4 9812 B12R1.69 CCOCc1ncc(cc1Br)Br 34a_100012354961_100000210202 [0,2,0,0,0,0|2,0,0]=4 9813 B12R1.69 CCOCc1ncc(cc1Br)Br 7a_100012354961_100000210202 [0,2,0,0,0,0|2,0,0]=4 9814 B12R1.69 CCOCc1ncc(cc1Br)Cl 34a_100010065237_100000210202 [0,2,0,0,0,0|2,0,0]=4 9815 B12R1.69 CCOCc1ncc(cc1Br)Cl 7a_100010065237_100000210202 [0,2,0,0,0,0|2,0,0]=4 9816 B12R1.69 CCOCc1ncc(cc1C)Br 34a_100010116297_100000210202 [0,2,0,0,0,0|2,0,0]=4 9817 B12R1.69 CCOCc1ncc(cc1C)Br 7a_100010116297_100000210202 [0,2,0,0,0,0|2,0,0]=4 9818 B12R1.69 CCOCc1ncc(cc1C)C 34a_100012000483_100000210202 [0,2,0,0,0,0|2,0,0]=4 9819 B12R1.69 CCOCc1ncc(cc1C)C 34a_100121572206_100016990036 [0,2,0,0,0,0|2,0,0]=4 9820 B12R1.69 CCOCc1ncc(cc1C)C 7a_100012000483_100000210202 [0,2,0,0,0,0|2,0,0]=4 9821 B12R1.69 CCOCc1ncc(cc1Cl)Br 34a_100010065239_100000210202 [0,2,0,0,0,0|2,0,0]=4 9822 B12R1.69 CCOCc1ncc(cc1Cl)Br 7a_100010065239_100000210202 [0,2,0,0,0,0|2,0,0]=4 9823 B12R1.69 CCOCc1ncc(cc1Cl)Cl 34a_100103146734_100000210202 [0,2,0,0,0,0|2,0,0]=4 9824 B12R1.69 CCOCc1ncc(cc1Cl)Cl 7a_100103146734_100000210202 [0,2,0,0,0,0|2,0,0]=4 9825 B12R1.69 CCOCc1ncc(cc1F)Br 34a_100010065252_100000210202 [0,2,0,0,0,0|2,0,0]=4 9826 B12R1.69 CCOCc1ncc(cc1F)Br 7a_100010065252_100000210202 [0,2,0,0,0,0|2,0,0]=4 9827 B12R1.69 CCOCc1ncc(cc1F)Cl 34a_100009885607_100000210202 [0,2,0,0,0,0|2,0,0]=4 9828 B12R1.69 CCOCc1ncc(cc1F)Cl 34a_100121572206_200009879301 [0,2,0,0,0,0|2,0,0]=4 9829 B12R1.69 CCOCc1ncc(cc1F)Cl 7a_100009885607_100000210202 [0,2,0,0,0,0|2,0,0]=4 9830 B12R1.69 CCOCc1ncc(cc1F)F 34a_100000104222_100000210202 [0,2,0,0,0,0|2,0,0]=4 9831 B12R1.69 CCOCc1ncc(cc1F)F 7a_100000104222_100000210202 [0,2,0,0,0,0|2,0,0]=4 9832 B12R1.69 CCSCc1ccc(cc1Br)Br 62a_100000210202_200012351560 [0,2,0,0,0,0|1,1,0]=4 9833 B12R1.69 CCSCc1ccc(cc1Br)Br 62a_200012351560_100000210202 [0,2,0,0,0,0|1,1,0]=4 9834 B12R1.69 CCSCc1ccc(cc1Br)Cl 62a_100000210202_100000755608 [0,2,0,0,0,0|1,1,0]=4 9835 B12R1.69 CCSCc1ccc(cc1Br)Cl 62a_100000755608_100000210202 [0,2,0,0,0,0|1,1,0]=4 9836 B12R1.69 CCSCc1ccc(cc1Br)F 62a_100000210202_100000243222 [0,2,0,0,0,0|1,1,0]=4 9837 B12R1.69 CCSCc1ccc(cc1Br)F 62a_100000243222_100000210202 [0,2,0,0,0,0|1,1,0]=4 9838 B12R1.69 CCSCc1ccc(cc1Br)I 62a_100000210202_100010146610 [0,2,0,0,0,0|1,1,0]=4 9839 B12R1.69 CCSCc1ccc(cc1Br)I 62a_100010146610_100000210202 [0,2,0,0,0,0|1,1,0]=4 9840 B12R1.69 CCSCc1ccc(cc1C)Br 62a_100000210202_100000708836 [0,2,0,0,0,0|1,1,0]=4 9841 B12R1.69 CCSCc1ccc(cc1C)Br 62a_100000708836_100000210202 [0,2,0,0,0,0|1,1,0]=4 9842 B12R1.69 CCSCc1ccc(cc1C)C 62a_100000210202_100011219618 [0,2,0,0,0,0|1,1,0]=4 9843 B12R1.69 CCSCc1ccc(cc1C)C 62a_100011219618_100000210202 [0,2,0,0,0,0|1,1,0]=4 9844 B12R1.69 CCSCc1ccc(cc1C)Cl 62a_100000210202_100012361307 [0,2,0,0,0,0|1,1,0]=4 9845 B12R1.69 CCSCc1ccc(cc1C)Cl 62a_100012361307_100000210202 [0,2,0,0,0,0|1,1,0]=4 9846 B12R1.69 CCSCc1ccc(cc1C)F 62a_100000210202_100000700533 [0,2,0,0,0,0|1,1,0]=4 9847 B12R1.69 CCSCc1ccc(cc1C)F 62a_100000700533_100000210202 [0,2,0,0,0,0|1,1,0]=4 9848 B12R1.69 CCSCc1ccc(cc1Cl)Br 62a_100000210202_100011740631 [0,2,0,0,0,0|1,1,0]=4 9849 B12R1.69 CCSCc1ccc(cc1Cl)Br 62a_100011740631_100000210202 [0,2,0,0,0,0|1,1,0]=4 9850 B12R1.69 CCSCc1ccc(cc1Cl)C 62a_100000210202_100012349684 [0,2,0,0,0,0|1,1,0]=4 9851 B12R1.69 CCSCc1ccc(cc1Cl)C 62a_100012349684_100000210202 [0,2,0,0,0,0|1,1,0]=4 9852 B12R1.69 CCSCc1ccc(cc1Cl)Cl 62a_100000188473_100000210202 [0,2,0,0,0,0|1,1,0]=4 9853 B12R1.69 CCSCc1ccc(cc1Cl)Cl 62a_100000210202_100000188473 [0,2,0,0,0,0|1,1,0]=4 9854 B12R1.69 CCSCc1ccc(cc1Cl)F 62a_100000187853_100000210202 [0,2,0,0,0,0|1,1,0]=4 9855 B12R1.69 CCSCc1ccc(cc1Cl)F 62a_100000210202_100000187853 [0,2,0,0,0,0|1,1,0]=4 9856 B12R1.69 CCSCc1ccc(cc1F)Br 62a_100000210202_100000211606 [0,2,0,0,0,0|1,1,0]=4 9857 B12R1.69 CCSCc1ccc(cc1F)Br 62a_100000211606_100000210202 [0,2,0,0,0,0|1,1,0]=4 9858 B12R1.69 CCSCc1ccc(cc1F)C 62a_100000210202_100011217900 [0,2,0,0,0,0|1,1,0]=4 9859 B12R1.69 CCSCc1ccc(cc1F)C 62a_100011217900_100000210202 [0,2,0,0,0,0|1,1,0]=4 9860 B12R1.69 CCSCc1ccc(cc1F)Cl 62a_100000210202_100000709361 [0,2,0,0,0,0|1,1,0]=4 9861 B12R1.69 CCSCc1ccc(cc1F)Cl 62a_100000709361_100000210202 [0,2,0,0,0,0|1,1,0]=4 9862 B12R1.69 CCSCc1ccc(cc1F)F 62a_100000210202_100000748237 [0,2,0,0,0,0|1,1,0]=4 9863 B12R1.69 CCSCc1ccc(cc1F)F 62a_100000748237_100000210202 [0,2,0,0,0,0|1,1,0]=4 9864 B12R1.69 CCSCc1ccc(cc1F)I 62a_100000210202_100010244991 [0,2,0,0,0,0|1,1,0]=4 9865 B12R1.69 CCSCc1ccc(cc1F)I 62a_100010244991_100000210202 [0,2,0,0,0,0|1,1,0]=4 9866 B12R1.69 CCSCc1ccc(cc1I)Br 62a_100000210202_100010146615 [0,2,0,0,0,0|1,1,0]=4 9867 B12R1.69 CCSCc1ccc(cc1I)Br 62a_100010146615_100000210202 [0,2,0,0,0,0|1,1,0]=4 9868 B12R1.69 CCSCc1ccc(cc1I)Cl 62a_100000210202_100010254388 [0,2,0,0,0,0|1,1,0]=4 9869 B12R1.69 CCSCc1ccc(cc1I)Cl 62a_100010254388_100000210202 [0,2,0,0,0,0|1,1,0]=4 9870 B12R1.69 CCSCc1ccc(cc1I)F 62a_100000210202_100012354799 [0,2,0,0,0,0|1,1,0]=4 9871 B12R1.69 CCSCc1ccc(cc1I)F 62a_100012354799_100000210202 [0,2,0,0,0,0|1,1,0]=4 9872 B12R1.69 CNCCc1ccc(cc1Br)Cl 2230a_106832991635_200012945151 [0,2,0,0,0,0|2,0,0]=4 9873 B12R1.69 CNCCc1ccc(cc1Br)Cl 34a_100102657272_200012945151 [0,2,0,0,0,0|2,0,0]=4 9874 B12R1.69 CNCCc1ccc(cc1Br)Cl 7a_106832991635_200012945151 [0,2,0,0,0,0|2,0,0]=4 9875 B12R1.69 CNCCc1ccc(cc1C)C 2230a_100000745621_200000210301 [0,2,0,0,0,0|2,0,0]=4 9876 B12R1.69 CNCCc1ccc(cc1C)C 270004a_106832991635_100011754701 [0,2,0,0,0,0|2,0,0]=4 9877 B12R1.69 CNCCc1ccc(cc1C)C 34a_100000745621_200000210301 [0,2,0,0,0,0|2,0,0]=4 9878 B12R1.69 CNCCc1ccc(cc1Cl)Cl 2230a_100000210994_200000210301 [0,2,0,0,0,0|2,0,0]=4 9879 B12R1.69 CNCCc1ccc(cc1Cl)Cl 2230a_106832991635_200012161198 [0,2,0,0,0,0|2,0,0]=4 9880 B12R1.69 CNCCc1ccc(cc1Cl)Cl 34a_100000210994_200000210301 [0,2,0,0,0,0|2,0,0]=4 9881 B12R1.69 CNCCc1ccc(cc1Cl)Cl 34a_100102657272_200012161198 [0,2,0,0,0,0|2,0,0]=4 9882 B12R1.69 CNCCc1ccc(cc1Cl)Cl 7a_106832991635_200012161198 [0,2,0,0,0,0|2,0,0]=4 9883 B12R1.69 CNCCc1ccc(cc1F)Cl 2230a_103496529009_200000210301 [0,2,0,0,0,0|2,0,0]=4 9884 B12R1.69 CNCCc1ccc(cc1F)Cl 34a_103496529009_200000210301 [0,2,0,0,0,0|2,0,0]=4 9885 B12R1.69 CNCCc1ccc(cc1F)F 2230a_100000754870_200000210301 [0,2,0,0,0,0|2,0,0]=4 9886 B12R1.69 CNCCc1ccc(cc1F)F 34a_100000754870_200000210301 [0,2,0,0,0,0|2,0,0]=4 9887 B12R1.69 COCCc1ccc(cc1Br)Cl 34a_100138415774_200012945151 [0,2,0,0,0,0|2,0,0]=4 9888 B12R1.69 COCCc1ccc(cc1Cl)Br 34a_100013445822_200000210301 [0,2,0,0,0,0|2,0,0]=4 9889 B12R1.69 COCCc1ccc(cc1Cl)Br 7a_100013445822_200000210301 [0,2,0,0,0,0|2,0,0]=4 9890 B12R1.69 COCCc1ccc(cc1Cl)Cl 34a_100011215701_200000210301 [0,2,0,0,0,0|2,0,0]=4 9891 B12R1.69 COCCc1ccc(cc1Cl)Cl 34a_100138415774_200012161198 [0,2,0,0,0,0|2,0,0]=4 9892 B12R1.69 COCCc1ccc(cc1Cl)Cl 7a_100011215701_200000210301 [0,2,0,0,0,0|2,0,0]=4 9893 B12R1.69 COCCc1ccc(cc1Cl)F 34a_100011962860_200000210301 [0,2,0,0,0,0|2,0,0]=4 9894 B12R1.69 COCCc1ccc(cc1Cl)F 7a_100011962860_200000210301 [0,2,0,0,0,0|2,0,0]=4 9895 B12R1.69 COCCc1ccc(cc1F)Br 34a_100011962869_200000210301 [0,2,0,0,0,0|2,0,0]=4 9896 B12R1.69 COCCc1ccc(cc1F)Br 7a_100011962869_200000210301 [0,2,0,0,0,0|2,0,0]=4 9897 B12R1.69 COCCc1ccc(cc1F)F 34a_100000697962_200000210301 [0,2,0,0,0,0|2,0,0]=4 9898 B12R1.69 COCCc1ccc(cc1F)F 7a_100000697962_200000210301 [0,2,0,0,0,0|2,0,0]=4 9899 B12R1.69 COCCn1ccc(cc1=O)O 271570a_203496583355_200015743058 [0,2,0,0,0,0|2,0,0]=4 9900 B12R1.69 COCOc1ccc(cc1F)O 271570a_203496583355_100009812708 [0,2,0,0,0,0|0,0,0]=2 9901 B12R1.69 COCOc1ccc(cc1O)C 271570a_203496583355_100012265689 [0,2,0,0,0,0|1,0,0]=3 9902 B12R1.69 COCOc1cnc(cc1O)F 271570a_203496583355_100010372047 [0,2,0,0,0,0|2,0,0]=4 9903 B12R1.69 COCSc1ccc(cc1Br)Br 62a_100000766300_100011484698 [0,2,0,0,0,0|1,1,0]=4 9904 B12R1.69 COCSc1ccc(cc1Br)Br 62a_100011484698_100000766300 [0,2,0,0,0,0|1,1,0]=4 9905 B12R1.69 COCSc1ccc(cc1Br)C 62a_100000766300_100009813563 [0,2,0,0,0,0|1,1,0]=4 9906 B12R1.69 COCSc1ccc(cc1Br)C 62a_100009813563_100000766300 [0,2,0,0,0,0|1,1,0]=4 9907 B12R1.69 COCSc1ccc(cc1Br)Cl 62a_100000766300_100011219703 [0,2,0,0,0,0|1,1,0]=4 9908 B12R1.69 COCSc1ccc(cc1Br)Cl 62a_100011219703_100000766300 [0,2,0,0,0,0|1,1,0]=4 9909 B12R1.69 COCSc1ccc(cc1Br)F 62a_100000766300_100011217111 [0,2,0,0,0,0|1,1,0]=4 9910 B12R1.69 COCSc1ccc(cc1Br)F 62a_100011217111_100000766300 [0,2,0,0,0,0|1,1,0]=4 9911 B12R1.69 COCSc1ccc(cc1Br)N 62a_100000750458_100000766300 [0,2,0,0,0,0|1,1,0]=4 9912 B12R1.69 COCSc1ccc(cc1Br)N 62a_100000766300_100000750458 [0,2,0,0,0,0|1,1,0]=4 9913 B12R1.69 COCSc1ccc(cc1Br)O 62a_100000701344_100000766300 [0,2,0,0,0,0|0,1,0]=3 9914 B12R1.69 COCSc1ccc(cc1Br)O 62a_100000766300_100000701344 [0,2,0,0,0,0|0,1,0]=3 9915 B12R1.69 COCSc1ccc(cc1C)Br 62a_100000701812_100000766300 [0,2,0,0,0,0|1,1,0]=4 9916 B12R1.69 COCSc1ccc(cc1C)Br 62a_100000766300_100000701812 [0,2,0,0,0,0|1,1,0]=4 9917 B12R1.69 COCSc1ccc(cc1C)C 62a_100000766300_100011217332 [0,2,0,0,0,0|1,1,0]=4 9918 B12R1.69 COCSc1ccc(cc1C)C 62a_100011217332_100000766300 [0,2,0,0,0,0|1,1,0]=4 9919 B12R1.69 COCSc1ccc(cc1C)Cl 62a_100000766300_100011219607 [0,2,0,0,0,0|1,1,0]=4 9920 B12R1.69 COCSc1ccc(cc1C)Cl 62a_100011219607_100000766300 [0,2,0,0,0,0|1,1,0]=4 9921 B12R1.69 COCSc1ccc(cc1C)F 62a_100000766300_100011205405 [0,2,0,0,0,0|1,1,0]=4 9922 B12R1.69 COCSc1ccc(cc1C)F 62a_100011205405_100000766300 [0,2,0,0,0,0|1,1,0]=4 9923 B12R1.69 COCSc1ccc(cc1C)N 62a_100000210723_100000766300 [0,2,0,0,0,0|1,1,0]=4 9924 B12R1.69 COCSc1ccc(cc1C)N 62a_100000766300_100000210723 [0,2,0,0,0,0|1,1,0]=4 9925 B12R1.69 COCSc1ccc(cc1C)O 62a_100000766300_100000690111 [0,2,0,0,0,0|0,1,0]=3 9926 B12R1.69 COCSc1ccc(cc1Cl)Br 62a_100000766300_100011216062 [0,2,0,0,0,0|1,1,0]=4 9927 B12R1.69 COCSc1ccc(cc1Cl)Br 62a_100011216062_100000766300 [0,2,0,0,0,0|1,1,0]=4 9928 B12R1.69 COCSc1ccc(cc1Cl)C 62a_100000766300_100011263221 [0,2,0,0,0,0|1,1,0]=4 9929 B12R1.69 COCSc1ccc(cc1Cl)C 62a_100011263221_100000766300 [0,2,0,0,0,0|1,1,0]=4 9930 B12R1.69 COCSc1ccc(cc1Cl)Cl 62a_100000699841_100000766300 [0,2,0,0,0,0|1,1,0]=4 9931 B12R1.69 COCSc1ccc(cc1Cl)Cl 62a_100000766300_100000699841 [0,2,0,0,0,0|1,1,0]=4 9932 B12R1.69 COCSc1ccc(cc1Cl)F 62a_100000733362_100000766300 [0,2,0,0,0,0|1,1,0]=4 9933 B12R1.69 COCSc1ccc(cc1Cl)F 62a_100000766300_100000733362 [0,2,0,0,0,0|1,1,0]=4 9934 B12R1.69 COCSc1ccc(cc1Cl)N 62a_100000761885_100000766300 [0,2,0,0,0,0|1,1,0]=4 9935 B12R1.69 COCSc1ccc(cc1Cl)N 62a_100000766300_100000761885 [0,2,0,0,0,0|1,1,0]=4 9936 B12R1.69 COCSc1ccc(cc1Cl)O 62a_100000047559_100000766300 [0,2,0,0,0,0|0,1,0]=3 9937 B12R1.69 COCSc1ccc(cc1Cl)O 62a_100000766300_100000047559 [0,2,0,0,0,0|0,1,0]=3 9938 B12R1.69 COCSc1ccc(cc1F)Br 62a_100000766300_100009814013 [0,2,0,0,0,0|1,1,0]=4 9939 B12R1.69 COCSc1ccc(cc1F)Br 62a_100009814013_100000766300 [0,2,0,0,0,0|1,1,0]=4 9940 B12R1.69 COCSc1ccc(cc1F)C 62a_100000766300_100011216119 [0,2,0,0,0,0|1,1,0]=4 9941 B12R1.69 COCSc1ccc(cc1F)C 62a_100011216119_100000766300 [0,2,0,0,0,0|1,1,0]=4 9942 B12R1.69 COCSc1ccc(cc1F)Cl 62a_100000766300_100011216042 [0,2,0,0,0,0|1,1,0]=4 9943 B12R1.69 COCSc1ccc(cc1F)Cl 62a_100011216042_100000766300 [0,2,0,0,0,0|1,1,0]=4 9944 B12R1.69 COCSc1ccc(cc1F)F 62a_100000750030_100000766300 [0,2,0,0,0,0|1,1,0]=4 9945 B12R1.69 COCSc1ccc(cc1F)F 62a_100000766300_100000750030 [0,2,0,0,0,0|1,1,0]=4 9946 B12R1.69 COCSc1ccc(cc1F)N 62a_100000766300_100011356925 [0,2,0,0,0,0|1,1,0]=4 9947 B12R1.69 COCSc1ccc(cc1F)N 62a_100011356925_100000766300 [0,2,0,0,0,0|1,1,0]=4 9948 B12R1.69 COCSc1ccc(cc1F)O 62a_100000755031_100000766300 [0,2,0,0,0,0|0,1,0]=3 9949 B12R1.69 COCSc1ccc(cc1F)O 62a_100000766300_100000755031 [0,2,0,0,0,0|0,1,0]=3 9950 B12R1.69 COCSc1ccc(cc1N)Br 62a_100000743836_100000766300 [0,2,0,0,0,0|1,1,0]=4 9951 B12R1.69 COCSc1ccc(cc1N)Br 62a_100000766300_100000743836 [0,2,0,0,0,0|1,1,0]=4 9952 B12R1.69 COCSc1ccc(cc1N)C 62a_100000766300_100011216686 [0,2,0,0,0,0|1,1,0]=4 9953 B12R1.69 COCSc1ccc(cc1N)C 62a_100011216686_100000766300 [0,2,0,0,0,0|1,1,0]=4 9954 B12R1.69 COCSc1ccc(cc1N)Cl 62a_100000761886_100000766300 [0,2,0,0,0,0|1,1,0]=4 9955 B12R1.69 COCSc1ccc(cc1N)Cl 62a_100000766300_100000761886 [0,2,0,0,0,0|1,1,0]=4 9956 B12R1.69 COCSc1ccc(cc1N)F 62a_100000687223_100000766300 [0,2,0,0,0,0|1,1,0]=4 9957 B12R1.69 COCSc1ccc(cc1N)F 62a_100000766300_100000687223 [0,2,0,0,0,0|1,1,0]=4 9958 B12R1.69 COCSc1ccc(cc1N)N 62a_100000766300_200012175722 [0,2,0,0,0,0|1,1,0]=4 9959 B12R1.69 COCSc1ccc(cc1N)N 62a_200012175722_100000766300 [0,2,0,0,0,0|1,1,0]=4 9960 B12R1.69 COCSc1ccc(cc1N)O 62a_100000766300_100011999798 [0,2,0,0,0,0|0,1,0]=3 9961 B12R1.69 COCSc1ccc(cc1N)O 62a_100011999798_100000766300 [0,2,0,0,0,0|0,1,0]=3 9962 B12R1.69 COCSc1ccc(cc1O)Br 62a_100000766300_100012344904 [0,2,0,0,0,0|1,1,0]=4 9963 B12R1.69 COCSc1ccc(cc1O)Br 62a_100012344904_100000766300 [0,2,0,0,0,0|1,1,0]=4 9964 B12R1.69 COCSc1ccc(cc1O)C 62a_100000766300_100012002257 [0,2,0,0,0,0|1,1,0]=4 9965 B12R1.69 COCSc1ccc(cc1O)C 62a_100012002257_100000766300 [0,2,0,0,0,0|1,1,0]=4 9966 B12R1.69 COCSc1ccc(cc1O)Cl 62a_100000050036_100000766300 [0,2,0,0,0,0|1,1,0]=4 9967 B12R1.69 COCSc1ccc(cc1O)Cl 62a_100000766300_100000050036 [0,2,0,0,0,0|1,1,0]=4 9968 B12R1.69 COCSc1ccc(cc1O)F 62a_100000690578_100000766300 [0,2,0,0,0,0|1,1,0]=4 9969 B12R1.69 COCSc1ccc(cc1O)F 62a_100000766300_100000690578 [0,2,0,0,0,0|1,1,0]=4 9970 B12R1.69 COCSc1ccc(cc1O)O 62a_100000766300_100009813921 [0,2,0,0,0,0|0,1,0]=3 9971 B12R1.69 COCSc1ccc(nc1C)O 62a_100000691680_100000766300 [0,2,0,0,0,0|1,1,0]=4 9972 B12R1.69 COCSc1ccc(nc1C)O 62a_100000766300_100000691680 [0,2,0,0,0,0|1,1,0]=4 9973 B12R1.69 COCSc1ccc(nc1F)O 62a_100000766300_100009879308 [0,2,0,0,0,0|1,1,0]=4 9974 B12R1.69 COCSc1ccc(nc1F)O 62a_100009879308_100000766300 [0,2,0,0,0,0|1,1,0]=4 9975 B12R1.69 COCSc1cnc(cc1C)O 62a_100000766222_100000766300 [0,2,0,0,0,0|1,1,0]=4 9976 B12R1.69 COCSc1cnc(cc1C)O 62a_100000766300_100000766222 [0,2,0,0,0,0|1,1,0]=4 9977 B12R1.69 COCSc1ncc(cc1C)O 62a_100000766300_100012000486 [0,2,0,0,0,0|1,1,0]=4 9978 B12R1.69 COCSc1ncc(cc1C)O 62a_100012000486_100000766300 [0,2,0,0,0,0|1,1,0]=4 9979 B12R1.69 COCSc1ncc(cc1F)O 62a_100000766300_100000063512 [0,2,0,0,0,0|1,1,0]=4 9980 B12R1.69 CSCCc1ccc(cc1Br)Cl 62a_200000210301_200012945151 [0,2,0,0,0,0|2,0,0]=4 9981 B12R1.69 CSCCc1ccc(cc1Br)Cl 62a_200012945151_200000210301 [0,2,0,0,0,0|2,0,0]=4 9982 B12R1.69 CSCCc1ccc(cc1Cl)Cl 62a_200000210301_200012161198 [0,2,0,0,0,0|2,0,0]=4 9983 B12R1.69 CSCCc1ccc(cc1Cl)Cl 62a_200012161198_200000210301 [0,2,0,0,0,0|2,0,0]=4 9984 B12R1.69 CSCNc1ccc(cc1Br)Br 34a_100000211012_100011218213 [0,2,0,0,0,0|2,0,0]=4 9985 B12R1.69 CSCNc1ccc(cc1Br)C 34a_100000210942_100011218213 [0,2,0,0,0,0|2,0,0]=4 9986 B12R1.69 CSCNc1ccc(cc1Br)Cl 34a_100000752454_100011218213 [0,2,0,0,0,0|2,0,0]=4 9987 B12R1.69 CSCNc1ccc(cc1Br)F 34a_100000738039_100011218213 [0,2,0,0,0,0|2,0,0]=4 9988 B12R1.69 CSCNc1ccc(cc1Br)O 34a_100012001276_100011218213 [0,2,0,0,0,0|1,0,0]=3 9989 B12R1.69 CSCNc1ccc(cc1C)Br 34a_100000211769_100011218213 [0,2,0,0,0,0|2,0,0]=4 9990 B12R1.69 CSCNc1ccc(cc1C)C 34a_100000736561_100011218213 [0,2,0,0,0,0|2,0,0]=4 9991 B12R1.69 CSCNc1ccc(cc1C)Cl 34a_100000210418_100011218213 [0,2,0,0,0,0|2,0,0]=4 9992 B12R1.69 CSCNc1ccc(cc1C)F 34a_100000211637_100011218213 [0,2,0,0,0,0|2,0,0]=4 9993 B12R1.69 CSCNc1ccc(cc1C)I 34a_100000184554_100011218213 [0,2,0,0,0,0|2,0,0]=4 9994 B12R1.69 CSCNc1ccc(cc1C)O 34a_100000756630_100011218213 [0,2,0,0,0,0|1,0,0]=3 9995 B12R1.69 CSCNc1ccc(cc1Cl)Br 34a_100000211467_100011218213 [0,2,0,0,0,0|2,0,0]=4 9996 B12R1.69 CSCNc1ccc(cc1Cl)C 34a_100000210522_100011218213 [0,2,0,0,0,0|2,0,0]=4 9997 B12R1.69 CSCNc1ccc(cc1Cl)Cl 34a_100000185861_100011218213 [0,2,0,0,0,0|2,0,0]=4 9998 B12R1.69 CSCNc1ccc(cc1Cl)F 34a_100000212003_100011218213 [0,2,0,0,0,0|2,0,0]=4 9999 B12R1.69 CSCNc1ccc(cc1Cl)I 34a_100011218065_100011218213 [0,2,0,0,0,0|2,0,0]=4 10000 B12R1.69 CSCNc1ccc(cc1Cl)O 34a_100011215599_100011218213 [0,2,0,0,0,0|1,0,0]=3 10001 B12R1.69 CSCNc1ccc(cc1F)Br 34a_100000210722_100011218213 [0,2,0,0,0,0|2,0,0]=4 10002 B12R1.69 CSCNc1ccc(cc1F)C 34a_100000211023_100011218213 [0,2,0,0,0,0|2,0,0]=4 10003 B12R1.69 CSCNc1ccc(cc1F)Cl 34a_100000211020_100011218213 [0,2,0,0,0,0|2,0,0]=4 10004 B12R1.69 CSCNc1ccc(cc1F)F 34a_100000210720_100011218213 [0,2,0,0,0,0|2,0,0]=4 10005 B12R1.69 CSCNc1ccc(cc1F)I 34a_100011215594_100011218213 [0,2,0,0,0,0|2,0,0]=4 10006 B12R1.69 CSCNc1ccc(cc1F)O 34a_100000759473_100011218213 [0,2,0,0,0,0|1,0,0]=3 10007 B12R1.69 CSCNc1ccc(cc1I)Br 34a_100000187925_100011218213 [0,2,0,0,0,0|2,0,0]=4 10008 B12R1.69 CSCNc1ccc(cc1I)C 34a_100011356834_100011218213 [0,2,0,0,0,0|2,0,0]=4 10009 B12R1.69 CSCNc1ccc(cc1I)Cl 34a_100000761889_100011218213 [0,2,0,0,0,0|2,0,0]=4 10010 B12R1.69 CSCNc1ccc(cc1I)F 34a_100000760547_100011218213 [0,2,0,0,0,0|2,0,0]=4 10011 B12R1.69 CSCNc1ccc(cc1I)O 34a_100010084370_100011218213 [0,2,0,0,0,0|1,0,0]=3 10012 B12R1.69 CSCNc1ccc(cc1O)Br 34a_100000739049_100011218213 [0,2,0,0,0,0|2,0,0]=4 10013 B12R1.69 CSCNc1ccc(cc1O)C 34a_100000211527_100011218213 [0,2,0,0,0,0|2,0,0]=4 10014 B12R1.69 CSCNc1ccc(cc1O)Cl 34a_100000185728_100011218213 [0,2,0,0,0,0|2,0,0]=4 10015 B12R1.69 CSCNc1ccc(cc1O)F 34a_100000753323_100011218213 [0,2,0,0,0,0|2,0,0]=4 10016 B12R1.69 CSCNc1ccc(cc1O)O 34a_100000106777_100011218213 [0,2,0,0,0,0|1,0,0]=3 10017 B12R1.69 CSCOc1ccc(cc1Br)Br 34a_100000188717_100011218213 [0,2,0,0,0,0|1,0,0]=3 10018 B12R1.69 CSCOc1ccc(cc1Br)C 34a_100000210800_100011218213 [0,2,0,0,0,0|1,0,0]=3 10019 B12R1.69 CSCOc1ccc(cc1Br)Cl 34a_100000211998_100011218213 [0,2,0,0,0,0|1,0,0]=3 10020 B12R1.69 CSCOc1ccc(cc1Br)F 34a_100000211999_100011218213 [0,2,0,0,0,0|1,0,0]=3 10021 B12R1.69 CSCOc1ccc(cc1Br)I 34a_100012361655_100011218213 [0,2,0,0,0,0|1,0,0]=3 10022 B12R1.69 CSCOc1ccc(cc1Br)N 34a_100011534360_100011218213 [0,2,0,0,0,0|1,0,0]=3 10023 B12R1.69 CSCOc1ccc(cc1C)Br 34a_100000186361_100011218213 [0,2,0,0,0,0|1,0,0]=3 10024 B12R1.69 CSCOc1ccc(cc1C)C 34a_100000211776_100011218213 [0,2,0,0,0,0|1,0,0]=3 10025 B12R1.69 CSCOc1ccc(cc1C)Cl 34a_100000211091_100011218213 [0,2,0,0,0,0|1,0,0]=3 10026 B12R1.69 CSCOc1ccc(cc1C)F 34a_100000764316_100011218213 [0,2,0,0,0,0|1,0,0]=3 10027 B12R1.69 CSCOc1ccc(cc1C)I 34a_100011218673_100011218213 [0,2,0,0,0,0|1,0,0]=3 10028 B12R1.69 CSCOc1ccc(cc1C)N 34a_100011218179_100011218213 [0,2,0,0,0,0|1,0,0]=3 10029 B12R1.69 CSCOc1ccc(cc1Cl)Br 34a_100000186472_100011218213 [0,2,0,0,0,0|1,0,0]=3 10030 B12R1.69 CSCOc1ccc(cc1Cl)C 34a_100000749699_100011218213 [0,2,0,0,0,0|1,0,0]=3 10031 B12R1.69 CSCOc1ccc(cc1Cl)Cl 34a_100015191787_100011218213 [0,2,0,0,0,0|1,0,0]=3 10032 B12R1.69 CSCOc1ccc(cc1Cl)F 34a_100000212004_100011218213 [0,2,0,0,0,0|1,0,0]=3 10033 B12R1.69 CSCOc1ccc(cc1Cl)I 34a_100012360047_100011218213 [0,2,0,0,0,0|1,0,0]=3 10034 B12R1.69 CSCOc1ccc(cc1Cl)N 34a_100000744943_100011218213 [0,2,0,0,0,0|1,0,0]=3 10035 B12R1.69 CSCOc1ccc(cc1F)Br 34a_100000185481_100011218213 [0,2,0,0,0,0|1,0,0]=3 10036 B12R1.69 CSCOc1ccc(cc1F)C 34a_100011216688_100011218213 [0,2,0,0,0,0|1,0,0]=3 10037 B12R1.69 CSCOc1ccc(cc1F)Cl 34a_100000230166_100011218213 [0,2,0,0,0,0|1,0,0]=3 10038 B12R1.69 CSCOc1ccc(cc1F)F 34a_100000230127_100011218213 [0,2,0,0,0,0|1,0,0]=3 10039 B12R1.69 CSCOc1ccc(cc1F)I 34a_100011356965_100011218213 [0,2,0,0,0,0|1,0,0]=3 10040 B12R1.69 CSCOc1ccc(cc1F)N 34a_100011220035_100011218213 [0,2,0,0,0,0|1,0,0]=3 10041 B12R1.69 CSCOc1ccc(cc1I)Br 34a_100012355227_100011218213 [0,2,0,0,0,0|1,0,0]=3 10042 B12R1.69 CSCOc1ccc(cc1I)C 34a_100000765521_100011218213 [0,2,0,0,0,0|1,0,0]=3 10043 B12R1.69 CSCOc1ccc(cc1I)Cl 34a_100011356953_100011218213 [0,2,0,0,0,0|1,0,0]=3 10044 B12R1.69 CSCOc1ccc(cc1I)F 34a_100012355409_100011218213 [0,2,0,0,0,0|1,0,0]=3 10045 B12R1.69 CSCOc1ccc(cc1N)Br 34a_100000752626_100011218213 [0,2,0,0,0,0|1,0,0]=3 10046 B12R1.69 CSCOc1ccc(cc1N)C 34a_100011215204_100011218213 [0,2,0,0,0,0|1,0,0]=3 10047 B12R1.69 CSCOc1ccc(cc1N)Cl 34a_100000210500_100011218213 [0,2,0,0,0,0|1,0,0]=3 10048 B12R1.69 CSCOc1ccc(cc1N)F 34a_100000759472_100011218213 [0,2,0,0,0,0|1,0,0]=3 10049 B12R1.69 CSCOc1ccc(cc1N)I 34a_100000753495_100011218213 [0,2,0,0,0,0|1,0,0]=3 10050 B12R1.69 CSCOc1ccc(cc1N)N 34a_100000725306_100011218213 [0,2,0,0,0,0|1,0,0]=3 10051 B12R1.69 CSCOc1ccc(nc1Br)Br 34a_100009999766_100011218213 [0,2,0,0,0,0|2,0,0]=4 10052 B12R1.69 CSCOc1ccc(nc1Br)C 34a_100000702858_100011218213 [0,2,0,0,0,0|2,0,0]=4 10053 B12R1.69 CSCOc1ccc(nc1Br)Cl 34a_100010219353_100011218213 [0,2,0,0,0,0|2,0,0]=4 10054 B12R1.69 CSCOc1ccc(nc1Br)F 34a_100009887730_100011218213 [0,2,0,0,0,0|2,0,0]=4 10055 B12R1.69 CSCOc1ccc(nc1Br)I 34a_100000725334_100011218213 [0,2,0,0,0,0|2,0,0]=4 10056 B12R1.69 CSCOc1ccc(nc1C)Br 34a_100012002022_100011218213 [0,2,0,0,0,0|2,0,0]=4 10057 B12R1.69 CSCOc1ccc(nc1C)C 34a_100011218912_100011218213 [0,2,0,0,0,0|2,0,0]=4 10058 B12R1.69 CSCOc1ccc(nc1C)Cl 34a_100012184626_100011218213 [0,2,0,0,0,0|2,0,0]=4 10059 B12R1.69 CSCOc1ccc(nc1C)F 34a_100009881036_100011218213 [0,2,0,0,0,0|2,0,0]=4 10060 B12R1.69 CSCOc1ccc(nc1C)I 34a_100010233687_100011218213 [0,2,0,0,0,0|2,0,0]=4 10061 B12R1.69 CSCOc1ccc(nc1Cl)Br 34a_100010246206_100011218213 [0,2,0,0,0,0|2,0,0]=4 10062 B12R1.69 CSCOc1ccc(nc1Cl)C 34a_100000086286_100011218213 [0,2,0,0,0,0|2,0,0]=4 10063 B12R1.69 CSCOc1ccc(nc1Cl)Cl 34a_100000101165_100011218213 [0,2,0,0,0,0|2,0,0]=4 10064 B12R1.69 CSCOc1ccc(nc1Cl)I 34a_100000721234_100011218213 [0,2,0,0,0,0|2,0,0]=4 10065 B12R1.69 CSCOc1ccc(nc1F)Br 34a_100009819667_100011218213 [0,2,0,0,0,0|2,0,0]=4 10066 B12R1.69 CSCOc1ccc(nc1F)C 34a_100000079963_100011218213 [0,2,0,0,0,0|2,0,0]=4 10067 B12R1.69 CSCOc1ccc(nc1F)Cl 34a_100009880201_100011218213 [0,2,0,0,0,0|2,0,0]=4 10068 B12R1.69 CSCOc1ccc(nc1F)F 34a_100000101184_100011218213 [0,2,0,0,0,0|2,0,0]=4 10069 B12R1.69 CSCOc1ccc(nc1I)Br 34a_100010253912_100011218213 [0,2,0,0,0,0|2,0,0]=4 10070 B12R1.69 CSCOc1ccc(nc1I)C 34a_100000023897_100011218213 [0,2,0,0,0,0|2,0,0]=4 10071 B12R1.69 CSCOc1ccc(nc1I)Cl 34a_100000696390_100011218213 [0,2,0,0,0,0|2,0,0]=4 10072 B12R1.69 CSCOc1ccc(nc1I)F 34a_100010382442_100011218213 [0,2,0,0,0,0|2,0,0]=4 10073 B12R1.69 CSCOc1ccc(nc1N)Br 34a_100000685527_100011218213 [0,2,0,0,0,0|2,0,0]=4 10074 B12R1.69 CSCOc1ccc(nc1N)C 34a_100000694039_100011218213 [0,2,0,0,0,0|2,0,0]=4 10075 B12R1.69 CSCOc1ccc(nc1N)Cl 34a_100000717809_100011218213 [0,2,0,0,0,0|2,0,0]=4 10076 B12R1.69 CSCOc1cnc(cc1Br)C 34a_100009843476_100011218213 [0,2,0,0,0,0|2,0,0]=4 10077 B12R1.69 CSCOc1cnc(cc1C)C 34a_200000068632_100011218213 [0,2,0,0,0,0|2,0,0]=4 10078 B12R1.69 CSCOc1cnc(cc1C)Cl 34a_100000692680_100011218213 [0,2,0,0,0,0|2,0,0]=4 10079 B12R1.69 CSCOc1cnc(cc1C)F 34a_100009856773_100011218213 [0,2,0,0,0,0|2,0,0]=4 10080 B12R1.69 CSCOc1cnc(cc1Cl)Cl 34a_100009868576_100011218213 [0,2,0,0,0,0|2,0,0]=4 10081 B12R1.69 CSCOc1cnc(cc1F)F 34a_100009885687_100011218213 [0,2,0,0,0,0|2,0,0]=4 10082 B12R1.69 CSCOc1cnc(cc1I)Cl 34a_100000698892_100011218213 [0,2,0,0,0,0|2,0,0]=4 10083 B12R1.69 CSCOc1cnc(cc1N)Br 34a_100009819941_100011218213 [0,2,0,0,0,0|2,0,0]=4 10084 B12R1.69 CSCOc1coc(cc1=O)C 34a_100000081520_100011218213 [0,2,0,0,0,0|2,0,0]=4 10085 B12R1.69 CSCOc1ncc(cc1Br)Br 34a_100000701035_100011218213 [0,2,0,0,0,0|2,0,0]=4 10086 B12R1.69 CSCOc1ncc(cc1Br)C 34a_100000719714_100011218213 [0,2,0,0,0,0|2,0,0]=4 10087 B12R1.69 CSCOc1ncc(cc1C)Br 34a_100000685391_100011218213 [0,2,0,0,0,0|2,0,0]=4 10088 B12R1.69 CSCOc1ncc(cc1Cl)Br 34a_100012339560_100011218213 [0,2,0,0,0,0|2,0,0]=4 10089 B12R1.69 CSCOc1ncc(cc1Cl)F 34a_100009847679_100011218213 [0,2,0,0,0,0|2,0,0]=4 10090 B12R1.69 CSCOc1ncc(cc1F)Cl 34a_100011998252_100011218213 [0,2,0,0,0,0|2,0,0]=4 10091 B12R1.69 CSCOc1ncc(cc1F)F 34a_100012025737_100011218213 [0,2,0,0,0,0|2,0,0]=4 10092 B12R1.69 CSCOc1ncc(cc1N)Br 34a_100000743729_100011218213 [0,2,0,0,0,0|2,0,0]=4 10093 B12R1.69 CSCOc1ncc(cc1N)C 34a_100012000488_100011218213 [0,2,0,0,0,0|2,0,0]=4 10094 B12R1.69 CSCOc1ncc(cc1N)Cl 34a_100011998249_100011218213 [0,2,0,0,0,0|2,0,0]=4 10095 B12R1.69 CSCSc1ccc(cc1Br)Br 62a_100011218213_100011484698 [0,2,0,0,0,0|1,1,0]=4 10096 B12R1.69 CSCSc1ccc(cc1Br)Br 62a_100011484698_100011218213 [0,2,0,0,0,0|1,1,0]=4 10097 B12R1.69 CSCSc1ccc(cc1Br)C 62a_100009813563_100011218213 [0,2,0,0,0,0|1,1,0]=4 10098 B12R1.69 CSCSc1ccc(cc1Br)C 62a_100011218213_100009813563 [0,2,0,0,0,0|1,1,0]=4 10099 B12R1.69 CSCSc1ccc(cc1Br)Cl 62a_100011218213_100011219703 [0,2,0,0,0,0|1,1,0]=4 10100 B12R1.69 CSCSc1ccc(cc1Br)Cl 62a_100011219703_100011218213 [0,2,0,0,0,0|1,1,0]=4 10101 B12R1.69 CSCSc1ccc(cc1Br)F 62a_100011217111_100011218213 [0,2,0,0,0,0|1,1,0]=4 10102 B12R1.69 CSCSc1ccc(cc1Br)F 62a_100011218213_100011217111 [0,2,0,0,0,0|1,1,0]=4 10103 B12R1.69 CSCSc1ccc(cc1Br)N 62a_100000750458_100011218213 [0,2,0,0,0,0|1,1,0]=4 10104 B12R1.69 CSCSc1ccc(cc1Br)N 62a_100011218213_100000750458 [0,2,0,0,0,0|1,1,0]=4 10105 B12R1.69 CSCSc1ccc(cc1Br)O 62a_100000701344_100011218213 [0,2,0,0,0,0|0,1,0]=3 10106 B12R1.69 CSCSc1ccc(cc1Br)O 62a_100011218213_100000701344 [0,2,0,0,0,0|0,1,0]=3 10107 B12R1.69 CSCSc1ccc(cc1C)Br 62a_100000701812_100011218213 [0,2,0,0,0,0|1,1,0]=4 10108 B12R1.69 CSCSc1ccc(cc1C)Br 62a_100011218213_100000701812 [0,2,0,0,0,0|1,1,0]=4 10109 B12R1.69 CSCSc1ccc(cc1C)C 62a_100011217332_100011218213 [0,2,0,0,0,0|1,1,0]=4 10110 B12R1.69 CSCSc1ccc(cc1C)C 62a_100011218213_100011217332 [0,2,0,0,0,0|1,1,0]=4 10111 B12R1.69 CSCSc1ccc(cc1C)Cl 62a_100011218213_100011219607 [0,2,0,0,0,0|1,1,0]=4 10112 B12R1.69 CSCSc1ccc(cc1C)Cl 62a_100011219607_100011218213 [0,2,0,0,0,0|1,1,0]=4 10113 B12R1.69 CSCSc1ccc(cc1C)F 62a_100011205405_100011218213 [0,2,0,0,0,0|1,1,0]=4 10114 B12R1.69 CSCSc1ccc(cc1C)F 62a_100011218213_100011205405 [0,2,0,0,0,0|1,1,0]=4 10115 B12R1.69 CSCSc1ccc(cc1C)N 62a_100000210723_100011218213 [0,2,0,0,0,0|1,1,0]=4 10116 B12R1.69 CSCSc1ccc(cc1C)N 62a_100011218213_100000210723 [0,2,0,0,0,0|1,1,0]=4 10117 B12R1.69 CSCSc1ccc(cc1C)O 62a_100011218213_100000690111 [0,2,0,0,0,0|0,1,0]=3 10118 B12R1.69 CSCSc1ccc(cc1Cl)Br 62a_100011216062_100011218213 [0,2,0,0,0,0|1,1,0]=4 10119 B12R1.69 CSCSc1ccc(cc1Cl)Br 62a_100011218213_100011216062 [0,2,0,0,0,0|1,1,0]=4 10120 B12R1.69 CSCSc1ccc(cc1Cl)C 62a_100011218213_100011263221 [0,2,0,0,0,0|1,1,0]=4 10121 B12R1.69 CSCSc1ccc(cc1Cl)C 62a_100011263221_100011218213 [0,2,0,0,0,0|1,1,0]=4 10122 B12R1.69 CSCSc1ccc(cc1Cl)Cl 62a_100000699841_100011218213 [0,2,0,0,0,0|1,1,0]=4 10123 B12R1.69 CSCSc1ccc(cc1Cl)Cl 62a_100011218213_100000699841 [0,2,0,0,0,0|1,1,0]=4 10124 B12R1.69 CSCSc1ccc(cc1Cl)F 62a_100000733362_100011218213 [0,2,0,0,0,0|1,1,0]=4 10125 B12R1.69 CSCSc1ccc(cc1Cl)F 62a_100011218213_100000733362 [0,2,0,0,0,0|1,1,0]=4 10126 B12R1.69 CSCSc1ccc(cc1Cl)N 62a_100000761885_100011218213 [0,2,0,0,0,0|1,1,0]=4 10127 B12R1.69 CSCSc1ccc(cc1Cl)N 62a_100011218213_100000761885 [0,2,0,0,0,0|1,1,0]=4 10128 B12R1.69 CSCSc1ccc(cc1Cl)O 62a_100000047559_100011218213 [0,2,0,0,0,0|0,1,0]=3 10129 B12R1.69 CSCSc1ccc(cc1Cl)O 62a_100011218213_100000047559 [0,2,0,0,0,0|0,1,0]=3 10130 B12R1.69 CSCSc1ccc(cc1F)Br 62a_100009814013_100011218213 [0,2,0,0,0,0|1,1,0]=4 10131 B12R1.69 CSCSc1ccc(cc1F)Br 62a_100011218213_100009814013 [0,2,0,0,0,0|1,1,0]=4 10132 B12R1.69 CSCSc1ccc(cc1F)C 62a_100011216119_100011218213 [0,2,0,0,0,0|1,1,0]=4 10133 B12R1.69 CSCSc1ccc(cc1F)C 62a_100011218213_100011216119 [0,2,0,0,0,0|1,1,0]=4 10134 B12R1.69 CSCSc1ccc(cc1F)Cl 62a_100011216042_100011218213 [0,2,0,0,0,0|1,1,0]=4 10135 B12R1.69 CSCSc1ccc(cc1F)Cl 62a_100011218213_100011216042 [0,2,0,0,0,0|1,1,0]=4 10136 B12R1.69 CSCSc1ccc(cc1F)F 62a_100000750030_100011218213 [0,2,0,0,0,0|1,1,0]=4 10137 B12R1.69 CSCSc1ccc(cc1F)F 62a_100011218213_100000750030 [0,2,0,0,0,0|1,1,0]=4 10138 B12R1.69 CSCSc1ccc(cc1F)N 62a_100011218213_100011356925 [0,2,0,0,0,0|1,1,0]=4 10139 B12R1.69 CSCSc1ccc(cc1F)N 62a_100011356925_100011218213 [0,2,0,0,0,0|1,1,0]=4 10140 B12R1.69 CSCSc1ccc(cc1F)O 62a_100000755031_100011218213 [0,2,0,0,0,0|0,1,0]=3 10141 B12R1.69 CSCSc1ccc(cc1F)O 62a_100011218213_100000755031 [0,2,0,0,0,0|0,1,0]=3 10142 B12R1.69 CSCSc1ccc(cc1N)Br 62a_100000743836_100011218213 [0,2,0,0,0,0|1,1,0]=4 10143 B12R1.69 CSCSc1ccc(cc1N)Br 62a_100011218213_100000743836 [0,2,0,0,0,0|1,1,0]=4 10144 B12R1.69 CSCSc1ccc(cc1N)C 62a_100011216686_100011218213 [0,2,0,0,0,0|1,1,0]=4 10145 B12R1.69 CSCSc1ccc(cc1N)C 62a_100011218213_100011216686 [0,2,0,0,0,0|1,1,0]=4 10146 B12R1.69 CSCSc1ccc(cc1N)Cl 62a_100000761886_100011218213 [0,2,0,0,0,0|1,1,0]=4 10147 B12R1.69 CSCSc1ccc(cc1N)Cl 62a_100011218213_100000761886 [0,2,0,0,0,0|1,1,0]=4 10148 B12R1.69 CSCSc1ccc(cc1N)F 62a_100000687223_100011218213 [0,2,0,0,0,0|1,1,0]=4 10149 B12R1.69 CSCSc1ccc(cc1N)F 62a_100011218213_100000687223 [0,2,0,0,0,0|1,1,0]=4 10150 B12R1.69 CSCSc1ccc(cc1N)N 62a_100011218213_200012175722 [0,2,0,0,0,0|1,1,0]=4 10151 B12R1.69 CSCSc1ccc(cc1N)N 62a_200012175722_100011218213 [0,2,0,0,0,0|1,1,0]=4 10152 B12R1.69 CSCSc1ccc(cc1N)O 62a_100011218213_100011999798 [0,2,0,0,0,0|0,1,0]=3 10153 B12R1.69 CSCSc1ccc(cc1N)O 62a_100011999798_100011218213 [0,2,0,0,0,0|0,1,0]=3 10154 B12R1.69 CSCSc1ccc(cc1O)Br 62a_100011218213_100012344904 [0,2,0,0,0,0|1,1,0]=4 10155 B12R1.69 CSCSc1ccc(cc1O)Br 62a_100012344904_100011218213 [0,2,0,0,0,0|1,1,0]=4 10156 B12R1.69 CSCSc1ccc(cc1O)C 62a_100011218213_100012002257 [0,2,0,0,0,0|1,1,0]=4 10157 B12R1.69 CSCSc1ccc(cc1O)C 62a_100012002257_100011218213 [0,2,0,0,0,0|1,1,0]=4 10158 B12R1.69 CSCSc1ccc(cc1O)Cl 62a_100000050036_100011218213 [0,2,0,0,0,0|1,1,0]=4 10159 B12R1.69 CSCSc1ccc(cc1O)Cl 62a_100011218213_100000050036 [0,2,0,0,0,0|1,1,0]=4 10160 B12R1.69 CSCSc1ccc(cc1O)F 62a_100000690578_100011218213 [0,2,0,0,0,0|1,1,0]=4 10161 B12R1.69 CSCSc1ccc(cc1O)F 62a_100011218213_100000690578 [0,2,0,0,0,0|1,1,0]=4 10162 B12R1.69 CSCSc1ccc(cc1O)O 62a_100011218213_100009813921 [0,2,0,0,0,0|0,1,0]=3 10163 B12R1.69 CSCSc1ccc(nc1C)O 62a_100000691680_100011218213 [0,2,0,0,0,0|1,1,0]=4 10164 B12R1.69 CSCSc1ccc(nc1C)O 62a_100011218213_100000691680 [0,2,0,0,0,0|1,1,0]=4 10165 B12R1.69 CSCSc1ccc(nc1F)O 62a_100009879308_100011218213 [0,2,0,0,0,0|1,1,0]=4 10166 B12R1.69 CSCSc1ccc(nc1F)O 62a_100011218213_100009879308 [0,2,0,0,0,0|1,1,0]=4 10167 B12R1.69 CSCSc1cnc(cc1C)O 62a_100000766222_100011218213 [0,2,0,0,0,0|1,1,0]=4 10168 B12R1.69 CSCSc1cnc(cc1C)O 62a_100011218213_100000766222 [0,2,0,0,0,0|1,1,0]=4 10169 B12R1.69 CSCSc1ncc(cc1C)O 62a_100011218213_100012000486 [0,2,0,0,0,0|1,1,0]=4 10170 B12R1.69 CSCSc1ncc(cc1C)O 62a_100012000486_100011218213 [0,2,0,0,0,0|1,1,0]=4 10171 B12R1.69 CSCSc1ncc(cc1F)O 62a_100011218213_100000063512 [0,2,0,0,0,0|1,1,0]=4 10172 B12R1.69 Cc1cc(=O)c(co1)OCCF 34a_100000081520_100011217306 [0,2,0,0,0,0|2,0,0]=4 10173 B12R1.69 Cc1cc(=O)c(co1)OCCO 34a_100000081520_100000211926 [0,2,0,0,0,0|2,0,0]=4 10174 B12R1.69 Cc1cc(c(cn1)OCCF)Br 34a_100009843476_100011217306 [0,2,0,0,0,0|2,0,0]=4 10175 B12R1.69 Cc1cc(c(cn1)OCCF)Br 7a_100009843476_100011217306 [0,2,0,0,0,0|2,0,0]=4 10176 B12R1.69 Cc1cc(c(cn1)OCCF)C 34a_200000068632_100011217306 [0,2,0,0,0,0|2,0,0]=4 10177 B12R1.69 Cc1cc(c(cn1)OCCF)C 7a_200000068632_100011217306 [0,2,0,0,0,0|2,0,0]=4 10178 B12R1.69 Cc1cc(c(cn1)OCCO)Br 34a_100009843476_100000211926 [0,2,0,0,0,0|2,0,0]=4 10179 B12R1.69 Cc1cc(c(cn1)OCCO)Br 7a_100009843476_100000211926 [0,2,0,0,0,0|2,0,0]=4 10180 B12R1.69 Cc1cc(c(cn1)OCCO)C 34a_200000068632_100000211926 [0,2,0,0,0,0|2,0,0]=4 10181 B12R1.69 Cc1cc(c(cn1)OCCO)C 7a_200000068632_100000211926 [0,2,0,0,0,0|2,0,0]=4 10182 B12R1.69 Cc1cc(ccc1COCF)Br 34a_100000748258_100015361967 [0,2,0,0,0,0|2,0,0]=4 10183 B12R1.69 Cc1cc(ccc1COCF)Br 7a_100000748258_100015361967 [0,2,0,0,0,0|2,0,0]=4 10184 B12R1.69 Cc1cc(ccc1COCF)Cl 34a_100000702939_100015361967 [0,2,0,0,0,0|2,0,0]=4 10185 B12R1.69 Cc1cc(ccc1COCF)Cl 7a_100000702939_100015361967 [0,2,0,0,0,0|2,0,0]=4 10186 B12R1.69 Cc1cc(ccc1COCF)F 34a_100000700136_100015361967 [0,2,0,0,0,0|2,0,0]=4 10187 B12R1.69 Cc1cc(ccc1COCF)F 7a_100000700136_100015361967 [0,2,0,0,0,0|2,0,0]=4 10188 B12R1.69 Cc1cc(ccc1COCF)N 34a_100000102464_100015361967 [0,2,0,0,0,0|2,0,0]=4 10189 B12R1.69 Cc1cc(ccc1COCF)N 7a_100000102464_100015361967 [0,2,0,0,0,0|2,0,0]=4 10190 B12R1.69 Cc1cc(ccc1NCC=O)O 34a_100000756630_200009817547 [0,2,0,0,0,0|1,0,1]=4 10191 B12R1.69 Cc1cc(ccc1NCCF)Br 34a_100000211769_100011217306 [0,2,0,0,0,0|2,0,0]=4 10192 B12R1.69 Cc1cc(ccc1NCCF)Br 7a_100000211769_100011217306 [0,2,0,0,0,0|2,0,0]=4 10193 B12R1.69 Cc1cc(ccc1NCCF)Cl 34a_100000210418_100011217306 [0,2,0,0,0,0|2,0,0]=4 10194 B12R1.69 Cc1cc(ccc1NCCF)Cl 7a_100000210418_100011217306 [0,2,0,0,0,0|2,0,0]=4 10195 B12R1.69 Cc1cc(ccc1NCCF)F 34a_100000211637_100011217306 [0,2,0,0,0,0|2,0,0]=4 10196 B12R1.69 Cc1cc(ccc1NCCF)F 7a_100000211637_100011217306 [0,2,0,0,0,0|2,0,0]=4 10197 B12R1.69 Cc1cc(ccc1NCCF)I 34a_100000184554_100011217306 [0,2,0,0,0,0|2,0,0]=4 10198 B12R1.69 Cc1cc(ccc1NCCF)I 7a_100000184554_100011217306 [0,2,0,0,0,0|2,0,0]=4 10199 B12R1.69 Cc1cc(ccc1NCCF)O 34a_100000756630_100011217306 [0,2,0,0,0,0|1,0,0]=3 10200 B12R1.69 Cc1cc(ccc1NCCO)Br 34a_100000211769_100000211926 [0,2,0,0,0,0|2,0,0]=4 10201 B12R1.69 Cc1cc(ccc1NCCO)Br 7a_100000211769_100000211926 [0,2,0,0,0,0|2,0,0]=4 10202 B12R1.69 Cc1cc(ccc1NCCO)Cl 34a_100000210418_100000211926 [0,2,0,0,0,0|2,0,0]=4 10203 B12R1.69 Cc1cc(ccc1NCCO)Cl 7a_100000210418_100000211926 [0,2,0,0,0,0|2,0,0]=4 10204 B12R1.69 Cc1cc(ccc1NCCO)F 34a_100000211637_100000211926 [0,2,0,0,0,0|2,0,0]=4 10205 B12R1.69 Cc1cc(ccc1NCCO)F 7a_100000211637_100000211926 [0,2,0,0,0,0|2,0,0]=4 10206 B12R1.69 Cc1cc(ccc1NCCO)I 34a_100000184554_100000211926 [0,2,0,0,0,0|2,0,0]=4 10207 B12R1.69 Cc1cc(ccc1NCCO)I 7a_100000184554_100000211926 [0,2,0,0,0,0|2,0,0]=4 10208 B12R1.69 Cc1cc(ccc1NCCO)O 34a_100000756630_100000211926 [0,2,0,0,0,0|1,0,0]=3 10209 B12R1.69 Cc1cc(ccc1OCC#N)Br 7a_100000186361_100011215382 [0,2,0,0,0,0|1,0,1]=4 10210 B12R1.69 Cc1cc(ccc1OCC#N)Cl 7a_100000211091_100011215382 [0,2,0,0,0,0|1,0,1]=4 10211 B12R1.69 Cc1cc(ccc1OCC#N)F 7a_100000764316_100011215382 [0,2,0,0,0,0|1,0,1]=4 10212 B12R1.69 Cc1cc(ccc1OCC#N)I 7a_100011218673_100011215382 [0,2,0,0,0,0|1,0,1]=4 10213 B12R1.69 Cc1cc(ccc1OCC#N)N 7a_100011218179_100011215382 [0,2,0,0,0,0|1,0,1]=4 10214 B12R1.69 Cc1cc(ccc1OCC=O)Br 34a_100000186361_200009817547 [0,2,0,0,0,0|1,0,1]=4 10215 B12R1.69 Cc1cc(ccc1OCC=O)Br 7a_100000186361_200015260668 [0,2,0,0,0,0|1,0,1]=4 10216 B12R1.69 Cc1cc(ccc1OCC=O)Cl 34a_100000211091_200009817547 [0,2,0,0,0,0|1,0,1]=4 10217 B12R1.69 Cc1cc(ccc1OCC=O)Cl 7a_100000211091_200015260668 [0,2,0,0,0,0|1,0,1]=4 10218 B12R1.69 Cc1cc(ccc1OCC=O)F 34a_100000764316_200009817547 [0,2,0,0,0,0|1,0,1]=4 10219 B12R1.69 Cc1cc(ccc1OCC=O)F 7a_100000764316_200015260668 [0,2,0,0,0,0|1,0,1]=4 10220 B12R1.69 Cc1cc(ccc1OCC=O)I 34a_100011218673_200009817547 [0,2,0,0,0,0|1,0,1]=4 10221 B12R1.69 Cc1cc(ccc1OCC=O)I 7a_100011218673_200015260668 [0,2,0,0,0,0|1,0,1]=4 10222 B12R1.69 Cc1cc(ccc1OCC=O)N 34a_100011218179_200009817547 [0,2,0,0,0,0|1,0,1]=4 10223 B12R1.69 Cc1cc(ccc1OCC=O)N 7a_100011218179_200015260668 [0,2,0,0,0,0|1,0,1]=4 10224 B12R1.69 Cc1cc(ccc1OCCF)Br 34a_100000186361_100011217306 [0,2,0,0,0,0|1,0,0]=3 10225 B12R1.69 Cc1cc(ccc1OCCF)Br 7a_100000186361_100011217306 [0,2,0,0,0,0|1,0,0]=3 10226 B12R1.69 Cc1cc(ccc1OCCF)Cl 34a_100000211091_100011217306 [0,2,0,0,0,0|1,0,0]=3 10227 B12R1.69 Cc1cc(ccc1OCCF)Cl 7a_100000211091_100011217306 [0,2,0,0,0,0|1,0,0]=3 10228 B12R1.69 Cc1cc(ccc1OCCF)F 34a_100000764316_100011217306 [0,2,0,0,0,0|1,0,0]=3 10229 B12R1.69 Cc1cc(ccc1OCCF)F 7a_100000764316_100011217306 [0,2,0,0,0,0|1,0,0]=3 10230 B12R1.69 Cc1cc(ccc1OCCF)I 34a_100011218673_100011217306 [0,2,0,0,0,0|1,0,0]=3 10231 B12R1.69 Cc1cc(ccc1OCCF)I 7a_100011218673_100011217306 [0,2,0,0,0,0|1,0,0]=3 10232 B12R1.69 Cc1cc(ccc1OCCF)N 34a_100011218179_100011217306 [0,2,0,0,0,0|1,0,0]=3 10233 B12R1.69 Cc1cc(ccc1OCCF)N 7a_100011218179_100011217306 [0,2,0,0,0,0|1,0,0]=3 10234 B12R1.69 Cc1cc(ccc1OCCO)Br 34a_100000186361_100000211926 [0,2,0,0,0,0|1,0,0]=3 10235 B12R1.69 Cc1cc(ccc1OCCO)Br 7a_100000186361_100000211926 [0,2,0,0,0,0|1,0,0]=3 10236 B12R1.69 Cc1cc(ccc1OCCO)Cl 34a_100000211091_100000211926 [0,2,0,0,0,0|1,0,0]=3 10237 B12R1.69 Cc1cc(ccc1OCCO)Cl 7a_100000211091_100000211926 [0,2,0,0,0,0|1,0,0]=3 10238 B12R1.69 Cc1cc(ccc1OCCO)F 34a_100000764316_100000211926 [0,2,0,0,0,0|1,0,0]=3 10239 B12R1.69 Cc1cc(ccc1OCCO)F 7a_100000764316_100000211926 [0,2,0,0,0,0|1,0,0]=3 10240 B12R1.69 Cc1cc(ccc1OCCO)I 34a_100011218673_100000211926 [0,2,0,0,0,0|1,0,0]=3 10241 B12R1.69 Cc1cc(ccc1OCCO)I 7a_100011218673_100000211926 [0,2,0,0,0,0|1,0,0]=3 10242 B12R1.69 Cc1cc(ccc1OCCO)N 34a_100011218179_100000211926 [0,2,0,0,0,0|1,0,0]=3 10243 B12R1.69 Cc1cc(ccc1OCCO)N 7a_100011218179_100000211926 [0,2,0,0,0,0|1,0,0]=3 10244 B12R1.69 Cc1cc(ccc1SCC#N)O 62a_100011215382_100000690111 [0,2,0,0,0,0|0,1,1]=4 10245 B12R1.69 Cc1cc(ccc1SCC=O)O 62a_200015260668_100000690111 [0,2,0,0,0,0|0,1,1]=4 10246 B12R1.69 Cc1cc(ccc1SCCF)Br 62a_100000701812_100011217306 [0,2,0,0,0,0|1,1,0]=4 10247 B12R1.69 Cc1cc(ccc1SCCF)Br 62a_100011217306_100000701812 [0,2,0,0,0,0|1,1,0]=4 10248 B12R1.69 Cc1cc(ccc1SCCF)Cl 62a_100011217306_100011219607 [0,2,0,0,0,0|1,1,0]=4 10249 B12R1.69 Cc1cc(ccc1SCCF)Cl 62a_100011219607_100011217306 [0,2,0,0,0,0|1,1,0]=4 10250 B12R1.69 Cc1cc(ccc1SCCF)F 62a_100011205405_100011217306 [0,2,0,0,0,0|1,1,0]=4 10251 B12R1.69 Cc1cc(ccc1SCCF)F 62a_100011217306_100011205405 [0,2,0,0,0,0|1,1,0]=4 10252 B12R1.69 Cc1cc(ccc1SCCF)N 62a_100000210723_100011217306 [0,2,0,0,0,0|1,1,0]=4 10253 B12R1.69 Cc1cc(ccc1SCCF)N 62a_100011217306_100000210723 [0,2,0,0,0,0|1,1,0]=4 10254 B12R1.69 Cc1cc(ccc1SCCF)O 62a_100011217306_100000690111 [0,2,0,0,0,0|0,1,0]=3 10255 B12R1.69 Cc1cc(ccc1SCCO)Br 62a_100000211926_100000701812 [0,2,0,0,0,0|1,1,0]=4 10256 B12R1.69 Cc1cc(ccc1SCCO)Br 62a_100000701812_100000211926 [0,2,0,0,0,0|1,1,0]=4 10257 B12R1.69 Cc1cc(ccc1SCCO)Cl 62a_100000211926_100011219607 [0,2,0,0,0,0|1,1,0]=4 10258 B12R1.69 Cc1cc(ccc1SCCO)Cl 62a_100011219607_100000211926 [0,2,0,0,0,0|1,1,0]=4 10259 B12R1.69 Cc1cc(ccc1SCCO)F 62a_100000211926_100011205405 [0,2,0,0,0,0|1,1,0]=4 10260 B12R1.69 Cc1cc(ccc1SCCO)F 62a_100011205405_100000211926 [0,2,0,0,0,0|1,1,0]=4 10261 B12R1.69 Cc1cc(ccc1SCCO)N 62a_100000210723_100000211926 [0,2,0,0,0,0|1,1,0]=4 10262 B12R1.69 Cc1cc(ccc1SCCO)N 62a_100000211926_100000210723 [0,2,0,0,0,0|1,1,0]=4 10263 B12R1.69 Cc1cc(ccc1SCCO)O 62a_100000211926_100000690111 [0,2,0,0,0,0|0,1,0]=3 10264 B12R1.69 Cc1cc(cnc1OCCF)Br 34a_100000685391_100011217306 [0,2,0,0,0,0|2,0,0]=4 10265 B12R1.69 Cc1cc(cnc1OCCO)Br 34a_100000685391_100000211926 [0,2,0,0,0,0|2,0,0]=4 10266 B12R1.69 Cc1cc(cnc1SCCF)O 62a_100011217306_100012000486 [0,2,0,0,0,0|1,1,0]=4 10267 B12R1.69 Cc1cc(cnc1SCCF)O 62a_100012000486_100011217306 [0,2,0,0,0,0|1,1,0]=4 10268 B12R1.69 Cc1cc(cnc1SCCO)O 62a_100000211926_100012000486 [0,2,0,0,0,0|1,1,0]=4 10269 B12R1.69 Cc1cc(cnc1SCCO)O 62a_100012000486_100000211926 [0,2,0,0,0,0|1,1,0]=4 10270 B12R1.69 Cc1cc(ncc1OCCF)Cl 34a_100000692680_100011217306 [0,2,0,0,0,0|2,0,0]=4 10271 B12R1.69 Cc1cc(ncc1OCCF)Cl 7a_100000692680_100011217306 [0,2,0,0,0,0|2,0,0]=4 10272 B12R1.69 Cc1cc(ncc1OCCF)F 34a_100009856773_100011217306 [0,2,0,0,0,0|2,0,0]=4 10273 B12R1.69 Cc1cc(ncc1OCCF)F 7a_100009856773_100011217306 [0,2,0,0,0,0|2,0,0]=4 10274 B12R1.69 Cc1cc(ncc1OCCO)Cl 34a_100000692680_100000211926 [0,2,0,0,0,0|2,0,0]=4 10275 B12R1.69 Cc1cc(ncc1OCCO)Cl 7a_100000692680_100000211926 [0,2,0,0,0,0|2,0,0]=4 10276 B12R1.69 Cc1cc(ncc1OCCO)F 34a_100009856773_100000211926 [0,2,0,0,0,0|2,0,0]=4 10277 B12R1.69 Cc1cc(ncc1OCCO)F 7a_100009856773_100000211926 [0,2,0,0,0,0|2,0,0]=4 10278 B12R1.69 Cc1cc(ncc1SCCF)O 62a_100000766222_100011217306 [0,2,0,0,0,0|1,1,0]=4 10279 B12R1.69 Cc1cc(ncc1SCCF)O 62a_100011217306_100000766222 [0,2,0,0,0,0|1,1,0]=4 10280 B12R1.69 Cc1cc(ncc1SCCO)O 62a_100000211926_100000766222 [0,2,0,0,0,0|1,1,0]=4 10281 B12R1.69 Cc1cc(ncc1SCCO)O 62a_100000766222_100000211926 [0,2,0,0,0,0|1,1,0]=4 10282 B12R1.69 Cc1ccc(c(c1)Br)NCCF 34a_100000210942_100011217306 [0,2,0,0,0,0|2,0,0]=4 10283 B12R1.69 Cc1ccc(c(c1)Br)NCCO 34a_100000210942_100000211926 [0,2,0,0,0,0|2,0,0]=4 10284 B12R1.69 Cc1ccc(c(c1)Br)OCC#N 7a_100000210800_100011215382 [0,2,0,0,0,0|1,0,1]=4 10285 B12R1.69 Cc1ccc(c(c1)Br)OCC=O 34a_100000210800_200009817547 [0,2,0,0,0,0|1,0,1]=4 10286 B12R1.69 Cc1ccc(c(c1)Br)OCC=O 7a_100000210800_200015260668 [0,2,0,0,0,0|1,0,1]=4 10287 B12R1.69 Cc1ccc(c(c1)Br)OCCF 34a_100000210800_100011217306 [0,2,0,0,0,0|1,0,0]=3 10288 B12R1.69 Cc1ccc(c(c1)Br)OCCF 7a_100000210800_100011217306 [0,2,0,0,0,0|1,0,0]=3 10289 B12R1.69 Cc1ccc(c(c1)Br)OCCO 34a_100000210800_100000211926 [0,2,0,0,0,0|1,0,0]=3 10290 B12R1.69 Cc1ccc(c(c1)Br)OCCO 7a_100000210800_100000211926 [0,2,0,0,0,0|1,0,0]=3 10291 B12R1.69 Cc1ccc(c(c1)Br)SCCF 62a_100009813563_100011217306 [0,2,0,0,0,0|1,1,0]=4 10292 B12R1.69 Cc1ccc(c(c1)Br)SCCF 62a_100011217306_100009813563 [0,2,0,0,0,0|1,1,0]=4 10293 B12R1.69 Cc1ccc(c(c1)Br)SCCO 62a_100000211926_100009813563 [0,2,0,0,0,0|1,1,0]=4 10294 B12R1.69 Cc1ccc(c(c1)Br)SCCO 62a_100009813563_100000211926 [0,2,0,0,0,0|1,1,0]=4 10295 B12R1.69 Cc1ccc(c(c1)C)CCN[13CH3] 2230a_100000745621_200025704644 [0,2,0,0,0,0|2,0,0]=4 10296 B12R1.69 Cc1ccc(c(c1)C)CCN[13CH3] 34a_100000745621_200025704644 [0,2,0,0,0,0|2,0,0]=4 10297 B12R1.69 Cc1ccc(c(c1)C)COCF 34a_100011215341_100015361967 [0,2,0,0,0,0|2,0,0]=4 10298 B12R1.69 Cc1ccc(c(c1)C)COCF 7a_100011215341_100015361967 [0,2,0,0,0,0|2,0,0]=4 10299 B12R1.69 Cc1ccc(c(c1)C)NCCF 34a_100000736561_100011217306 [0,2,0,0,0,0|2,0,0]=4 10300 B12R1.69 Cc1ccc(c(c1)C)NCCF 7a_100000736561_100011217306 [0,2,0,0,0,0|2,0,0]=4 10301 B12R1.69 Cc1ccc(c(c1)C)NCCO 34a_100000736561_100000211926 [0,2,0,0,0,0|2,0,0]=4 10302 B12R1.69 Cc1ccc(c(c1)C)NCCO 7a_100000736561_100000211926 [0,2,0,0,0,0|2,0,0]=4 10303 B12R1.69 Cc1ccc(c(c1)C)OCC#N 7a_100000211776_100011215382 [0,2,0,0,0,0|1,0,1]=4 10304 B12R1.69 Cc1ccc(c(c1)C)OCC=O 34a_100000211776_200009817547 [0,2,0,0,0,0|1,0,1]=4 10305 B12R1.69 Cc1ccc(c(c1)C)OCC=O 7a_100000211776_200015260668 [0,2,0,0,0,0|1,0,1]=4 10306 B12R1.69 Cc1ccc(c(c1)C)OCCF 34a_100000211776_100011217306 [0,2,0,0,0,0|1,0,0]=3 10307 B12R1.69 Cc1ccc(c(c1)C)OCCF 7a_100000211776_100011217306 [0,2,0,0,0,0|1,0,0]=3 10308 B12R1.69 Cc1ccc(c(c1)C)OCCO 34a_100000211776_100000211926 [0,2,0,0,0,0|1,0,0]=3 10309 B12R1.69 Cc1ccc(c(c1)C)OCCO 7a_100000211776_100000211926 [0,2,0,0,0,0|1,0,0]=3 10310 B12R1.69 Cc1ccc(c(c1)C)SCCF 62a_100011217306_100011217332 [0,2,0,0,0,0|1,1,0]=4 10311 B12R1.69 Cc1ccc(c(c1)C)SCCF 62a_100011217332_100011217306 [0,2,0,0,0,0|1,1,0]=4 10312 B12R1.69 Cc1ccc(c(c1)C)SCCO 62a_100000211926_100011217332 [0,2,0,0,0,0|1,1,0]=4 10313 B12R1.69 Cc1ccc(c(c1)C)SCCO 62a_100011217332_100000211926 [0,2,0,0,0,0|1,1,0]=4 10314 B12R1.69 Cc1ccc(c(c1)Cl)COCF 34a_100000720314_100015361967 [0,2,0,0,0,0|2,0,0]=4 10315 B12R1.69 Cc1ccc(c(c1)Cl)COCF 7a_100000720314_100015361967 [0,2,0,0,0,0|2,0,0]=4 10316 B12R1.69 Cc1ccc(c(c1)Cl)NCCF 34a_100000210522_100011217306 [0,2,0,0,0,0|2,0,0]=4 10317 B12R1.69 Cc1ccc(c(c1)Cl)NCCO 34a_100000210522_100000211926 [0,2,0,0,0,0|2,0,0]=4 10318 B12R1.69 Cc1ccc(c(c1)Cl)OCC#N 7a_100000749699_100011215382 [0,2,0,0,0,0|1,0,1]=4 10319 B12R1.69 Cc1ccc(c(c1)Cl)OCC=O 34a_100000749699_200009817547 [0,2,0,0,0,0|1,0,1]=4 10320 B12R1.69 Cc1ccc(c(c1)Cl)OCC=O 7a_100000749699_200015260668 [0,2,0,0,0,0|1,0,1]=4 10321 B12R1.69 Cc1ccc(c(c1)Cl)OCCF 34a_100000749699_100011217306 [0,2,0,0,0,0|1,0,0]=3 10322 B12R1.69 Cc1ccc(c(c1)Cl)OCCF 7a_100000749699_100011217306 [0,2,0,0,0,0|1,0,0]=3 10323 B12R1.69 Cc1ccc(c(c1)Cl)OCCO 34a_100000749699_100000211926 [0,2,0,0,0,0|1,0,0]=3 10324 B12R1.69 Cc1ccc(c(c1)Cl)OCCO 7a_100000749699_100000211926 [0,2,0,0,0,0|1,0,0]=3 10325 B12R1.69 Cc1ccc(c(c1)Cl)SCCF 62a_100011217306_100011263221 [0,2,0,0,0,0|1,1,0]=4 10326 B12R1.69 Cc1ccc(c(c1)Cl)SCCF 62a_100011263221_100011217306 [0,2,0,0,0,0|1,1,0]=4 10327 B12R1.69 Cc1ccc(c(c1)Cl)SCCO 62a_100000211926_100011263221 [0,2,0,0,0,0|1,1,0]=4 10328 B12R1.69 Cc1ccc(c(c1)Cl)SCCO 62a_100011263221_100000211926 [0,2,0,0,0,0|1,1,0]=4 10329 B12R1.69 Cc1ccc(c(c1)F)COCF 34a_100011216587_100015361967 [0,2,0,0,0,0|2,0,0]=4 10330 B12R1.69 Cc1ccc(c(c1)F)COCF 7a_100011216587_100015361967 [0,2,0,0,0,0|2,0,0]=4 10331 B12R1.69 Cc1ccc(c(c1)F)NCCF 34a_100000211023_100011217306 [0,2,0,0,0,0|2,0,0]=4 10332 B12R1.69 Cc1ccc(c(c1)F)NCCO 34a_100000211023_100000211926 [0,2,0,0,0,0|2,0,0]=4 10333 B12R1.69 Cc1ccc(c(c1)F)OCC#N 7a_100011216688_100011215382 [0,2,0,0,0,0|1,0,1]=4 10334 B12R1.69 Cc1ccc(c(c1)F)OCC=O 34a_100011216688_200009817547 [0,2,0,0,0,0|1,0,1]=4 10335 B12R1.69 Cc1ccc(c(c1)F)OCC=O 7a_100011216688_200015260668 [0,2,0,0,0,0|1,0,1]=4 10336 B12R1.69 Cc1ccc(c(c1)F)OCCF 34a_100011216688_100011217306 [0,2,0,0,0,0|1,0,0]=3 10337 B12R1.69 Cc1ccc(c(c1)F)OCCF 7a_100011216688_100011217306 [0,2,0,0,0,0|1,0,0]=3 10338 B12R1.69 Cc1ccc(c(c1)F)OCCO 34a_100011216688_100000211926 [0,2,0,0,0,0|1,0,0]=3 10339 B12R1.69 Cc1ccc(c(c1)F)OCCO 7a_100011216688_100000211926 [0,2,0,0,0,0|1,0,0]=3 10340 B12R1.69 Cc1ccc(c(c1)F)SCCF 62a_100011216119_100011217306 [0,2,0,0,0,0|1,1,0]=4 10341 B12R1.69 Cc1ccc(c(c1)F)SCCF 62a_100011217306_100011216119 [0,2,0,0,0,0|1,1,0]=4 10342 B12R1.69 Cc1ccc(c(c1)F)SCCO 62a_100000211926_100011216119 [0,2,0,0,0,0|1,1,0]=4 10343 B12R1.69 Cc1ccc(c(c1)F)SCCO 62a_100011216119_100000211926 [0,2,0,0,0,0|1,1,0]=4 10344 B12R1.69 Cc1ccc(c(c1)I)NCCF 34a_100011356834_100011217306 [0,2,0,0,0,0|2,0,0]=4 10345 B12R1.69 Cc1ccc(c(c1)I)NCCO 34a_100011356834_100000211926 [0,2,0,0,0,0|2,0,0]=4 10346 B12R1.69 Cc1ccc(c(c1)I)OCC#N 7a_100000765521_100011215382 [0,2,0,0,0,0|1,0,1]=4 10347 B12R1.69 Cc1ccc(c(c1)I)OCC=O 34a_100000765521_200009817547 [0,2,0,0,0,0|1,0,1]=4 10348 B12R1.69 Cc1ccc(c(c1)I)OCC=O 7a_100000765521_200015260668 [0,2,0,0,0,0|1,0,1]=4 10349 B12R1.69 Cc1ccc(c(c1)I)OCCF 34a_100000765521_100011217306 [0,2,0,0,0,0|1,0,0]=3 10350 B12R1.69 Cc1ccc(c(c1)I)OCCF 7a_100000765521_100011217306 [0,2,0,0,0,0|1,0,0]=3 10351 B12R1.69 Cc1ccc(c(c1)I)OCCO 34a_100000765521_100000211926 [0,2,0,0,0,0|1,0,0]=3 10352 B12R1.69 Cc1ccc(c(c1)I)OCCO 7a_100000765521_100000211926 [0,2,0,0,0,0|1,0,0]=3 10353 B12R1.69 Cc1ccc(c(c1)N)COCF 34a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 10354 B12R1.69 Cc1ccc(c(c1)N)COCF 7a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 10355 B12R1.69 Cc1ccc(c(c1)N)OCC#N 7a_100011215204_100011215382 [0,2,0,0,0,0|1,0,1]=4 10356 B12R1.69 Cc1ccc(c(c1)N)OCC=O 34a_100011215204_200009817547 [0,2,0,0,0,0|1,0,1]=4 10357 B12R1.69 Cc1ccc(c(c1)N)OCC=O 7a_100011215204_200015260668 [0,2,0,0,0,0|1,0,1]=4 10358 B12R1.69 Cc1ccc(c(c1)N)OCCF 34a_100011215204_100011217306 [0,2,0,0,0,0|1,0,0]=3 10359 B12R1.69 Cc1ccc(c(c1)N)OCCF 7a_100011215204_100011217306 [0,2,0,0,0,0|1,0,0]=3 10360 B12R1.69 Cc1ccc(c(c1)N)OCCO 34a_100011215204_100000211926 [0,2,0,0,0,0|1,0,0]=3 10361 B12R1.69 Cc1ccc(c(c1)N)OCCO 7a_100011215204_100000211926 [0,2,0,0,0,0|1,0,0]=3 10362 B12R1.69 Cc1ccc(c(c1)N)SCCF 62a_100011216686_100011217306 [0,2,0,0,0,0|1,1,0]=4 10363 B12R1.69 Cc1ccc(c(c1)N)SCCF 62a_100011217306_100011216686 [0,2,0,0,0,0|1,1,0]=4 10364 B12R1.69 Cc1ccc(c(c1)N)SCCO 62a_100000211926_100011216686 [0,2,0,0,0,0|1,1,0]=4 10365 B12R1.69 Cc1ccc(c(c1)N)SCCO 62a_100011216686_100000211926 [0,2,0,0,0,0|1,1,0]=4 10366 B12R1.69 Cc1ccc(c(c1)O)NCCF 34a_100000211527_100011217306 [0,2,0,0,0,0|2,0,0]=4 10367 B12R1.69 Cc1ccc(c(c1)O)NCCO 34a_100000211527_100000211926 [0,2,0,0,0,0|2,0,0]=4 10368 B12R1.69 Cc1ccc(c(c1)O)OCCN 271570a_203496583355_100025744979 [0,2,0,0,0,0|1,0,0]=3 10369 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100011217306_100012002257 [0,2,0,0,0,0|1,1,0]=4 10370 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100012002257_100011217306 [0,2,0,0,0,0|1,1,0]=4 10371 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100000211926_100012002257 [0,2,0,0,0,0|1,1,0]=4 10372 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100012002257_100000211926 [0,2,0,0,0,0|1,1,0]=4 10373 B12R1.69 Cc1ccc(c(n1)Br)OCCF 34a_100000702858_100011217306 [0,2,0,0,0,0|2,0,0]=4 10374 B12R1.69 Cc1ccc(c(n1)Br)OCCF 7a_100000702858_100011217306 [0,2,0,0,0,0|2,0,0]=4 10375 B12R1.69 Cc1ccc(c(n1)Br)OCCO 34a_100000702858_100000211926 [0,2,0,0,0,0|2,0,0]=4 10376 B12R1.69 Cc1ccc(c(n1)Br)OCCO 7a_100000702858_100000211926 [0,2,0,0,0,0|2,0,0]=4 10377 B12R1.69 Cc1ccc(c(n1)C)OCCF 34a_100011218912_100011217306 [0,2,0,0,0,0|2,0,0]=4 10378 B12R1.69 Cc1ccc(c(n1)C)OCCF 7a_100011218912_100011217306 [0,2,0,0,0,0|2,0,0]=4 10379 B12R1.69 Cc1ccc(c(n1)C)OCCO 34a_100011218912_100000211926 [0,2,0,0,0,0|2,0,0]=4 10380 B12R1.69 Cc1ccc(c(n1)C)OCCO 7a_100011218912_100000211926 [0,2,0,0,0,0|2,0,0]=4 10381 B12R1.69 Cc1ccc(c(n1)Cl)OCCF 34a_100000086286_100011217306 [0,2,0,0,0,0|2,0,0]=4 10382 B12R1.69 Cc1ccc(c(n1)Cl)OCCF 7a_100000086286_100011217306 [0,2,0,0,0,0|2,0,0]=4 10383 B12R1.69 Cc1ccc(c(n1)Cl)OCCO 34a_100000086286_100000211926 [0,2,0,0,0,0|2,0,0]=4 10384 B12R1.69 Cc1ccc(c(n1)Cl)OCCO 7a_100000086286_100000211926 [0,2,0,0,0,0|2,0,0]=4 10385 B12R1.69 Cc1ccc(c(n1)F)OCCF 34a_100000079963_100011217306 [0,2,0,0,0,0|2,0,0]=4 10386 B12R1.69 Cc1ccc(c(n1)F)OCCF 7a_100000079963_100011217306 [0,2,0,0,0,0|2,0,0]=4 10387 B12R1.69 Cc1ccc(c(n1)F)OCCO 34a_100000079963_100000211926 [0,2,0,0,0,0|2,0,0]=4 10388 B12R1.69 Cc1ccc(c(n1)F)OCCO 7a_100000079963_100000211926 [0,2,0,0,0,0|2,0,0]=4 10389 B12R1.69 Cc1ccc(c(n1)I)OCCF 34a_100000023897_100011217306 [0,2,0,0,0,0|2,0,0]=4 10390 B12R1.69 Cc1ccc(c(n1)I)OCCF 7a_100000023897_100011217306 [0,2,0,0,0,0|2,0,0]=4 10391 B12R1.69 Cc1ccc(c(n1)I)OCCO 34a_100000023897_100000211926 [0,2,0,0,0,0|2,0,0]=4 10392 B12R1.69 Cc1ccc(c(n1)I)OCCO 7a_100000023897_100000211926 [0,2,0,0,0,0|2,0,0]=4 10393 B12R1.69 Cc1ccc(c(n1)N)OCCF 34a_100000694039_100011217306 [0,2,0,0,0,0|2,0,0]=4 10394 B12R1.69 Cc1ccc(c(n1)N)OCCF 7a_100000694039_100011217306 [0,2,0,0,0,0|2,0,0]=4 10395 B12R1.69 Cc1ccc(c(n1)N)OCCO 34a_100000694039_100000211926 [0,2,0,0,0,0|2,0,0]=4 10396 B12R1.69 Cc1ccc(c(n1)N)OCCO 7a_100000694039_100000211926 [0,2,0,0,0,0|2,0,0]=4 10397 B12R1.69 Cc1cnc(c(c1)Br)OCCF 34a_100000719714_100011217306 [0,2,0,0,0,0|2,0,0]=4 10398 B12R1.69 Cc1cnc(c(c1)Br)OCCO 34a_100000719714_100000211926 [0,2,0,0,0,0|2,0,0]=4 10399 B12R1.69 Cc1cnc(c(c1)N)OCCF 34a_100012000488_100011217306 [0,2,0,0,0,0|2,0,0]=4 10400 B12R1.69 Cc1cnc(c(c1)N)OCCO 34a_100012000488_100000211926 [0,2,0,0,0,0|2,0,0]=4 10401 B12R1.69 Cc1nc(ccc1OCCF)Br 34a_100012002022_100011217306 [0,2,0,0,0,0|2,0,0]=4 10402 B12R1.69 Cc1nc(ccc1OCCF)Br 7a_100012002022_100011217306 [0,2,0,0,0,0|2,0,0]=4 10403 B12R1.69 Cc1nc(ccc1OCCF)Cl 34a_100012184626_100011217306 [0,2,0,0,0,0|2,0,0]=4 10404 B12R1.69 Cc1nc(ccc1OCCF)Cl 7a_100012184626_100011217306 [0,2,0,0,0,0|2,0,0]=4 10405 B12R1.69 Cc1nc(ccc1OCCF)F 34a_100009881036_100011217306 [0,2,0,0,0,0|2,0,0]=4 10406 B12R1.69 Cc1nc(ccc1OCCF)F 7a_100009881036_100011217306 [0,2,0,0,0,0|2,0,0]=4 10407 B12R1.69 Cc1nc(ccc1OCCF)I 34a_100010233687_100011217306 [0,2,0,0,0,0|2,0,0]=4 10408 B12R1.69 Cc1nc(ccc1OCCF)I 7a_100010233687_100011217306 [0,2,0,0,0,0|2,0,0]=4 10409 B12R1.69 Cc1nc(ccc1OCCO)Br 34a_100012002022_100000211926 [0,2,0,0,0,0|2,0,0]=4 10410 B12R1.69 Cc1nc(ccc1OCCO)Br 7a_100012002022_100000211926 [0,2,0,0,0,0|2,0,0]=4 10411 B12R1.69 Cc1nc(ccc1OCCO)Cl 34a_100012184626_100000211926 [0,2,0,0,0,0|2,0,0]=4 10412 B12R1.69 Cc1nc(ccc1OCCO)Cl 7a_100012184626_100000211926 [0,2,0,0,0,0|2,0,0]=4 10413 B12R1.69 Cc1nc(ccc1OCCO)F 34a_100009881036_100000211926 [0,2,0,0,0,0|2,0,0]=4 10414 B12R1.69 Cc1nc(ccc1OCCO)F 7a_100009881036_100000211926 [0,2,0,0,0,0|2,0,0]=4 10415 B12R1.69 Cc1nc(ccc1OCCO)I 34a_100010233687_100000211926 [0,2,0,0,0,0|2,0,0]=4 10416 B12R1.69 Cc1nc(ccc1OCCO)I 7a_100010233687_100000211926 [0,2,0,0,0,0|2,0,0]=4 10417 B12R1.69 Cc1nc(ccc1SCCF)O 62a_100000691680_100011217306 [0,2,0,0,0,0|1,1,0]=4 10418 B12R1.69 Cc1nc(ccc1SCCF)O 62a_100011217306_100000691680 [0,2,0,0,0,0|1,1,0]=4 10419 B12R1.69 Cc1nc(ccc1SCCO)O 62a_100000211926_100000691680 [0,2,0,0,0,0|1,1,0]=4 10420 B12R1.69 Cc1nc(ccc1SCCO)O 62a_100000691680_100000211926 [0,2,0,0,0,0|1,1,0]=4 10421 B12R1.69 FCCNc1ccc(cc1Br)Br 34a_100000211012_100011217306 [0,2,0,0,0,0|2,0,0]=4 10422 B12R1.69 FCCNc1ccc(cc1Br)Cl 34a_100000752454_100011217306 [0,2,0,0,0,0|2,0,0]=4 10423 B12R1.69 FCCNc1ccc(cc1Br)F 34a_100000738039_100011217306 [0,2,0,0,0,0|2,0,0]=4 10424 B12R1.69 FCCNc1ccc(cc1Cl)Br 34a_100000211467_100011217306 [0,2,0,0,0,0|2,0,0]=4 10425 B12R1.69 FCCNc1ccc(cc1Cl)Cl 34a_100000185861_100011217306 [0,2,0,0,0,0|2,0,0]=4 10426 B12R1.69 FCCNc1ccc(cc1Cl)F 34a_100000212003_100011217306 [0,2,0,0,0,0|2,0,0]=4 10427 B12R1.69 FCCNc1ccc(cc1Cl)I 34a_100011218065_100011217306 [0,2,0,0,0,0|2,0,0]=4 10428 B12R1.69 FCCNc1ccc(cc1F)Br 34a_100000210722_100011217306 [0,2,0,0,0,0|2,0,0]=4 10429 B12R1.69 FCCNc1ccc(cc1F)Cl 34a_100000211020_100011217306 [0,2,0,0,0,0|2,0,0]=4 10430 B12R1.69 FCCNc1ccc(cc1F)F 34a_100000210720_100011217306 [0,2,0,0,0,0|2,0,0]=4 10431 B12R1.69 FCCNc1ccc(cc1F)I 34a_100011215594_100011217306 [0,2,0,0,0,0|2,0,0]=4 10432 B12R1.69 FCCNc1ccc(cc1I)Br 34a_100000187925_100011217306 [0,2,0,0,0,0|2,0,0]=4 10433 B12R1.69 FCCNc1ccc(cc1I)Cl 34a_100000761889_100011217306 [0,2,0,0,0,0|2,0,0]=4 10434 B12R1.69 FCCNc1ccc(cc1I)F 34a_100000760547_100011217306 [0,2,0,0,0,0|2,0,0]=4 10435 B12R1.69 FCCOc1ccc(cc1Br)Br 34a_100000188717_100011217306 [0,2,0,0,0,0|1,0,0]=3 10436 B12R1.69 FCCOc1ccc(cc1Br)Br 7a_100000188717_100011217306 [0,2,0,0,0,0|1,0,0]=3 10437 B12R1.69 FCCOc1ccc(cc1Br)Cl 34a_100000211998_100011217306 [0,2,0,0,0,0|1,0,0]=3 10438 B12R1.69 FCCOc1ccc(cc1Br)Cl 7a_100000211998_100011217306 [0,2,0,0,0,0|1,0,0]=3 10439 B12R1.69 FCCOc1ccc(cc1Br)F 34a_100000211999_100011217306 [0,2,0,0,0,0|1,0,0]=3 10440 B12R1.69 FCCOc1ccc(cc1Br)F 7a_100000211999_100011217306 [0,2,0,0,0,0|1,0,0]=3 10441 B12R1.69 FCCOc1ccc(cc1Br)I 34a_100012361655_100011217306 [0,2,0,0,0,0|1,0,0]=3 10442 B12R1.69 FCCOc1ccc(cc1Br)I 7a_100012361655_100011217306 [0,2,0,0,0,0|1,0,0]=3 10443 B12R1.69 FCCOc1ccc(cc1Cl)Br 34a_100000186472_100011217306 [0,2,0,0,0,0|1,0,0]=3 10444 B12R1.69 FCCOc1ccc(cc1Cl)Br 7a_100000186472_100011217306 [0,2,0,0,0,0|1,0,0]=3 10445 B12R1.69 FCCOc1ccc(cc1Cl)Cl 34a_100015191787_100011217306 [0,2,0,0,0,0|1,0,0]=3 10446 B12R1.69 FCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011217306 [0,2,0,0,0,0|1,0,0]=3 10447 B12R1.69 FCCOc1ccc(cc1Cl)F 34a_100000212004_100011217306 [0,2,0,0,0,0|1,0,0]=3 10448 B12R1.69 FCCOc1ccc(cc1Cl)F 7a_100000212004_100011217306 [0,2,0,0,0,0|1,0,0]=3 10449 B12R1.69 FCCOc1ccc(cc1Cl)I 34a_100012360047_100011217306 [0,2,0,0,0,0|1,0,0]=3 10450 B12R1.69 FCCOc1ccc(cc1Cl)I 7a_100012360047_100011217306 [0,2,0,0,0,0|1,0,0]=3 10451 B12R1.69 FCCOc1ccc(cc1F)Br 34a_100000185481_100011217306 [0,2,0,0,0,0|1,0,0]=3 10452 B12R1.69 FCCOc1ccc(cc1F)Br 7a_100000185481_100011217306 [0,2,0,0,0,0|1,0,0]=3 10453 B12R1.69 FCCOc1ccc(cc1F)Cl 34a_100000230166_100011217306 [0,2,0,0,0,0|1,0,0]=3 10454 B12R1.69 FCCOc1ccc(cc1F)Cl 7a_100000230166_100011217306 [0,2,0,0,0,0|1,0,0]=3 10455 B12R1.69 FCCOc1ccc(cc1F)F 34a_100000230127_100011217306 [0,2,0,0,0,0|1,0,0]=3 10456 B12R1.69 FCCOc1ccc(cc1F)F 7a_100000230127_100011217306 [0,2,0,0,0,0|1,0,0]=3 10457 B12R1.69 FCCOc1ccc(cc1F)I 34a_100011356965_100011217306 [0,2,0,0,0,0|1,0,0]=3 10458 B12R1.69 FCCOc1ccc(cc1F)I 7a_100011356965_100011217306 [0,2,0,0,0,0|1,0,0]=3 10459 B12R1.69 FCCOc1ccc(cc1I)Br 34a_100012355227_100011217306 [0,2,0,0,0,0|1,0,0]=3 10460 B12R1.69 FCCOc1ccc(cc1I)Br 7a_100012355227_100011217306 [0,2,0,0,0,0|1,0,0]=3 10461 B12R1.69 FCCOc1ccc(cc1I)Cl 34a_100011356953_100011217306 [0,2,0,0,0,0|1,0,0]=3 10462 B12R1.69 FCCOc1ccc(cc1I)Cl 7a_100011356953_100011217306 [0,2,0,0,0,0|1,0,0]=3 10463 B12R1.69 FCCOc1ccc(cc1I)F 34a_100012355409_100011217306 [0,2,0,0,0,0|1,0,0]=3 10464 B12R1.69 FCCOc1ccc(cc1I)F 7a_100012355409_100011217306 [0,2,0,0,0,0|1,0,0]=3 10465 B12R1.69 FCCOc1ccc(cc1I)I 7a_100010001573_100011217306 [0,2,0,0,0,0|1,0,0]=3 10466 B12R1.69 FCCOc1ccc(nc1Br)Br 34a_100009999766_100011217306 [0,2,0,0,0,0|2,0,0]=4 10467 B12R1.69 FCCOc1ccc(nc1Br)Br 7a_100009999766_100011217306 [0,2,0,0,0,0|2,0,0]=4 10468 B12R1.69 FCCOc1ccc(nc1Br)Cl 34a_100010219353_100011217306 [0,2,0,0,0,0|2,0,0]=4 10469 B12R1.69 FCCOc1ccc(nc1Br)Cl 7a_100010219353_100011217306 [0,2,0,0,0,0|2,0,0]=4 10470 B12R1.69 FCCOc1ccc(nc1Br)F 34a_100009887730_100011217306 [0,2,0,0,0,0|2,0,0]=4 10471 B12R1.69 FCCOc1ccc(nc1Br)F 7a_100009887730_100011217306 [0,2,0,0,0,0|2,0,0]=4 10472 B12R1.69 FCCOc1ccc(nc1Br)I 34a_100000725334_100011217306 [0,2,0,0,0,0|2,0,0]=4 10473 B12R1.69 FCCOc1ccc(nc1Br)I 7a_100000725334_100011217306 [0,2,0,0,0,0|2,0,0]=4 10474 B12R1.69 FCCOc1ccc(nc1Cl)Br 34a_100010246206_100011217306 [0,2,0,0,0,0|2,0,0]=4 10475 B12R1.69 FCCOc1ccc(nc1Cl)Br 7a_100010246206_100011217306 [0,2,0,0,0,0|2,0,0]=4 10476 B12R1.69 FCCOc1ccc(nc1Cl)Cl 34a_100000101165_100011217306 [0,2,0,0,0,0|2,0,0]=4 10477 B12R1.69 FCCOc1ccc(nc1Cl)Cl 7a_100000101165_100011217306 [0,2,0,0,0,0|2,0,0]=4 10478 B12R1.69 FCCOc1ccc(nc1Cl)I 34a_100000721234_100011217306 [0,2,0,0,0,0|2,0,0]=4 10479 B12R1.69 FCCOc1ccc(nc1Cl)I 7a_100000721234_100011217306 [0,2,0,0,0,0|2,0,0]=4 10480 B12R1.69 FCCOc1ccc(nc1F)Br 34a_100009819667_100011217306 [0,2,0,0,0,0|2,0,0]=4 10481 B12R1.69 FCCOc1ccc(nc1F)Br 7a_100009819667_100011217306 [0,2,0,0,0,0|2,0,0]=4 10482 B12R1.69 FCCOc1ccc(nc1F)Cl 34a_100009880201_100011217306 [0,2,0,0,0,0|2,0,0]=4 10483 B12R1.69 FCCOc1ccc(nc1F)Cl 7a_100009880201_100011217306 [0,2,0,0,0,0|2,0,0]=4 10484 B12R1.69 FCCOc1ccc(nc1F)F 34a_100000101184_100011217306 [0,2,0,0,0,0|2,0,0]=4 10485 B12R1.69 FCCOc1ccc(nc1F)F 7a_100000101184_100011217306 [0,2,0,0,0,0|2,0,0]=4 10486 B12R1.69 FCCOc1ccc(nc1I)Br 34a_100010253912_100011217306 [0,2,0,0,0,0|2,0,0]=4 10487 B12R1.69 FCCOc1ccc(nc1I)Br 7a_100010253912_100011217306 [0,2,0,0,0,0|2,0,0]=4 10488 B12R1.69 FCCOc1ccc(nc1I)Cl 34a_100000696390_100011217306 [0,2,0,0,0,0|2,0,0]=4 10489 B12R1.69 FCCOc1ccc(nc1I)Cl 7a_100000696390_100011217306 [0,2,0,0,0,0|2,0,0]=4 10490 B12R1.69 FCCOc1ccc(nc1I)F 34a_100010382442_100011217306 [0,2,0,0,0,0|2,0,0]=4 10491 B12R1.69 FCCOc1ccc(nc1I)F 7a_100010382442_100011217306 [0,2,0,0,0,0|2,0,0]=4 10492 B12R1.69 FCCOc1cnc(cc1Cl)Cl 34a_100009868576_100011217306 [0,2,0,0,0,0|2,0,0]=4 10493 B12R1.69 FCCOc1cnc(cc1Cl)Cl 7a_100009868576_100011217306 [0,2,0,0,0,0|2,0,0]=4 10494 B12R1.69 FCCOc1cnc(cc1F)F 34a_100009885687_100011217306 [0,2,0,0,0,0|2,0,0]=4 10495 B12R1.69 FCCOc1cnc(cc1F)F 7a_100009885687_100011217306 [0,2,0,0,0,0|2,0,0]=4 10496 B12R1.69 FCCOc1cnc(cc1I)Cl 34a_100000698892_100011217306 [0,2,0,0,0,0|2,0,0]=4 10497 B12R1.69 FCCOc1cnc(cc1I)Cl 7a_100000698892_100011217306 [0,2,0,0,0,0|2,0,0]=4 10498 B12R1.69 FCCOc1ncc(cc1Br)Br 34a_100000701035_100011217306 [0,2,0,0,0,0|2,0,0]=4 10499 B12R1.69 FCCOc1ncc(cc1Cl)Br 34a_100012339560_100011217306 [0,2,0,0,0,0|2,0,0]=4 10500 B12R1.69 FCCOc1ncc(cc1Cl)F 34a_100009847679_100011217306 [0,2,0,0,0,0|2,0,0]=4 10501 B12R1.69 FCCOc1ncc(cc1F)Cl 34a_100011998252_100011217306 [0,2,0,0,0,0|2,0,0]=4 10502 B12R1.69 FCCOc1ncc(cc1F)F 34a_100012025737_100011217306 [0,2,0,0,0,0|2,0,0]=4 10503 B12R1.69 FCCSc1ccc(cc1Br)Br 62a_100011217306_100011484698 [0,2,0,0,0,0|1,1,0]=4 10504 B12R1.69 FCCSc1ccc(cc1Br)Br 62a_100011484698_100011217306 [0,2,0,0,0,0|1,1,0]=4 10505 B12R1.69 FCCSc1ccc(cc1Br)Cl 62a_100011217306_100011219703 [0,2,0,0,0,0|1,1,0]=4 10506 B12R1.69 FCCSc1ccc(cc1Br)Cl 62a_100011219703_100011217306 [0,2,0,0,0,0|1,1,0]=4 10507 B12R1.69 FCCSc1ccc(cc1Br)F 62a_100011217111_100011217306 [0,2,0,0,0,0|1,1,0]=4 10508 B12R1.69 FCCSc1ccc(cc1Br)F 62a_100011217306_100011217111 [0,2,0,0,0,0|1,1,0]=4 10509 B12R1.69 FCCSc1ccc(cc1Cl)Br 62a_100011216062_100011217306 [0,2,0,0,0,0|1,1,0]=4 10510 B12R1.69 FCCSc1ccc(cc1Cl)Br 62a_100011217306_100011216062 [0,2,0,0,0,0|1,1,0]=4 10511 B12R1.69 FCCSc1ccc(cc1Cl)Cl 62a_100000699841_100011217306 [0,2,0,0,0,0|1,1,0]=4 10512 B12R1.69 FCCSc1ccc(cc1Cl)Cl 62a_100011217306_100000699841 [0,2,0,0,0,0|1,1,0]=4 10513 B12R1.69 FCCSc1ccc(cc1Cl)F 62a_100000733362_100011217306 [0,2,0,0,0,0|1,1,0]=4 10514 B12R1.69 FCCSc1ccc(cc1Cl)F 62a_100011217306_100000733362 [0,2,0,0,0,0|1,1,0]=4 10515 B12R1.69 FCCSc1ccc(cc1F)Br 62a_100009814013_100011217306 [0,2,0,0,0,0|1,1,0]=4 10516 B12R1.69 FCCSc1ccc(cc1F)Br 62a_100011217306_100009814013 [0,2,0,0,0,0|1,1,0]=4 10517 B12R1.69 FCCSc1ccc(cc1F)Cl 62a_100011216042_100011217306 [0,2,0,0,0,0|1,1,0]=4 10518 B12R1.69 FCCSc1ccc(cc1F)Cl 62a_100011217306_100011216042 [0,2,0,0,0,0|1,1,0]=4 10519 B12R1.69 FCCSc1ccc(cc1F)F 62a_100000750030_100011217306 [0,2,0,0,0,0|1,1,0]=4 10520 B12R1.69 FCCSc1ccc(cc1F)F 62a_100011217306_100000750030 [0,2,0,0,0,0|1,1,0]=4 10521 B12R1.69 FCOCc1ccc(cc1Br)Br 34a_100012357508_100015361967 [0,2,0,0,0,0|2,0,0]=4 10522 B12R1.69 FCOCc1ccc(cc1Br)Br 7a_100012357508_100015361967 [0,2,0,0,0,0|2,0,0]=4 10523 B12R1.69 FCOCc1ccc(cc1Br)Cl 34a_100000707881_100015361967 [0,2,0,0,0,0|2,0,0]=4 10524 B12R1.69 FCOCc1ccc(cc1Br)Cl 7a_100000707881_100015361967 [0,2,0,0,0,0|2,0,0]=4 10525 B12R1.69 FCOCc1ccc(cc1Br)F 34a_100000744086_100015361967 [0,2,0,0,0,0|2,0,0]=4 10526 B12R1.69 FCOCc1ccc(cc1Br)F 7a_100000744086_100015361967 [0,2,0,0,0,0|2,0,0]=4 10527 B12R1.69 FCOCc1ccc(cc1Br)I 7a_100010240206_100015361967 [0,2,0,0,0,0|2,0,0]=4 10528 B12R1.69 FCOCc1ccc(cc1Cl)Br 34a_100000756401_100015361967 [0,2,0,0,0,0|2,0,0]=4 10529 B12R1.69 FCOCc1ccc(cc1Cl)Br 7a_100000756401_100015361967 [0,2,0,0,0,0|2,0,0]=4 10530 B12R1.69 FCOCc1ccc(cc1Cl)Cl 34a_100000215721_100015361967 [0,2,0,0,0,0|2,0,0]=4 10531 B12R1.69 FCOCc1ccc(cc1Cl)Cl 7a_100000215721_100015361967 [0,2,0,0,0,0|2,0,0]=4 10532 B12R1.69 FCOCc1ccc(cc1Cl)F 34a_100011219954_100015361967 [0,2,0,0,0,0|2,0,0]=4 10533 B12R1.69 FCOCc1ccc(cc1Cl)F 7a_100011219954_100015361967 [0,2,0,0,0,0|2,0,0]=4 10534 B12R1.69 FCOCc1ccc(cc1F)Br 34a_100011191541_100015361967 [0,2,0,0,0,0|2,0,0]=4 10535 B12R1.69 FCOCc1ccc(cc1F)Br 7a_100011191541_100015361967 [0,2,0,0,0,0|2,0,0]=4 10536 B12R1.69 FCOCc1ccc(cc1F)Cl 34a_100011217562_100015361967 [0,2,0,0,0,0|2,0,0]=4 10537 B12R1.69 FCOCc1ccc(cc1F)Cl 7a_100011217562_100015361967 [0,2,0,0,0,0|2,0,0]=4 10538 B12R1.69 FCOCc1ccc(cc1F)F 34a_100011215441_100015361967 [0,2,0,0,0,0|2,0,0]=4 10539 B12R1.69 FCOCc1ccc(cc1F)F 7a_100011215441_100015361967 [0,2,0,0,0,0|2,0,0]=4 10540 B12R1.69 FCOCc1ccc(cc1F)I 34a_200010202041_100015361967 [0,2,0,0,0,0|2,0,0]=4 10541 B12R1.69 FCOCc1ccc(cc1F)I 7a_200010202041_100015361967 [0,2,0,0,0,0|2,0,0]=4 10542 B12R1.69 FCOCc1ccc(cc1I)Br 7a_100010146605_100015361967 [0,2,0,0,0,0|2,0,0]=4 10543 B12R1.69 FCOCc1ccc(cc1I)Cl 34a_100000722340_100015361967 [0,2,0,0,0,0|2,0,0]=4 10544 B12R1.69 FCOCc1ccc(cc1I)Cl 7a_100000722340_100015361967 [0,2,0,0,0,0|2,0,0]=4 10545 B12R1.69 FCOCc1ccc(cc1I)F 34a_100011356828_100015361967 [0,2,0,0,0,0|2,0,0]=4 10546 B12R1.69 FCOCc1ccc(cc1I)F 7a_100011356828_100015361967 [0,2,0,0,0,0|2,0,0]=4 10547 B12R1.69 N#CCOc1ccc(cc1Br)Br 7a_100000188717_100011215382 [0,2,0,0,0,0|1,0,1]=4 10548 B12R1.69 N#CCOc1ccc(cc1Br)Cl 7a_100000211998_100011215382 [0,2,0,0,0,0|1,0,1]=4 10549 B12R1.69 N#CCOc1ccc(cc1Br)F 7a_100000211999_100011215382 [0,2,0,0,0,0|1,0,1]=4 10550 B12R1.69 N#CCOc1ccc(cc1Br)I 7a_100012361655_100011215382 [0,2,0,0,0,0|1,0,1]=4 10551 B12R1.69 N#CCOc1ccc(cc1Br)N 7a_100011534360_100011215382 [0,2,0,0,0,0|1,0,1]=4 10552 B12R1.69 N#CCOc1ccc(cc1Cl)Br 7a_100000186472_100011215382 [0,2,0,0,0,0|1,0,1]=4 10553 B12R1.69 N#CCOc1ccc(cc1Cl)Cl 7a_100015191787_100011215382 [0,2,0,0,0,0|1,0,1]=4 10554 B12R1.69 N#CCOc1ccc(cc1Cl)F 7a_100000212004_100011215382 [0,2,0,0,0,0|1,0,1]=4 10555 B12R1.69 N#CCOc1ccc(cc1Cl)I 7a_100012360047_100011215382 [0,2,0,0,0,0|1,0,1]=4 10556 B12R1.69 N#CCOc1ccc(cc1Cl)N 7a_100000744943_100011215382 [0,2,0,0,0,0|1,0,1]=4 10557 B12R1.69 N#CCOc1ccc(cc1F)Br 7a_100000185481_100011215382 [0,2,0,0,0,0|1,0,1]=4 10558 B12R1.69 N#CCOc1ccc(cc1F)Cl 7a_100000230166_100011215382 [0,2,0,0,0,0|1,0,1]=4 10559 B12R1.69 N#CCOc1ccc(cc1F)F 7a_100000230127_100011215382 [0,2,0,0,0,0|1,0,1]=4 10560 B12R1.69 N#CCOc1ccc(cc1F)I 7a_100011356965_100011215382 [0,2,0,0,0,0|1,0,1]=4 10561 B12R1.69 N#CCOc1ccc(cc1F)N 7a_100011220035_100011215382 [0,2,0,0,0,0|1,0,1]=4 10562 B12R1.69 N#CCOc1ccc(cc1I)Br 7a_100012355227_100011215382 [0,2,0,0,0,0|1,0,1]=4 10563 B12R1.69 N#CCOc1ccc(cc1I)Cl 7a_100011356953_100011215382 [0,2,0,0,0,0|1,0,1]=4 10564 B12R1.69 N#CCOc1ccc(cc1I)F 7a_100012355409_100011215382 [0,2,0,0,0,0|1,0,1]=4 10565 B12R1.69 N#CCOc1ccc(cc1I)I 7a_100010001573_100011215382 [0,2,0,0,0,0|1,0,1]=4 10566 B12R1.69 N#CCOc1ccc(cc1N)Br 7a_100000752626_100011215382 [0,2,0,0,0,0|1,0,1]=4 10567 B12R1.69 N#CCOc1ccc(cc1N)Cl 7a_100000210500_100011215382 [0,2,0,0,0,0|1,0,1]=4 10568 B12R1.69 N#CCOc1ccc(cc1N)F 7a_100000759472_100011215382 [0,2,0,0,0,0|1,0,1]=4 10569 B12R1.69 N#CCOc1ccc(cc1N)I 7a_100000753495_100011215382 [0,2,0,0,0,0|1,0,1]=4 10570 B12R1.69 N#CCSc1ccc(cc1Br)O 62a_100000701344_100011215382 [0,2,0,0,0,0|0,1,1]=4 10571 B12R1.69 N#CCSc1ccc(cc1Br)O 62a_100011215382_100000701344 [0,2,0,0,0,0|0,1,1]=4 10572 B12R1.69 N#CCSc1ccc(cc1Cl)O 62a_100000047559_100011215382 [0,2,0,0,0,0|0,1,1]=4 10573 B12R1.69 N#CCSc1ccc(cc1Cl)O 62a_100011215382_100000047559 [0,2,0,0,0,0|0,1,1]=4 10574 B12R1.69 N#CCSc1ccc(cc1F)O 62a_100000755031_100011215382 [0,2,0,0,0,0|0,1,1]=4 10575 B12R1.69 N#CCSc1ccc(cc1F)O 62a_100011215382_100000755031 [0,2,0,0,0,0|0,1,1]=4 10576 B12R1.69 N#CCSc1ccc(cc1N)O 62a_100011215382_100011999798 [0,2,0,0,0,0|0,1,1]=4 10577 B12R1.69 N#CCSc1ccc(cc1N)O 62a_100011999798_100011215382 [0,2,0,0,0,0|0,1,1]=4 10578 B12R1.69 N#CCSc1ccc(cc1O)O 62a_100011215382_100009813921 [0,2,0,0,0,0|0,1,1]=4 10579 B12R1.69 Nc1cc(ccc1COCF)Br 34a_100000718831_100015361967 [0,2,0,0,0,0|2,0,0]=4 10580 B12R1.69 Nc1cc(ccc1COCF)Br 7a_100000718831_100015361967 [0,2,0,0,0,0|2,0,0]=4 10581 B12R1.69 Nc1cc(ccc1COCF)Cl 34a_100000238622_100015361967 [0,2,0,0,0,0|2,0,0]=4 10582 B12R1.69 Nc1cc(ccc1COCF)Cl 7a_100000238622_100015361967 [0,2,0,0,0,0|2,0,0]=4 10583 B12R1.69 Nc1cc(ccc1COCF)F 34a_100011996588_100015361967 [0,2,0,0,0,0|2,0,0]=4 10584 B12R1.69 Nc1cc(ccc1OCC=O)Br 34a_100000752626_200009817547 [0,2,0,0,0,0|1,0,1]=4 10585 B12R1.69 Nc1cc(ccc1OCC=O)Br 7a_100000752626_200015260668 [0,2,0,0,0,0|1,0,1]=4 10586 B12R1.69 Nc1cc(ccc1OCC=O)Cl 34a_100000210500_200009817547 [0,2,0,0,0,0|1,0,1]=4 10587 B12R1.69 Nc1cc(ccc1OCC=O)Cl 7a_100000210500_200015260668 [0,2,0,0,0,0|1,0,1]=4 10588 B12R1.69 Nc1cc(ccc1OCC=O)F 34a_100000759472_200009817547 [0,2,0,0,0,0|1,0,1]=4 10589 B12R1.69 Nc1cc(ccc1OCC=O)F 7a_100000759472_200015260668 [0,2,0,0,0,0|1,0,1]=4 10590 B12R1.69 Nc1cc(ccc1OCC=O)I 34a_100000753495_200009817547 [0,2,0,0,0,0|1,0,1]=4 10591 B12R1.69 Nc1cc(ccc1OCC=O)I 7a_100000753495_200015260668 [0,2,0,0,0,0|1,0,1]=4 10592 B12R1.69 Nc1cc(ccc1OCCF)Br 34a_100000752626_100011217306 [0,2,0,0,0,0|1,0,0]=3 10593 B12R1.69 Nc1cc(ccc1OCCF)Br 7a_100000752626_100011217306 [0,2,0,0,0,0|1,0,0]=3 10594 B12R1.69 Nc1cc(ccc1OCCF)Cl 34a_100000210500_100011217306 [0,2,0,0,0,0|1,0,0]=3 10595 B12R1.69 Nc1cc(ccc1OCCF)Cl 7a_100000210500_100011217306 [0,2,0,0,0,0|1,0,0]=3 10596 B12R1.69 Nc1cc(ccc1OCCF)F 34a_100000759472_100011217306 [0,2,0,0,0,0|1,0,0]=3 10597 B12R1.69 Nc1cc(ccc1OCCF)F 7a_100000759472_100011217306 [0,2,0,0,0,0|1,0,0]=3 10598 B12R1.69 Nc1cc(ccc1OCCF)I 34a_100000753495_100011217306 [0,2,0,0,0,0|1,0,0]=3 10599 B12R1.69 Nc1cc(ccc1OCCF)I 7a_100000753495_100011217306 [0,2,0,0,0,0|1,0,0]=3 10600 B12R1.69 Nc1cc(ccc1OCCO)Br 34a_100000752626_100000211926 [0,2,0,0,0,0|1,0,0]=3 10601 B12R1.69 Nc1cc(ccc1OCCO)Br 7a_100000752626_100000211926 [0,2,0,0,0,0|1,0,0]=3 10602 B12R1.69 Nc1cc(ccc1OCCO)Cl 34a_100000210500_100000211926 [0,2,0,0,0,0|1,0,0]=3 10603 B12R1.69 Nc1cc(ccc1OCCO)Cl 7a_100000210500_100000211926 [0,2,0,0,0,0|1,0,0]=3 10604 B12R1.69 Nc1cc(ccc1OCCO)F 34a_100000759472_100000211926 [0,2,0,0,0,0|1,0,0]=3 10605 B12R1.69 Nc1cc(ccc1OCCO)F 7a_100000759472_100000211926 [0,2,0,0,0,0|1,0,0]=3 10606 B12R1.69 Nc1cc(ccc1OCCO)I 34a_100000753495_100000211926 [0,2,0,0,0,0|1,0,0]=3 10607 B12R1.69 Nc1cc(ccc1OCCO)I 7a_100000753495_100000211926 [0,2,0,0,0,0|1,0,0]=3 10608 B12R1.69 Nc1cc(ccc1SCC=O)O 62a_100011999798_200015260668 [0,2,0,0,0,0|0,1,1]=4 10609 B12R1.69 Nc1cc(ccc1SCC=O)O 62a_200015260668_100011999798 [0,2,0,0,0,0|0,1,1]=4 10610 B12R1.69 Nc1cc(ccc1SCCF)Br 62a_100000743836_100011217306 [0,2,0,0,0,0|1,1,0]=4 10611 B12R1.69 Nc1cc(ccc1SCCF)Br 62a_100011217306_100000743836 [0,2,0,0,0,0|1,1,0]=4 10612 B12R1.69 Nc1cc(ccc1SCCF)Cl 62a_100000761886_100011217306 [0,2,0,0,0,0|1,1,0]=4 10613 B12R1.69 Nc1cc(ccc1SCCF)Cl 62a_100011217306_100000761886 [0,2,0,0,0,0|1,1,0]=4 10614 B12R1.69 Nc1cc(ccc1SCCF)F 62a_100000687223_100011217306 [0,2,0,0,0,0|1,1,0]=4 10615 B12R1.69 Nc1cc(ccc1SCCF)F 62a_100011217306_100000687223 [0,2,0,0,0,0|1,1,0]=4 10616 B12R1.69 Nc1cc(ccc1SCCF)O 62a_100011217306_100011999798 [0,2,0,0,0,0|0,1,0]=3 10617 B12R1.69 Nc1cc(ccc1SCCF)O 62a_100011999798_100011217306 [0,2,0,0,0,0|0,1,0]=3 10618 B12R1.69 Nc1cc(ccc1SCCO)Br 62a_100000211926_100000743836 [0,2,0,0,0,0|1,1,0]=4 10619 B12R1.69 Nc1cc(ccc1SCCO)Br 62a_100000743836_100000211926 [0,2,0,0,0,0|1,1,0]=4 10620 B12R1.69 Nc1cc(ccc1SCCO)Cl 62a_100000211926_100000761886 [0,2,0,0,0,0|1,1,0]=4 10621 B12R1.69 Nc1cc(ccc1SCCO)Cl 62a_100000761886_100000211926 [0,2,0,0,0,0|1,1,0]=4 10622 B12R1.69 Nc1cc(ccc1SCCO)F 62a_100000211926_100000687223 [0,2,0,0,0,0|1,1,0]=4 10623 B12R1.69 Nc1cc(ccc1SCCO)F 62a_100000687223_100000211926 [0,2,0,0,0,0|1,1,0]=4 10624 B12R1.69 Nc1cc(ccc1SCCO)O 62a_100000211926_100011999798 [0,2,0,0,0,0|0,1,0]=3 10625 B12R1.69 Nc1cc(ccc1SCCO)O 62a_100011999798_100000211926 [0,2,0,0,0,0|0,1,0]=3 10626 B12R1.69 Nc1cc(cnc1OCCF)Br 34a_100000743729_100011217306 [0,2,0,0,0,0|2,0,0]=4 10627 B12R1.69 Nc1cc(cnc1OCCF)Cl 34a_100011998249_100011217306 [0,2,0,0,0,0|2,0,0]=4 10628 B12R1.69 Nc1cc(cnc1OCCO)Br 34a_100000743729_100000211926 [0,2,0,0,0,0|2,0,0]=4 10629 B12R1.69 Nc1cc(cnc1OCCO)Cl 34a_100011998249_100000211926 [0,2,0,0,0,0|2,0,0]=4 10630 B12R1.69 Nc1cc(ncc1OCCF)Br 34a_100009819941_100011217306 [0,2,0,0,0,0|2,0,0]=4 10631 B12R1.69 Nc1cc(ncc1OCCF)Br 7a_100009819941_100011217306 [0,2,0,0,0,0|2,0,0]=4 10632 B12R1.69 Nc1cc(ncc1OCCO)Br 34a_100009819941_100000211926 [0,2,0,0,0,0|2,0,0]=4 10633 B12R1.69 Nc1cc(ncc1OCCO)Br 7a_100009819941_100000211926 [0,2,0,0,0,0|2,0,0]=4 10634 B12R1.69 Nc1ccc(c(c1)Br)OCC=O 34a_100011534360_200009817547 [0,2,0,0,0,0|1,0,1]=4 10635 B12R1.69 Nc1ccc(c(c1)Br)OCC=O 7a_100011534360_200015260668 [0,2,0,0,0,0|1,0,1]=4 10636 B12R1.69 Nc1ccc(c(c1)Br)OCCF 34a_100011534360_100011217306 [0,2,0,0,0,0|1,0,0]=3 10637 B12R1.69 Nc1ccc(c(c1)Br)OCCF 7a_100011534360_100011217306 [0,2,0,0,0,0|1,0,0]=3 10638 B12R1.69 Nc1ccc(c(c1)Br)OCCO 34a_100011534360_100000211926 [0,2,0,0,0,0|1,0,0]=3 10639 B12R1.69 Nc1ccc(c(c1)Br)OCCO 7a_100011534360_100000211926 [0,2,0,0,0,0|1,0,0]=3 10640 B12R1.69 Nc1ccc(c(c1)Br)SCCF 62a_100000750458_100011217306 [0,2,0,0,0,0|1,1,0]=4 10641 B12R1.69 Nc1ccc(c(c1)Br)SCCF 62a_100011217306_100000750458 [0,2,0,0,0,0|1,1,0]=4 10642 B12R1.69 Nc1ccc(c(c1)Br)SCCO 62a_100000211926_100000750458 [0,2,0,0,0,0|1,1,0]=4 10643 B12R1.69 Nc1ccc(c(c1)Br)SCCO 62a_100000750458_100000211926 [0,2,0,0,0,0|1,1,0]=4 10644 B12R1.69 Nc1ccc(c(c1)Cl)COCF 34a_100000689119_100015361967 [0,2,0,0,0,0|2,0,0]=4 10645 B12R1.69 Nc1ccc(c(c1)Cl)OCC=O 34a_100000744943_200009817547 [0,2,0,0,0,0|1,0,1]=4 10646 B12R1.69 Nc1ccc(c(c1)Cl)OCC=O 7a_100000744943_200015260668 [0,2,0,0,0,0|1,0,1]=4 10647 B12R1.69 Nc1ccc(c(c1)Cl)OCCF 34a_100000744943_100011217306 [0,2,0,0,0,0|1,0,0]=3 10648 B12R1.69 Nc1ccc(c(c1)Cl)OCCF 7a_100000744943_100011217306 [0,2,0,0,0,0|1,0,0]=3 10649 B12R1.69 Nc1ccc(c(c1)Cl)OCCO 34a_100000744943_100000211926 [0,2,0,0,0,0|1,0,0]=3 10650 B12R1.69 Nc1ccc(c(c1)Cl)OCCO 7a_100000744943_100000211926 [0,2,0,0,0,0|1,0,0]=3 10651 B12R1.69 Nc1ccc(c(c1)Cl)SCCF 62a_100000761885_100011217306 [0,2,0,0,0,0|1,1,0]=4 10652 B12R1.69 Nc1ccc(c(c1)Cl)SCCF 62a_100011217306_100000761885 [0,2,0,0,0,0|1,1,0]=4 10653 B12R1.69 Nc1ccc(c(c1)Cl)SCCO 62a_100000211926_100000761885 [0,2,0,0,0,0|1,1,0]=4 10654 B12R1.69 Nc1ccc(c(c1)Cl)SCCO 62a_100000761885_100000211926 [0,2,0,0,0,0|1,1,0]=4 10655 B12R1.69 Nc1ccc(c(c1)F)OCC=O 34a_100011220035_200009817547 [0,2,0,0,0,0|1,0,1]=4 10656 B12R1.69 Nc1ccc(c(c1)F)OCC=O 7a_100011220035_200015260668 [0,2,0,0,0,0|1,0,1]=4 10657 B12R1.69 Nc1ccc(c(c1)F)OCCF 34a_100011220035_100011217306 [0,2,0,0,0,0|1,0,0]=3 10658 B12R1.69 Nc1ccc(c(c1)F)OCCF 7a_100011220035_100011217306 [0,2,0,0,0,0|1,0,0]=3 10659 B12R1.69 Nc1ccc(c(c1)F)OCCO 34a_100011220035_100000211926 [0,2,0,0,0,0|1,0,0]=3 10660 B12R1.69 Nc1ccc(c(c1)F)OCCO 7a_100011220035_100000211926 [0,2,0,0,0,0|1,0,0]=3 10661 B12R1.69 Nc1ccc(c(c1)F)SCCF 62a_100011217306_100011356925 [0,2,0,0,0,0|1,1,0]=4 10662 B12R1.69 Nc1ccc(c(c1)F)SCCF 62a_100011356925_100011217306 [0,2,0,0,0,0|1,1,0]=4 10663 B12R1.69 Nc1ccc(c(c1)F)SCCO 62a_100000211926_100011356925 [0,2,0,0,0,0|1,1,0]=4 10664 B12R1.69 Nc1ccc(c(c1)F)SCCO 62a_100011356925_100000211926 [0,2,0,0,0,0|1,1,0]=4 10665 B12R1.69 Nc1ccc(c(c1)N)OCC=O 34a_100000725306_200009817547 [0,2,0,0,0,0|1,0,1]=4 10666 B12R1.69 Nc1ccc(c(c1)N)OCCF 34a_100000725306_100011217306 [0,2,0,0,0,0|1,0,0]=3 10667 B12R1.69 Nc1ccc(c(c1)N)OCCO 34a_100000725306_100000211926 [0,2,0,0,0,0|1,0,0]=3 10668 B12R1.69 Nc1ccc(c(c1)N)SCCF 62a_100011217306_200012175722 [0,2,0,0,0,0|1,1,0]=4 10669 B12R1.69 Nc1ccc(c(c1)N)SCCF 62a_200012175722_100011217306 [0,2,0,0,0,0|1,1,0]=4 10670 B12R1.69 Nc1ccc(c(c1)N)SCCO 62a_100000211926_200012175722 [0,2,0,0,0,0|1,1,0]=4 10671 B12R1.69 Nc1ccc(c(c1)N)SCCO 62a_200012175722_100000211926 [0,2,0,0,0,0|1,1,0]=4 10672 B12R1.69 Nc1nc(ccc1OCCF)Br 34a_100000685527_100011217306 [0,2,0,0,0,0|2,0,0]=4 10673 B12R1.69 Nc1nc(ccc1OCCF)Br 7a_100000685527_100011217306 [0,2,0,0,0,0|2,0,0]=4 10674 B12R1.69 Nc1nc(ccc1OCCF)Cl 34a_100000717809_100011217306 [0,2,0,0,0,0|2,0,0]=4 10675 B12R1.69 Nc1nc(ccc1OCCF)Cl 7a_100000717809_100011217306 [0,2,0,0,0,0|2,0,0]=4 10676 B12R1.69 Nc1nc(ccc1OCCO)Br 34a_100000685527_100000211926 [0,2,0,0,0,0|2,0,0]=4 10677 B12R1.69 Nc1nc(ccc1OCCO)Br 7a_100000685527_100000211926 [0,2,0,0,0,0|2,0,0]=4 10678 B12R1.69 Nc1nc(ccc1OCCO)Cl 34a_100000717809_100000211926 [0,2,0,0,0,0|2,0,0]=4 10679 B12R1.69 Nc1nc(ccc1OCCO)Cl 7a_100000717809_100000211926 [0,2,0,0,0,0|2,0,0]=4 10680 B12R1.69 O=CCNc1ccc(cc1Br)O 34a_100012001276_200009817547 [0,2,0,0,0,0|1,0,1]=4 10681 B12R1.69 O=CCNc1ccc(cc1Cl)O 34a_100011215599_200009817547 [0,2,0,0,0,0|1,0,1]=4 10682 B12R1.69 O=CCNc1ccc(cc1F)O 34a_100000759473_200009817547 [0,2,0,0,0,0|1,0,1]=4 10683 B12R1.69 O=CCNc1ccc(cc1I)O 34a_100010084370_200009817547 [0,2,0,0,0,0|1,0,1]=4 10684 B12R1.69 O=CCNc1ccc(cc1O)O 34a_100000106777_200009817547 [0,2,0,0,0,0|1,0,1]=4 10685 B12R1.69 O=CCOc1ccc(cc1Br)Br 34a_100000188717_200009817547 [0,2,0,0,0,0|1,0,1]=4 10686 B12R1.69 O=CCOc1ccc(cc1Br)Br 7a_100000188717_200015260668 [0,2,0,0,0,0|1,0,1]=4 10687 B12R1.69 O=CCOc1ccc(cc1Br)Cl 34a_100000211998_200009817547 [0,2,0,0,0,0|1,0,1]=4 10688 B12R1.69 O=CCOc1ccc(cc1Br)Cl 7a_100000211998_200015260668 [0,2,0,0,0,0|1,0,1]=4 10689 B12R1.69 O=CCOc1ccc(cc1Br)F 34a_100000211999_200009817547 [0,2,0,0,0,0|1,0,1]=4 10690 B12R1.69 O=CCOc1ccc(cc1Br)F 7a_100000211999_200015260668 [0,2,0,0,0,0|1,0,1]=4 10691 B12R1.69 O=CCOc1ccc(cc1Br)I 34a_100012361655_200009817547 [0,2,0,0,0,0|1,0,1]=4 10692 B12R1.69 O=CCOc1ccc(cc1Br)I 7a_100012361655_200015260668 [0,2,0,0,0,0|1,0,1]=4 10693 B12R1.69 O=CCOc1ccc(cc1Cl)Br 34a_100000186472_200009817547 [0,2,0,0,0,0|1,0,1]=4 10694 B12R1.69 O=CCOc1ccc(cc1Cl)Br 7a_100000186472_200015260668 [0,2,0,0,0,0|1,0,1]=4 10695 B12R1.69 O=CCOc1ccc(cc1Cl)Cl 34a_100015191787_200009817547 [0,2,0,0,0,0|1,0,1]=4 10696 B12R1.69 O=CCOc1ccc(cc1Cl)Cl 7a_100015191787_200015260668 [0,2,0,0,0,0|1,0,1]=4 10697 B12R1.69 O=CCOc1ccc(cc1Cl)F 34a_100000212004_200009817547 [0,2,0,0,0,0|1,0,1]=4 10698 B12R1.69 O=CCOc1ccc(cc1Cl)F 7a_100000212004_200015260668 [0,2,0,0,0,0|1,0,1]=4 10699 B12R1.69 O=CCOc1ccc(cc1Cl)I 34a_100012360047_200009817547 [0,2,0,0,0,0|1,0,1]=4 10700 B12R1.69 O=CCOc1ccc(cc1Cl)I 7a_100012360047_200015260668 [0,2,0,0,0,0|1,0,1]=4 10701 B12R1.69 O=CCOc1ccc(cc1F)Br 34a_100000185481_200009817547 [0,2,0,0,0,0|1,0,1]=4 10702 B12R1.69 O=CCOc1ccc(cc1F)Br 7a_100000185481_200015260668 [0,2,0,0,0,0|1,0,1]=4 10703 B12R1.69 O=CCOc1ccc(cc1F)Cl 34a_100000230166_200009817547 [0,2,0,0,0,0|1,0,1]=4 10704 B12R1.69 O=CCOc1ccc(cc1F)Cl 7a_100000230166_200015260668 [0,2,0,0,0,0|1,0,1]=4 10705 B12R1.69 O=CCOc1ccc(cc1F)F 34a_100000230127_200009817547 [0,2,0,0,0,0|1,0,1]=4 10706 B12R1.69 O=CCOc1ccc(cc1F)F 7a_100000230127_200015260668 [0,2,0,0,0,0|1,0,1]=4 10707 B12R1.69 O=CCOc1ccc(cc1F)I 34a_100011356965_200009817547 [0,2,0,0,0,0|1,0,1]=4 10708 B12R1.69 O=CCOc1ccc(cc1F)I 7a_100011356965_200015260668 [0,2,0,0,0,0|1,0,1]=4 10709 B12R1.69 O=CCOc1ccc(cc1I)Br 34a_100012355227_200009817547 [0,2,0,0,0,0|1,0,1]=4 10710 B12R1.69 O=CCOc1ccc(cc1I)Br 7a_100012355227_200015260668 [0,2,0,0,0,0|1,0,1]=4 10711 B12R1.69 O=CCOc1ccc(cc1I)Cl 34a_100011356953_200009817547 [0,2,0,0,0,0|1,0,1]=4 10712 B12R1.69 O=CCOc1ccc(cc1I)Cl 7a_100011356953_200015260668 [0,2,0,0,0,0|1,0,1]=4 10713 B12R1.69 O=CCOc1ccc(cc1I)F 34a_100012355409_200009817547 [0,2,0,0,0,0|1,0,1]=4 10714 B12R1.69 O=CCOc1ccc(cc1I)F 7a_100012355409_200015260668 [0,2,0,0,0,0|1,0,1]=4 10715 B12R1.69 O=CCOc1ccc(cc1I)I 7a_100010001573_200015260668 [0,2,0,0,0,0|1,0,1]=4 10716 B12R1.69 O=CCSc1ccc(cc1Br)O 62a_100000701344_200015260668 [0,2,0,0,0,0|0,1,1]=4 10717 B12R1.69 O=CCSc1ccc(cc1Br)O 62a_200015260668_100000701344 [0,2,0,0,0,0|0,1,1]=4 10718 B12R1.69 O=CCSc1ccc(cc1Cl)O 62a_100000047559_200015260668 [0,2,0,0,0,0|0,1,1]=4 10719 B12R1.69 O=CCSc1ccc(cc1Cl)O 62a_200015260668_100000047559 [0,2,0,0,0,0|0,1,1]=4 10720 B12R1.69 O=CCSc1ccc(cc1F)O 62a_100000755031_200015260668 [0,2,0,0,0,0|0,1,1]=4 10721 B12R1.69 O=CCSc1ccc(cc1F)O 62a_200015260668_100000755031 [0,2,0,0,0,0|0,1,1]=4 10722 B12R1.69 O=CCSc1ccc(cc1O)O 62a_200015260668_100009813921 [0,2,0,0,0,0|0,1,1]=4 10723 B12R1.69 OCCNc1ccc(cc1Br)Br 34a_100000211012_100000211926 [0,2,0,0,0,0|2,0,0]=4 10724 B12R1.69 OCCNc1ccc(cc1Br)Cl 34a_100000752454_100000211926 [0,2,0,0,0,0|2,0,0]=4 10725 B12R1.69 OCCNc1ccc(cc1Br)F 34a_100000738039_100000211926 [0,2,0,0,0,0|2,0,0]=4 10726 B12R1.69 OCCNc1ccc(cc1Br)O 34a_100012001276_100000211926 [0,2,0,0,0,0|1,0,0]=3 10727 B12R1.69 OCCNc1ccc(cc1Cl)Br 34a_100000211467_100000211926 [0,2,0,0,0,0|2,0,0]=4 10728 B12R1.69 OCCNc1ccc(cc1Cl)Cl 34a_100000185861_100000211926 [0,2,0,0,0,0|2,0,0]=4 10729 B12R1.69 OCCNc1ccc(cc1Cl)F 34a_100000212003_100000211926 [0,2,0,0,0,0|2,0,0]=4 10730 B12R1.69 OCCNc1ccc(cc1Cl)I 34a_100011218065_100000211926 [0,2,0,0,0,0|2,0,0]=4 10731 B12R1.69 OCCNc1ccc(cc1Cl)O 34a_100011215599_100000211926 [0,2,0,0,0,0|1,0,0]=3 10732 B12R1.69 OCCNc1ccc(cc1F)Br 34a_100000210722_100000211926 [0,2,0,0,0,0|2,0,0]=4 10733 B12R1.69 OCCNc1ccc(cc1F)Cl 34a_100000211020_100000211926 [0,2,0,0,0,0|2,0,0]=4 10734 B12R1.69 OCCNc1ccc(cc1F)F 34a_100000210720_100000211926 [0,2,0,0,0,0|2,0,0]=4 10735 B12R1.69 OCCNc1ccc(cc1F)I 34a_100011215594_100000211926 [0,2,0,0,0,0|2,0,0]=4 10736 B12R1.69 OCCNc1ccc(cc1F)O 34a_100000759473_100000211926 [0,2,0,0,0,0|1,0,0]=3 10737 B12R1.69 OCCNc1ccc(cc1I)Br 34a_100000187925_100000211926 [0,2,0,0,0,0|2,0,0]=4 10738 B12R1.69 OCCNc1ccc(cc1I)Cl 34a_100000761889_100000211926 [0,2,0,0,0,0|2,0,0]=4 10739 B12R1.69 OCCNc1ccc(cc1I)F 34a_100000760547_100000211926 [0,2,0,0,0,0|2,0,0]=4 10740 B12R1.69 OCCNc1ccc(cc1I)O 34a_100010084370_100000211926 [0,2,0,0,0,0|1,0,0]=3 10741 B12R1.69 OCCNc1ccc(cc1O)Br 34a_100000739049_100000211926 [0,2,0,0,0,0|2,0,0]=4 10742 B12R1.69 OCCNc1ccc(cc1O)Cl 34a_100000185728_100000211926 [0,2,0,0,0,0|2,0,0]=4 10743 B12R1.69 OCCNc1ccc(cc1O)F 34a_100000753323_100000211926 [0,2,0,0,0,0|2,0,0]=4 10744 B12R1.69 OCCNc1ccc(cc1O)O 34a_100000106777_100000211926 [0,2,0,0,0,0|1,0,0]=3 10745 B12R1.69 OCCOc1ccc(cc1Br)Br 34a_100000188717_100000211926 [0,2,0,0,0,0|1,0,0]=3 10746 B12R1.69 OCCOc1ccc(cc1Br)Br 7a_100000188717_100000211926 [0,2,0,0,0,0|1,0,0]=3 10747 B12R1.69 OCCOc1ccc(cc1Br)Cl 34a_100000211998_100000211926 [0,2,0,0,0,0|1,0,0]=3 10748 B12R1.69 OCCOc1ccc(cc1Br)Cl 7a_100000211998_100000211926 [0,2,0,0,0,0|1,0,0]=3 10749 B12R1.69 OCCOc1ccc(cc1Br)F 34a_100000211999_100000211926 [0,2,0,0,0,0|1,0,0]=3 10750 B12R1.69 OCCOc1ccc(cc1Br)F 7a_100000211999_100000211926 [0,2,0,0,0,0|1,0,0]=3 10751 B12R1.69 OCCOc1ccc(cc1Br)I 34a_100012361655_100000211926 [0,2,0,0,0,0|1,0,0]=3 10752 B12R1.69 OCCOc1ccc(cc1Br)I 7a_100012361655_100000211926 [0,2,0,0,0,0|1,0,0]=3 10753 B12R1.69 OCCOc1ccc(cc1Cl)Br 34a_100000186472_100000211926 [0,2,0,0,0,0|1,0,0]=3 10754 B12R1.69 OCCOc1ccc(cc1Cl)Br 7a_100000186472_100000211926 [0,2,0,0,0,0|1,0,0]=3 10755 B12R1.69 OCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000211926 [0,2,0,0,0,0|1,0,0]=3 10756 B12R1.69 OCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000211926 [0,2,0,0,0,0|1,0,0]=3 10757 B12R1.69 OCCOc1ccc(cc1Cl)F 34a_100000212004_100000211926 [0,2,0,0,0,0|1,0,0]=3 10758 B12R1.69 OCCOc1ccc(cc1Cl)F 7a_100000212004_100000211926 [0,2,0,0,0,0|1,0,0]=3 10759 B12R1.69 OCCOc1ccc(cc1Cl)I 34a_100012360047_100000211926 [0,2,0,0,0,0|1,0,0]=3 10760 B12R1.69 OCCOc1ccc(cc1Cl)I 7a_100012360047_100000211926 [0,2,0,0,0,0|1,0,0]=3 10761 B12R1.69 OCCOc1ccc(cc1F)Br 34a_100000185481_100000211926 [0,2,0,0,0,0|1,0,0]=3 10762 B12R1.69 OCCOc1ccc(cc1F)Br 7a_100000185481_100000211926 [0,2,0,0,0,0|1,0,0]=3 10763 B12R1.69 OCCOc1ccc(cc1F)Cl 34a_100000230166_100000211926 [0,2,0,0,0,0|1,0,0]=3 10764 B12R1.69 OCCOc1ccc(cc1F)Cl 7a_100000230166_100000211926 [0,2,0,0,0,0|1,0,0]=3 10765 B12R1.69 OCCOc1ccc(cc1F)F 34a_100000230127_100000211926 [0,2,0,0,0,0|1,0,0]=3 10766 B12R1.69 OCCOc1ccc(cc1F)F 7a_100000230127_100000211926 [0,2,0,0,0,0|1,0,0]=3 10767 B12R1.69 OCCOc1ccc(cc1F)I 34a_100011356965_100000211926 [0,2,0,0,0,0|1,0,0]=3 10768 B12R1.69 OCCOc1ccc(cc1F)I 7a_100011356965_100000211926 [0,2,0,0,0,0|1,0,0]=3 10769 B12R1.69 OCCOc1ccc(cc1I)Br 34a_100012355227_100000211926 [0,2,0,0,0,0|1,0,0]=3 10770 B12R1.69 OCCOc1ccc(cc1I)Br 7a_100012355227_100000211926 [0,2,0,0,0,0|1,0,0]=3 10771 B12R1.69 OCCOc1ccc(cc1I)Cl 34a_100011356953_100000211926 [0,2,0,0,0,0|1,0,0]=3 10772 B12R1.69 OCCOc1ccc(cc1I)Cl 7a_100011356953_100000211926 [0,2,0,0,0,0|1,0,0]=3 10773 B12R1.69 OCCOc1ccc(cc1I)F 34a_100012355409_100000211926 [0,2,0,0,0,0|1,0,0]=3 10774 B12R1.69 OCCOc1ccc(cc1I)F 7a_100012355409_100000211926 [0,2,0,0,0,0|1,0,0]=3 10775 B12R1.69 OCCOc1ccc(cc1I)I 7a_100010001573_100000211926 [0,2,0,0,0,0|1,0,0]=3 10776 B12R1.69 OCCOc1ccc(nc1Br)Br 34a_100009999766_100000211926 [0,2,0,0,0,0|2,0,0]=4 10777 B12R1.69 OCCOc1ccc(nc1Br)Br 7a_100009999766_100000211926 [0,2,0,0,0,0|2,0,0]=4 10778 B12R1.69 OCCOc1ccc(nc1Br)Cl 34a_100010219353_100000211926 [0,2,0,0,0,0|2,0,0]=4 10779 B12R1.69 OCCOc1ccc(nc1Br)Cl 7a_100010219353_100000211926 [0,2,0,0,0,0|2,0,0]=4 10780 B12R1.69 OCCOc1ccc(nc1Br)F 34a_100009887730_100000211926 [0,2,0,0,0,0|2,0,0]=4 10781 B12R1.69 OCCOc1ccc(nc1Br)F 7a_100009887730_100000211926 [0,2,0,0,0,0|2,0,0]=4 10782 B12R1.69 OCCOc1ccc(nc1Br)I 34a_100000725334_100000211926 [0,2,0,0,0,0|2,0,0]=4 10783 B12R1.69 OCCOc1ccc(nc1Br)I 7a_100000725334_100000211926 [0,2,0,0,0,0|2,0,0]=4 10784 B12R1.69 OCCOc1ccc(nc1Cl)Br 34a_100010246206_100000211926 [0,2,0,0,0,0|2,0,0]=4 10785 B12R1.69 OCCOc1ccc(nc1Cl)Br 7a_100010246206_100000211926 [0,2,0,0,0,0|2,0,0]=4 10786 B12R1.69 OCCOc1ccc(nc1Cl)Cl 34a_100000101165_100000211926 [0,2,0,0,0,0|2,0,0]=4 10787 B12R1.69 OCCOc1ccc(nc1Cl)Cl 7a_100000101165_100000211926 [0,2,0,0,0,0|2,0,0]=4 10788 B12R1.69 OCCOc1ccc(nc1Cl)I 34a_100000721234_100000211926 [0,2,0,0,0,0|2,0,0]=4 10789 B12R1.69 OCCOc1ccc(nc1Cl)I 7a_100000721234_100000211926 [0,2,0,0,0,0|2,0,0]=4 10790 B12R1.69 OCCOc1ccc(nc1F)Br 34a_100009819667_100000211926 [0,2,0,0,0,0|2,0,0]=4 10791 B12R1.69 OCCOc1ccc(nc1F)Br 7a_100009819667_100000211926 [0,2,0,0,0,0|2,0,0]=4 10792 B12R1.69 OCCOc1ccc(nc1F)Cl 34a_100009880201_100000211926 [0,2,0,0,0,0|2,0,0]=4 10793 B12R1.69 OCCOc1ccc(nc1F)Cl 7a_100009880201_100000211926 [0,2,0,0,0,0|2,0,0]=4 10794 B12R1.69 OCCOc1ccc(nc1F)F 34a_100000101184_100000211926 [0,2,0,0,0,0|2,0,0]=4 10795 B12R1.69 OCCOc1ccc(nc1F)F 7a_100000101184_100000211926 [0,2,0,0,0,0|2,0,0]=4 10796 B12R1.69 OCCOc1ccc(nc1I)Br 34a_100010253912_100000211926 [0,2,0,0,0,0|2,0,0]=4 10797 B12R1.69 OCCOc1ccc(nc1I)Br 7a_100010253912_100000211926 [0,2,0,0,0,0|2,0,0]=4 10798 B12R1.69 OCCOc1ccc(nc1I)Cl 34a_100000696390_100000211926 [0,2,0,0,0,0|2,0,0]=4 10799 B12R1.69 OCCOc1ccc(nc1I)Cl 7a_100000696390_100000211926 [0,2,0,0,0,0|2,0,0]=4 10800 B12R1.69 OCCOc1ccc(nc1I)F 34a_100010382442_100000211926 [0,2,0,0,0,0|2,0,0]=4 10801 B12R1.69 OCCOc1ccc(nc1I)F 7a_100010382442_100000211926 [0,2,0,0,0,0|2,0,0]=4 10802 B12R1.69 OCCOc1cnc(cc1Cl)Cl 34a_100009868576_100000211926 [0,2,0,0,0,0|2,0,0]=4 10803 B12R1.69 OCCOc1cnc(cc1Cl)Cl 7a_100009868576_100000211926 [0,2,0,0,0,0|2,0,0]=4 10804 B12R1.69 OCCOc1cnc(cc1F)F 34a_100009885687_100000211926 [0,2,0,0,0,0|2,0,0]=4 10805 B12R1.69 OCCOc1cnc(cc1F)F 7a_100009885687_100000211926 [0,2,0,0,0,0|2,0,0]=4 10806 B12R1.69 OCCOc1cnc(cc1I)Cl 34a_100000698892_100000211926 [0,2,0,0,0,0|2,0,0]=4 10807 B12R1.69 OCCOc1cnc(cc1I)Cl 7a_100000698892_100000211926 [0,2,0,0,0,0|2,0,0]=4 10808 B12R1.69 OCCOc1ncc(cc1Br)Br 34a_100000701035_100000211926 [0,2,0,0,0,0|2,0,0]=4 10809 B12R1.69 OCCOc1ncc(cc1Cl)Br 34a_100012339560_100000211926 [0,2,0,0,0,0|2,0,0]=4 10810 B12R1.69 OCCOc1ncc(cc1Cl)F 34a_100009847679_100000211926 [0,2,0,0,0,0|2,0,0]=4 10811 B12R1.69 OCCOc1ncc(cc1F)Cl 34a_100011998252_100000211926 [0,2,0,0,0,0|2,0,0]=4 10812 B12R1.69 OCCOc1ncc(cc1F)F 34a_100012025737_100000211926 [0,2,0,0,0,0|2,0,0]=4 10813 B12R1.69 OCCSc1ccc(cc1Br)Br 62a_100000211926_100011484698 [0,2,0,0,0,0|1,1,0]=4 10814 B12R1.69 OCCSc1ccc(cc1Br)Br 62a_100011484698_100000211926 [0,2,0,0,0,0|1,1,0]=4 10815 B12R1.69 OCCSc1ccc(cc1Br)Cl 62a_100000211926_100011219703 [0,2,0,0,0,0|1,1,0]=4 10816 B12R1.69 OCCSc1ccc(cc1Br)Cl 62a_100011219703_100000211926 [0,2,0,0,0,0|1,1,0]=4 10817 B12R1.69 OCCSc1ccc(cc1Br)F 62a_100000211926_100011217111 [0,2,0,0,0,0|1,1,0]=4 10818 B12R1.69 OCCSc1ccc(cc1Br)F 62a_100011217111_100000211926 [0,2,0,0,0,0|1,1,0]=4 10819 B12R1.69 OCCSc1ccc(cc1Br)O 62a_100000211926_100000701344 [0,2,0,0,0,0|0,1,0]=3 10820 B12R1.69 OCCSc1ccc(cc1Br)O 62a_100000701344_100000211926 [0,2,0,0,0,0|0,1,0]=3 10821 B12R1.69 OCCSc1ccc(cc1Cl)Br 62a_100000211926_100011216062 [0,2,0,0,0,0|1,1,0]=4 10822 B12R1.69 OCCSc1ccc(cc1Cl)Br 62a_100011216062_100000211926 [0,2,0,0,0,0|1,1,0]=4 10823 B12R1.69 OCCSc1ccc(cc1Cl)Cl 62a_100000211926_100000699841 [0,2,0,0,0,0|1,1,0]=4 10824 B12R1.69 OCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000211926 [0,2,0,0,0,0|1,1,0]=4 10825 B12R1.69 OCCSc1ccc(cc1Cl)F 62a_100000211926_100000733362 [0,2,0,0,0,0|1,1,0]=4 10826 B12R1.69 OCCSc1ccc(cc1Cl)F 62a_100000733362_100000211926 [0,2,0,0,0,0|1,1,0]=4 10827 B12R1.69 OCCSc1ccc(cc1Cl)O 62a_100000047559_100000211926 [0,2,0,0,0,0|0,1,0]=3 10828 B12R1.69 OCCSc1ccc(cc1Cl)O 62a_100000211926_100000047559 [0,2,0,0,0,0|0,1,0]=3 10829 B12R1.69 OCCSc1ccc(cc1F)Br 62a_100000211926_100009814013 [0,2,0,0,0,0|1,1,0]=4 10830 B12R1.69 OCCSc1ccc(cc1F)Br 62a_100009814013_100000211926 [0,2,0,0,0,0|1,1,0]=4 10831 B12R1.69 OCCSc1ccc(cc1F)Cl 62a_100000211926_100011216042 [0,2,0,0,0,0|1,1,0]=4 10832 B12R1.69 OCCSc1ccc(cc1F)Cl 62a_100011216042_100000211926 [0,2,0,0,0,0|1,1,0]=4 10833 B12R1.69 OCCSc1ccc(cc1F)F 62a_100000211926_100000750030 [0,2,0,0,0,0|1,1,0]=4 10834 B12R1.69 OCCSc1ccc(cc1F)F 62a_100000750030_100000211926 [0,2,0,0,0,0|1,1,0]=4 10835 B12R1.69 OCCSc1ccc(cc1F)O 62a_100000211926_100000755031 [0,2,0,0,0,0|0,1,0]=3 10836 B12R1.69 OCCSc1ccc(cc1F)O 62a_100000755031_100000211926 [0,2,0,0,0,0|0,1,0]=3 10837 B12R1.69 OCCSc1ccc(cc1O)Br 62a_100000211926_100012344904 [0,2,0,0,0,0|1,1,0]=4 10838 B12R1.69 OCCSc1ccc(cc1O)Br 62a_100012344904_100000211926 [0,2,0,0,0,0|1,1,0]=4 10839 B12R1.69 OCCSc1ccc(cc1O)Cl 62a_100000050036_100000211926 [0,2,0,0,0,0|1,1,0]=4 10840 B12R1.69 OCCSc1ccc(cc1O)Cl 62a_100000211926_100000050036 [0,2,0,0,0,0|1,1,0]=4 10841 B12R1.69 OCCSc1ccc(cc1O)F 62a_100000211926_100000690578 [0,2,0,0,0,0|1,1,0]=4 10842 B12R1.69 OCCSc1ccc(cc1O)F 62a_100000690578_100000211926 [0,2,0,0,0,0|1,1,0]=4 10843 B12R1.69 OCCSc1ccc(cc1O)O 62a_100000211926_100009813921 [0,2,0,0,0,0|0,1,0]=3 10844 B12R1.69 OCCSc1ccc(nc1F)O 62a_100000211926_100009879308 [0,2,0,0,0,0|1,1,0]=4 10845 B12R1.69 OCCSc1ccc(nc1F)O 62a_100009879308_100000211926 [0,2,0,0,0,0|1,1,0]=4 10846 B12R1.69 OCCSc1ncc(cc1F)O 62a_100000211926_100000063512 [0,2,0,0,0,0|1,1,0]=4 10847 B12R1.69 Oc1cc(ccc1NCCF)Br 34a_100000739049_100011217306 [0,2,0,0,0,0|2,0,0]=4 10848 B12R1.69 Oc1cc(ccc1NCCF)Cl 34a_100000185728_100011217306 [0,2,0,0,0,0|2,0,0]=4 10849 B12R1.69 Oc1cc(ccc1NCCF)F 34a_100000753323_100011217306 [0,2,0,0,0,0|2,0,0]=4 10850 B12R1.69 Oc1cc(ccc1SCCF)Br 62a_100011217306_100012344904 [0,2,0,0,0,0|1,1,0]=4 10851 B12R1.69 Oc1cc(ccc1SCCF)Br 62a_100012344904_100011217306 [0,2,0,0,0,0|1,1,0]=4 10852 B12R1.69 Oc1cc(ccc1SCCF)Cl 62a_100000050036_100011217306 [0,2,0,0,0,0|1,1,0]=4 10853 B12R1.69 Oc1cc(ccc1SCCF)Cl 62a_100011217306_100000050036 [0,2,0,0,0,0|1,1,0]=4 10854 B12R1.69 Oc1cc(ccc1SCCF)F 62a_100000690578_100011217306 [0,2,0,0,0,0|1,1,0]=4 10855 B12R1.69 Oc1cc(ccc1SCCF)F 62a_100011217306_100000690578 [0,2,0,0,0,0|1,1,0]=4 10856 B12R1.69 Oc1ccc(c(c1)Br)NCCF 34a_100012001276_100011217306 [0,2,0,0,0,0|1,0,0]=3 10857 B12R1.69 Oc1ccc(c(c1)Br)SCCF 62a_100000701344_100011217306 [0,2,0,0,0,0|0,1,0]=3 10858 B12R1.69 Oc1ccc(c(c1)Br)SCCF 62a_100011217306_100000701344 [0,2,0,0,0,0|0,1,0]=3 10859 B12R1.69 Oc1ccc(c(c1)Cl)CNCF 34a_200161156549_100015361967 [0,2,0,0,0,0|2,0,0]=4 10860 B12R1.69 Oc1ccc(c(c1)Cl)NCCF 34a_100011215599_100011217306 [0,2,0,0,0,0|1,0,0]=3 10861 B12R1.69 Oc1ccc(c(c1)Cl)SCCF 62a_100000047559_100011217306 [0,2,0,0,0,0|0,1,0]=3 10862 B12R1.69 Oc1ccc(c(c1)Cl)SCCF 62a_100011217306_100000047559 [0,2,0,0,0,0|0,1,0]=3 10863 B12R1.69 Oc1ccc(c(c1)F)NCCF 34a_100000759473_100011217306 [0,2,0,0,0,0|1,0,0]=3 10864 B12R1.69 Oc1ccc(c(c1)F)SCCF 62a_100000755031_100011217306 [0,2,0,0,0,0|0,1,0]=3 10865 B12R1.69 Oc1ccc(c(c1)F)SCCF 62a_100011217306_100000755031 [0,2,0,0,0,0|0,1,0]=3 10866 B12R1.69 Oc1ccc(c(c1)I)NCCF 34a_100010084370_100011217306 [0,2,0,0,0,0|1,0,0]=3 10867 B12R1.69 Oc1ccc(c(c1)O)NCCF 34a_100000106777_100011217306 [0,2,0,0,0,0|1,0,0]=3 10868 B12R1.69 Oc1ccc(c(c1)O)SCCF 62a_100011217306_100009813921 [0,2,0,0,0,0|0,1,0]=3 10869 B12R1.69 Oc1ccc(c(n1)F)SCCF 62a_100009879308_100011217306 [0,2,0,0,0,0|1,1,0]=4 10870 B12R1.69 Oc1ccc(c(n1)F)SCCF 62a_100011217306_100009879308 [0,2,0,0,0,0|1,1,0]=4 10871 B12R1.69 Oc1cnc(c(c1)F)SCCF 62a_100011217306_100000063512 [0,2,0,0,0,0|1,1,0]=4 10872 B12R1.69 [13CH3]NCCc1ccc(cc1Cl)Cl 2230a_100000210994_200025704644 [0,2,0,0,0,0|2,0,0]=4 10873 B12R1.69 [13CH3]NCCc1ccc(cc1Cl)Cl 34a_100000210994_200025704644 [0,2,0,0,0,0|2,0,0]=4 10874 B12R1.69 [13CH3]NCCc1ccc(cc1F)Cl 2230a_103496529009_200025704644 [0,2,0,0,0,0|2,0,0]=4 10875 B12R1.69 [13CH3]NCCc1ccc(cc1F)Cl 34a_103496529009_200025704644 [0,2,0,0,0,0|2,0,0]=4 10876 B12R1.69 [13CH3]NCCc1ccc(cc1F)F 2230a_100000754870_200025704644 [0,2,0,0,0,0|2,0,0]=4 10877 B12R1.69 [13CH3]NCCc1ccc(cc1F)F 34a_100000754870_200025704644 [0,2,0,0,0,0|2,0,0]=4 10878 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Br 34a_100013445822_200025704644 [0,2,0,0,0,0|2,0,0]=4 10879 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Br 7a_100013445822_200025704644 [0,2,0,0,0,0|2,0,0]=4 10880 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Cl 34a_100011215701_200025704644 [0,2,0,0,0,0|2,0,0]=4 10881 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Cl 7a_100011215701_200025704644 [0,2,0,0,0,0|2,0,0]=4 10882 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)F 34a_100011962860_200025704644 [0,2,0,0,0,0|2,0,0]=4 10883 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)F 7a_100011962860_200025704644 [0,2,0,0,0,0|2,0,0]=4 10884 B12R1.69 [13CH3]OCCc1ccc(cc1F)Br 34a_100011962869_200025704644 [0,2,0,0,0,0|2,0,0]=4 10885 B12R1.69 [13CH3]OCCc1ccc(cc1F)Br 7a_100011962869_200025704644 [0,2,0,0,0,0|2,0,0]=4 10886 B12R1.69 [13CH3]OCCc1ccc(cc1F)F 34a_100000697962_200025704644 [0,2,0,0,0,0|2,0,0]=4 10887 B12R1.69 [13CH3]OCCc1ccc(cc1F)F 7a_100000697962_200025704644 [0,2,0,0,0,0|2,0,0]=4 10888 B12R1.69 [13CH3]SCCc1ccc(cc1Br)Cl 62a_200012945151_200025704644 [0,2,0,0,0,0|2,0,0]=4 10889 B12R1.69 [13CH3]SCCc1ccc(cc1Br)Cl 62a_200025704644_200012945151 [0,2,0,0,0,0|2,0,0]=4 10890 B12R1.69 [13CH3]SCCc1ccc(cc1Cl)Cl 62a_200012161198_200025704644 [0,2,0,0,0,0|2,0,0]=4 10891 B12R1.69 [13CH3]SCCc1ccc(cc1Cl)Cl 62a_200025704644_200012161198 [0,2,0,0,0,0|2,0,0]=4 10892 B12R1.71 C#CCNc1ccc(cc1)CO 2230a_100011215238_100000038162 [0,2,0,0,0,0|1,0,1]=4 10893 B12R1.71 C#CCNc1ccc(cc1)CO 34a_100011215238_100000184674 [0,2,0,0,0,0|1,0,1]=4 10894 B12R1.71 C#CCNc1ccc(cc1)OC 34a_100000184247_100000184674 [0,2,0,0,0,0|1,0,1]=4 10895 B12R1.71 C#CCOc1ccc(cc1)C#N 34a_100000210344_100000184674 [0,2,0,0,0,0|1,0,1]=4 10896 B12R1.71 C#CCOc1ccc(cc1)C#N 7a_100000210344_100000038162 [0,2,0,0,0,0|1,0,1]=4 10897 B12R1.71 C#CCOc1ccc(cc1)C=C 34a_100000189437_100000184674 [0,2,0,0,0,0|1,0,1]=4 10898 B12R1.71 C#CCOc1ccc(cc1)C=C 7a_100000189437_100000038162 [0,2,0,0,0,0|1,0,1]=4 10899 B12R1.71 C#CCOc1ccc(cc1)CC 34a_100000211359_100000184674 [0,2,0,0,0,0|1,0,1]=4 10900 B12R1.71 C#CCOc1ccc(cc1)CC 7a_100000211359_100000038162 [0,2,0,0,0,0|1,0,1]=4 10901 B12R1.71 C#CCOc1ccc(cc1)CN 34a_100000185549_100000184674 [0,2,0,0,0,0|1,0,1]=4 10902 B12R1.71 C#CCOc1ccc(cc1)CO 34a_100000211755_100000184674 [0,2,0,0,0,0|0,0,1]=3 10903 B12R1.71 C#CCOc1ccc(cc1)NC 2230a_100000753246_200000210301 [0,2,0,0,0,0|1,0,1]=4 10904 B12R1.71 C#CCOc1ccc(cc1)NC 34a_100000182112_100000184674 [0,2,0,0,0,0|1,0,1]=4 10905 B12R1.71 C#CCOc1ccc(cc1)NC 34a_100000753246_200000210301 [0,2,0,0,0,0|1,0,1]=4 10906 B12R1.71 C#CCOc1ccc(cc1)N[13CH3] 2230a_100000753246_200025704644 [0,2,0,0,0,0|1,0,1]=4 10907 B12R1.71 C#CCOc1ccc(cc1)N[13CH3] 34a_100000753246_200025704644 [0,2,0,0,0,0|1,0,1]=4 10908 B12R1.71 C#CCOc1ccc(cc1)OC 34a_100000210503_100000184674 [0,2,0,0,0,0|0,0,1]=3 10909 B12R1.71 C#CCOc1ccc(cc1)SC 34a_100000211864_100000184674 [0,2,0,0,0,0|0,1,1]=4 10910 B12R1.71 C#CCOc1ccc(cn1)OC 34a_100012002028_100000184674 [0,2,0,0,0,0|1,0,1]=4 10911 B12R1.71 C#CCOc1ccc(nc1)CO 34a_103436540053_100000184674 [0,2,0,0,0,0|1,0,1]=4 10912 B12R1.71 C#CCOc1ccc(nc1)OC 34a_100011934560_100000184674 [0,2,0,0,0,0|1,0,1]=4 10913 B12R1.71 C#CCSc1ccc(cc1)CO 62a_100000038162_100000690907 [0,2,0,0,0,0|0,1,1]=4 10914 B12R1.71 C#CCSc1ccc(cc1)OC 62a_100000038162_100000171711 [0,2,0,0,0,0|0,1,1]=4 10915 B12R1.71 C#Cc1ccc(cc1)CNCC 207a_100015525214_100011361452 [0,2,0,0,0,0|2,0,0]=4 10916 B12R1.71 C#Cc1ccc(cc1)CNCC 2230a_100015199678_100000210202 [0,2,0,0,0,0|2,0,0]=4 10917 B12R1.71 C#Cc1ccc(cc1)CNCC 2230a_100015525214_100000140223 [0,2,0,0,0,0|2,0,0]=4 10918 B12R1.71 C#Cc1ccc(cc1)CNCC 270004a_100015525214_100011361452 [0,2,0,0,0,0|2,0,0]=4 10919 B12R1.71 C#Cc1ccc(cc1)CNCC 34a_100015199678_100000210202 [0,2,0,0,0,0|2,0,0]=4 10920 B12R1.71 C#Cc1ccc(cc1)COCC 34a_100000054647_100000210202 [0,2,0,0,0,0|1,0,0]=3 10921 B12R1.71 C#Cc1ccc(cc1)COCC 34a_100121572206_100000140223 [0,2,0,0,0,0|1,0,0]=3 10922 B12R1.71 C#Cc1ccc(cc1)COCC 7a_100000054647_100000210202 [0,2,0,0,0,0|1,0,0]=3 10923 B12R1.71 C#Cc1ccc(cc1)COCF 34a_100000054647_100015361967 [0,2,0,0,0,0|2,0,0]=4 10924 B12R1.71 C#Cc1ccc(cc1)COCF 7a_100000054647_100015361967 [0,2,0,0,0,0|2,0,0]=4 10925 B12R1.71 C#Cc1ccc(cc1)CSCC 62a_100000210202_100000140223 [0,2,0,0,0,0|1,1,0]=4 10926 B12R1.71 C#Cc1ccc(cc1)NCCC 34a_100011215031_100000210303 [0,2,0,0,0,0|2,0,0]=4 10927 B12R1.71 C#Cc1ccc(cc1)NCCF 34a_100011215031_100011217306 [0,2,0,0,0,0|2,0,0]=4 10928 B12R1.71 C#Cc1ccc(cc1)NCCO 34a_100011215031_100000211926 [0,2,0,0,0,0|2,0,0]=4 10929 B12R1.71 C#Cc1ccc(cc1)NCSC 34a_100011215031_100011218213 [0,2,0,0,0,0|2,0,0]=4 10930 B12R1.71 C#Cc1ccc(nc1)OCCC 34a_200009884252_100000210303 [0,2,0,0,0,0|2,0,0]=4 10931 B12R1.71 C#Cc1ccc(nc1)OCCF 34a_200009884252_100011217306 [0,2,0,0,0,0|2,0,0]=4 10932 B12R1.71 C#Cc1ccc(nc1)OCCO 34a_200009884252_100000211926 [0,2,0,0,0,0|2,0,0]=4 10933 B12R1.71 C#Cc1ccc(nc1)OCSC 34a_200009884252_100011218213 [0,2,0,0,0,0|2,0,0]=4 10934 B12R1.71 C=CCNc1ccc(cc1)CO 2230a_100011215238_100000210623 [0,2,0,0,0,0|1,0,1]=4 10935 B12R1.71 C=CCNc1ccc(cc1)CO 34a_100011215238_100015514636 [0,2,0,0,0,0|1,0,1]=4 10936 B12R1.71 C=CCNc1ccc(cc1)OC 34a_100000184247_100015514636 [0,2,0,0,0,0|1,0,1]=4 10937 B12R1.71 C=CCOc1ccc(cc1)C#N 34a_100000210344_100015514636 [0,2,0,0,0,0|1,0,1]=4 10938 B12R1.71 C=CCOc1ccc(cc1)C#N 7a_100000210344_100015514636 [0,2,0,0,0,0|1,0,1]=4 10939 B12R1.71 C=CCOc1ccc(cc1)C=C 271570a_100011290941_100000172055 [0,2,0,0,0,0|1,0,1]=4 10940 B12R1.71 C=CCOc1ccc(cc1)C=C 34a_100000189437_100015514636 [0,2,0,0,0,0|1,0,1]=4 10941 B12R1.71 C=CCOc1ccc(cc1)C=C 7a_100000189437_100015514636 [0,2,0,0,0,0|1,0,1]=4 10942 B12R1.71 C=CCOc1ccc(cc1)CC 34a_100000211359_100015514636 [0,2,0,0,0,0|1,0,1]=4 10943 B12R1.71 C=CCOc1ccc(cc1)CC 7a_100000211359_100015514636 [0,2,0,0,0,0|1,0,1]=4 10944 B12R1.71 C=CCOc1ccc(cc1)CN 34a_100000185549_100015514636 [0,2,0,0,0,0|1,0,1]=4 10945 B12R1.71 C=CCOc1ccc(cc1)CO 34a_100000211755_100015514636 [0,2,0,0,0,0|0,0,1]=3 10946 B12R1.71 C=CCOc1ccc(cc1)NC 34a_100000182112_100015514636 [0,2,0,0,0,0|1,0,1]=4 10947 B12R1.71 C=CCOc1ccc(cc1)OC 34a_100000210503_100015514636 [0,2,0,0,0,0|0,0,1]=3 10948 B12R1.71 C=CCOc1ccc(cc1)SC 34a_100000211864_100015514636 [0,2,0,0,0,0|0,1,1]=4 10949 B12R1.71 C=CCOc1ccc(cc1)SC 62a_100000172055_200000210301 [0,2,0,0,0,0|0,1,1]=4 10950 B12R1.71 C=CCOc1ccc(cc1)SC 62a_200000210301_100000172055 [0,2,0,0,0,0|0,1,1]=4 10951 B12R1.71 C=CCOc1ccc(cc1)S[13CH3] 62a_100000172055_200025704644 [0,2,0,0,0,0|0,1,1]=4 10952 B12R1.71 C=CCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000172055 [0,2,0,0,0,0|0,1,1]=4 10953 B12R1.71 C=CCOc1ccc(cn1)OC 34a_100012002028_100015514636 [0,2,0,0,0,0|1,0,1]=4 10954 B12R1.71 C=CCOc1ccc(nc1)CO 34a_103436540053_100015514636 [0,2,0,0,0,0|1,0,1]=4 10955 B12R1.71 C=CCOc1ccc(nc1)OC 34a_100011934560_100015514636 [0,2,0,0,0,0|1,0,1]=4 10956 B12R1.71 C=CCSc1ccc(cc1)CO 62a_100000210623_100000690907 [0,2,0,0,0,0|0,1,1]=4 10957 B12R1.71 C=CCSc1ccc(cc1)CO 62a_100000690907_100000210623 [0,2,0,0,0,0|0,1,1]=4 10958 B12R1.71 C=CCSc1ccc(cc1)OC 62a_100000210623_100000171711 [0,2,0,0,0,0|0,1,1]=4 10959 B12R1.71 C=Cc1ccc(cc1)CCCC 271570a_100011290941_100011215597 [0,2,0,0,0,0|2,0,0]=4 10960 B12R1.71 C=Cc1ccc(cc1)CCCN 271570a_100011290941_100011297623 [0,2,0,0,0,0|2,0,0]=4 10961 B12R1.71 C=Cc1ccc(cc1)CCCO 271570a_100011290941_100011709247 [0,2,0,0,0,0|2,0,0]=4 10962 B12R1.71 C=Cc1ccc(cc1)CCNC 2230a_106832991635_100000142037 [0,2,0,0,0,0|2,0,0]=4 10963 B12R1.71 C=Cc1ccc(cc1)CCNC 271570a_100011290941_100000752880 [0,2,0,0,0,0|2,0,0]=4 10964 B12R1.71 C=Cc1ccc(cc1)CCNC 34a_100102657272_100000142037 [0,2,0,0,0,0|2,0,0]=4 10965 B12R1.71 C=Cc1ccc(cc1)CCNC 7a_106832991635_100000142037 [0,2,0,0,0,0|2,0,0]=4 10966 B12R1.71 C=Cc1ccc(cc1)CCOC 271570a_100011290941_100000739703 [0,2,0,0,0,0|2,0,0]=4 10967 B12R1.71 C=Cc1ccc(cc1)CCOC 34a_100138415774_100000142037 [0,2,0,0,0,0|2,0,0]=4 10968 B12R1.71 C=Cc1ccc(cc1)CCSC 62a_100000142037_200000210301 [0,2,0,0,0,0|2,0,0]=4 10969 B12R1.71 C=Cc1ccc(cc1)CCSC 62a_200000210301_100000142037 [0,2,0,0,0,0|2,0,0]=4 10970 B12R1.71 C=Cc1ccc(cc1)CCS[13CH3] 62a_100000142037_200025704644 [0,2,0,0,0,0|2,0,0]=4 10971 B12R1.71 C=Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100000142037 [0,2,0,0,0,0|2,0,0]=4 10972 B12R1.71 C=Cc1ccc(cc1)CNCC 2230a_100015525214_100000034074 [0,2,0,0,0,0|2,0,0]=4 10973 B12R1.71 C=Cc1ccc(cc1)CNCC 270004a_100015525214_100011361436 [0,2,0,0,0,0|2,0,0]=4 10974 B12R1.71 C=Cc1ccc(cc1)CNCC 271570a_100011290941_100000187385 [0,2,0,0,0,0|2,0,0]=4 10975 B12R1.71 C=Cc1ccc(cc1)CNCC 34a_200011934891_100000210202 [0,2,0,0,0,0|2,0,0]=4 10976 B12R1.71 C=Cc1ccc(cc1)COCC 271570a_100011290941_100000758564 [0,2,0,0,0,0|1,0,0]=3 10977 B12R1.71 C=Cc1ccc(cc1)COCC 34a_100000073583_100000210202 [0,2,0,0,0,0|1,0,0]=3 10978 B12R1.71 C=Cc1ccc(cc1)COCC 34a_100121572206_100000034074 [0,2,0,0,0,0|1,0,0]=3 10979 B12R1.71 C=Cc1ccc(cc1)COCC 7a_100000073583_100000210202 [0,2,0,0,0,0|1,0,0]=3 10980 B12R1.71 C=Cc1ccc(cc1)COCF 34a_100000073583_100015361967 [0,2,0,0,0,0|2,0,0]=4 10981 B12R1.71 C=Cc1ccc(cc1)COCF 7a_100000073583_100015361967 [0,2,0,0,0,0|2,0,0]=4 10982 B12R1.71 C=Cc1ccc(cc1)CSCC 62a_100000034074_100000210202 [0,2,0,0,0,0|1,1,0]=4 10983 B12R1.71 C=Cc1ccc(cc1)CSCC 62a_100000210202_100000034074 [0,2,0,0,0,0|1,1,0]=4 10984 B12R1.71 C=Cc1ccc(cc1)NCCC 34a_100011218248_100000210303 [0,2,0,0,0,0|2,0,0]=4 10985 B12R1.71 C=Cc1ccc(cc1)NCCF 34a_100011218248_100011217306 [0,2,0,0,0,0|2,0,0]=4 10986 B12R1.71 C=Cc1ccc(cc1)NCCO 34a_100011218248_100000211926 [0,2,0,0,0,0|2,0,0]=4 10987 B12R1.71 C=Cc1ccc(cc1)NCSC 34a_100011218248_100011218213 [0,2,0,0,0,0|2,0,0]=4 10988 B12R1.71 C=Cc1ccc(cc1)OCC#N 271570a_100011290941_200000169425 [0,2,0,0,0,0|1,0,1]=4 10989 B12R1.71 C=Cc1ccc(cc1)OCC#N 7a_100000189437_100011215382 [0,2,0,0,0,0|1,0,1]=4 10990 B12R1.71 C=Cc1ccc(cc1)OCC=O 34a_100000189437_200009817547 [0,2,0,0,0,0|1,0,1]=4 10991 B12R1.71 C=Cc1ccc(cc1)OCC=O 7a_100000189437_200015260668 [0,2,0,0,0,0|1,0,1]=4 10992 B12R1.71 C=Cc1ccc(cc1)OCCC 271570a_100011290941_100000169948 [0,2,0,0,0,0|1,0,0]=3 10993 B12R1.71 C=Cc1ccc(cc1)OCCC 34a_100000189437_100000210303 [0,2,0,0,0,0|1,0,0]=3 10994 B12R1.71 C=Cc1ccc(cc1)OCCC 7a_100000189437_100000210303 [0,2,0,0,0,0|1,0,0]=3 10995 B12R1.71 C=Cc1ccc(cc1)OCCF 271570a_100011290941_100012347556 [0,2,0,0,0,0|1,0,0]=3 10996 B12R1.71 C=Cc1ccc(cc1)OCCF 34a_100000189437_100011217306 [0,2,0,0,0,0|1,0,0]=3 10997 B12R1.71 C=Cc1ccc(cc1)OCCF 7a_100000189437_100011217306 [0,2,0,0,0,0|1,0,0]=3 10998 B12R1.71 C=Cc1ccc(cc1)OCCN 271570a_100011290941_100000746992 [0,2,0,0,0,0|1,0,0]=3 10999 B12R1.71 C=Cc1ccc(cc1)OCCO 271570a_100011290941_100000686261 [0,2,0,0,0,0|1,0,0]=3 11000 B12R1.71 C=Cc1ccc(cc1)OCCO 34a_100000189437_100000211926 [0,2,0,0,0,0|1,0,0]=3 11001 B12R1.71 C=Cc1ccc(cc1)OCCO 7a_100000189437_100000211926 [0,2,0,0,0,0|1,0,0]=3 11002 B12R1.71 C=Cc1ccc(cc1)OCOC 271570a_100011290941_100012265687 [0,2,0,0,0,0|1,0,0]=3 11003 B12R1.71 C=Cc1ccc(cc1)OCSC 34a_100000189437_100011218213 [0,2,0,0,0,0|1,0,0]=3 11004 B12R1.71 C=Cc1ccc(cc1)SCCC 271570a_100011290941_200009811899 [0,2,0,0,0,0|1,1,0]=4 11005 B12R1.71 C=Cc1ccc(cc1)SCCC 62a_100000210303_100000748128 [0,2,0,0,0,0|1,1,0]=4 11006 B12R1.71 C=Cc1ccc(cc1)SCCC 62a_100000748128_100000210303 [0,2,0,0,0,0|1,1,0]=4 11007 B12R1.71 C=Cc1ccc(cc1)SCCF 62a_100000748128_100011217306 [0,2,0,0,0,0|1,1,0]=4 11008 B12R1.71 C=Cc1ccc(cc1)SCCF 62a_100011217306_100000748128 [0,2,0,0,0,0|1,1,0]=4 11009 B12R1.71 C=Cc1ccc(cc1)SCCN 271570a_100011290941_100000184645 [0,2,0,0,0,0|1,1,0]=4 11010 B12R1.71 C=Cc1ccc(cc1)SCCO 62a_100000211926_100000748128 [0,2,0,0,0,0|1,1,0]=4 11011 B12R1.71 C=Cc1ccc(cc1)SCCO 62a_100000748128_100000211926 [0,2,0,0,0,0|1,1,0]=4 11012 B12R1.71 C=Cc1ccc(cc1)SCOC 62a_100000748128_100000766300 [0,2,0,0,0,0|1,1,0]=4 11013 B12R1.71 C=Cc1ccc(cc1)SCOC 62a_100000766300_100000748128 [0,2,0,0,0,0|1,1,0]=4 11014 B12R1.71 C=Cc1ccc(cc1)SCSC 62a_100000748128_100011218213 [0,2,0,0,0,0|1,1,0]=4 11015 B12R1.71 C=Cc1ccc(cc1)SCSC 62a_100011218213_100000748128 [0,2,0,0,0,0|1,1,0]=4 11016 B12R1.71 C=Cc1ccc(cn1)COCC 271570a_100011290941_100011206209 [0,2,0,0,0,0|2,0,0]=4 11017 B12R1.71 C=Cc1ccc(cn1)OCCC 271570a_100011290941_100000719977 [0,2,0,0,0,0|2,0,0]=4 11018 B12R1.71 C=Cc1ccc(cn1)OCCO 271570a_100011290941_200013150534 [0,2,0,0,0,0|2,0,0]=4 11019 B12R1.71 C=Cc1ccc(cn1)OCOC 271570a_100011290941_100012568617 [0,2,0,0,0,0|2,0,0]=4 11020 B12R1.71 C=Cc1ccc(nc1)OCCC 271570a_100011290941_100011465619 [0,2,0,0,0,0|2,0,0]=4 11021 B12R1.71 CC=NNc1ccc(cc1)OC 4a_100000005221_200000210099 [0,2,0,0,0,0|1,0,1]=4 11022 B12R1.71 CCCCc1ccc(cc1)C#N 271570a_100020621405_100000179745 [0,2,0,0,0,0|2,0,0]=4 11023 B12R1.71 CCCCc1ccc(cc1)C=O 271570a_100020621405_100000186029 [0,2,0,0,0,0|1,0,1]=4 11024 B12R1.71 CCCCc1ccc(cc1)CC 271570a_100020621405_100011215824 [0,2,0,0,0,0|2,0,0]=4 11025 B12R1.71 CCCCc1ccc(cc1)CF 271570a_100020621405_100010268989 [0,2,0,0,0,0|2,0,0]=4 11026 B12R1.71 CCCCc1ccc(cc1)CN 271570a_100020621405_100016989417 [0,2,0,0,0,0|2,0,0]=4 11027 B12R1.71 CCCCc1ccc(cc1)CO 271570a_100020621405_100000690907 [0,2,0,0,0,0|1,0,0]=3 11028 B12R1.71 CCCCc1ccc(cc1)NC 2230a_100000210628_200000210301 [0,2,0,0,0,0|2,0,0]=4 11029 B12R1.71 CCCCc1ccc(cc1)NC 271570a_100020621405_100000219623 [0,2,0,0,0,0|2,0,0]=4 11030 B12R1.71 CCCCc1ccc(cc1)NC 34a_100000210628_200000210301 [0,2,0,0,0,0|2,0,0]=4 11031 B12R1.71 CCCCc1ccc(cc1)NN 271570a_100020621405_100016988836 [0,2,0,0,0,0|2,0,0]=4 11032 B12R1.71 CCCCc1ccc(cc1)N[13CH3] 2230a_100000210628_200025704644 [0,2,0,0,0,0|2,0,0]=4 11033 B12R1.71 CCCCc1ccc(cc1)N[13CH3] 34a_100000210628_200025704644 [0,2,0,0,0,0|2,0,0]=4 11034 B12R1.71 CCCCc1ccc(cc1)OC 271570a_100020621405_100000171711 [0,2,0,0,0,0|1,0,0]=3 11035 B12R1.71 CCCCc1ccc(cc1)OC 34a_100011216022_200000210301 [0,2,0,0,0,0|1,0,0]=3 11036 B12R1.71 CCCCc1ccc(cc1)OC 7a_100011216022_200000210301 [0,2,0,0,0,0|1,0,0]=3 11037 B12R1.71 CCCCc1ccc(cc1)O[13CH3] 34a_100011216022_200025704644 [0,2,0,0,0,0|1,0,0]=3 11038 B12R1.71 CCCCc1ccc(cc1)O[13CH3] 7a_100011216022_200025704644 [0,2,0,0,0,0|1,0,0]=3 11039 B12R1.71 CCCCc1ccc(cc1)SC 271570a_100020621405_100011263217 [0,2,0,0,0,0|1,1,0]=4 11040 B12R1.71 CCCCc1ccc(cc1)SC 62a_100011218101_200000210301 [0,2,0,0,0,0|1,1,0]=4 11041 B12R1.71 CCCCc1ccc(cc1)SC 62a_200000210301_100011218101 [0,2,0,0,0,0|1,1,0]=4 11042 B12R1.71 CCCCc1ccc(cc1)S[13CH3] 62a_100011218101_200025704644 [0,2,0,0,0,0|1,1,0]=4 11043 B12R1.71 CCCCc1ccc(cc1)S[13CH3] 62a_200025704644_100011218101 [0,2,0,0,0,0|1,1,0]=4 11044 B12R1.71 CCCCc1ccc(cn1)CO 271570a_100020621405_100009816760 [0,2,0,0,0,0|2,0,0]=4 11045 B12R1.71 CCCCc1ccc(cn1)OC 271570a_100020621405_100000755202 [0,2,0,0,0,0|2,0,0]=4 11046 B12R1.71 CCCCc1ccc(nc1)CO 271570a_100020621405_100000754261 [0,2,0,0,0,0|2,0,0]=4 11047 B12R1.71 CCCCc1ccc(nc1)OC 271570a_100020621405_100000047065 [0,2,0,0,0,0|2,0,0]=4 11048 B12R1.71 CCCNc1ccc(cc1)C#N 34a_100000185469_100000210303 [0,2,0,0,0,0|2,0,0]=4 11049 B12R1.71 CCCNc1ccc(cc1)CC 2230a_100000211069_100000210303 [0,2,0,0,0,0|2,0,0]=4 11050 B12R1.71 CCCNc1ccc(cc1)CC 34a_100000211069_100000210303 [0,2,0,0,0,0|2,0,0]=4 11051 B12R1.71 CCCNc1ccc(cc1)CO 2230a_100011215238_100000210303 [0,2,0,0,0,0|1,0,0]=3 11052 B12R1.71 CCCNc1ccc(cc1)CO 34a_100011215238_100000210303 [0,2,0,0,0,0|1,0,0]=3 11053 B12R1.71 CCCNc1ccc(cc1)OC 34a_100000184247_100000210303 [0,2,0,0,0,0|1,0,0]=3 11054 B12R1.71 CCCNc1ccc(cc1)SC 34a_100000212337_100000210303 [0,2,0,0,0,0|1,1,0]=4 11055 B12R1.71 CCCOc1ccc(cc1)C#N 34a_100000210344_100000210303 [0,2,0,0,0,0|1,0,0]=3 11056 B12R1.71 CCCOc1ccc(cc1)C#N 7a_100000210344_100000210303 [0,2,0,0,0,0|1,0,0]=3 11057 B12R1.71 CCCOc1ccc(cc1)CC 34a_100000211359_100000210303 [0,2,0,0,0,0|1,0,0]=3 11058 B12R1.71 CCCOc1ccc(cc1)CC 7a_100000211359_100000210303 [0,2,0,0,0,0|1,0,0]=3 11059 B12R1.71 CCCOc1ccc(cc1)CN 34a_100000185549_100000210303 [0,2,0,0,0,0|1,0,0]=3 11060 B12R1.71 CCCOc1ccc(cc1)CO 34a_100000211755_100000210303 [0,2,0,0,0,0|0,0,0]=2 11061 B12R1.71 CCCOc1ccc(cc1)NC 34a_100000182112_100000210303 [0,2,0,0,0,0|1,0,0]=3 11062 B12R1.71 CCCOc1ccc(cc1)NC 34a_100000748631_200000210301 [0,2,0,0,0,0|1,0,0]=3 11063 B12R1.71 CCCOc1ccc(cc1)N[13CH3] 34a_100000748631_200025704644 [0,2,0,0,0,0|1,0,0]=3 11064 B12R1.71 CCCOc1ccc(cc1)OC 34a_100000185468_200000210301 [0,2,0,0,0,0|0,0,0]=2 11065 B12R1.71 CCCOc1ccc(cc1)OC 34a_100000210503_100000210303 [0,2,0,0,0,0|0,0,0]=2 11066 B12R1.71 CCCOc1ccc(cc1)OC 7a_100000185468_200000210301 [0,2,0,0,0,0|0,0,0]=2 11067 B12R1.71 CCCOc1ccc(cc1)O[13CH3] 34a_100000185468_200025704644 [0,2,0,0,0,0|0,0,0]=2 11068 B12R1.71 CCCOc1ccc(cc1)O[13CH3] 7a_100000185468_200025704644 [0,2,0,0,0,0|0,0,0]=2 11069 B12R1.71 CCCOc1ccc(cc1)SC 34a_100000211864_100000210303 [0,2,0,0,0,0|0,1,0]=3 11070 B12R1.71 CCCOc1ccc(cc1)SC 62a_100000169948_200000210301 [0,2,0,0,0,0|0,1,0]=3 11071 B12R1.71 CCCOc1ccc(cc1)SC 62a_200000210301_100000169948 [0,2,0,0,0,0|0,1,0]=3 11072 B12R1.71 CCCOc1ccc(cc1)S[13CH3] 62a_100000169948_200025704644 [0,2,0,0,0,0|0,1,0]=3 11073 B12R1.71 CCCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000169948 [0,2,0,0,0,0|0,1,0]=3 11074 B12R1.71 CCCOc1ccc(cn1)CN 34a_100000757128_100000210303 [0,2,0,0,0,0|2,0,0]=4 11075 B12R1.71 CCCOc1ccc(cn1)OC 34a_100012002028_100000210303 [0,2,0,0,0,0|1,0,0]=3 11076 B12R1.71 CCCOc1ccc(cn1)SC 62a_100011465619_200000210301 [0,2,0,0,0,0|1,1,0]=4 11077 B12R1.71 CCCOc1ccc(cn1)SC 62a_200000210301_100011465619 [0,2,0,0,0,0|1,1,0]=4 11078 B12R1.71 CCCOc1ccc(cn1)S[13CH3] 62a_100011465619_200025704644 [0,2,0,0,0,0|1,1,0]=4 11079 B12R1.71 CCCOc1ccc(cn1)S[13CH3] 62a_200025704644_100011465619 [0,2,0,0,0,0|1,1,0]=4 11080 B12R1.71 CCCOc1ccc(nc1)C#N 34a_100011934750_100000210303 [0,2,0,0,0,0|2,0,0]=4 11081 B12R1.71 CCCOc1ccc(nc1)C#N 7a_100011934750_100000210303 [0,2,0,0,0,0|2,0,0]=4 11082 B12R1.71 CCCOc1ccc(nc1)CN 34a_100020605196_100000210303 [0,2,0,0,0,0|2,0,0]=4 11083 B12R1.71 CCCOc1ccc(nc1)CO 34a_103436540053_100000210303 [0,2,0,0,0,0|1,0,0]=3 11084 B12R1.71 CCCOc1ccc(nc1)OC 34a_100011934560_100000210303 [0,2,0,0,0,0|1,0,0]=3 11085 B12R1.71 CCCOc1ccc(nc1)SC 62a_100000719977_200000210301 [0,2,0,0,0,0|1,1,0]=4 11086 B12R1.71 CCCOc1ccc(nc1)SC 62a_200000210301_100000719977 [0,2,0,0,0,0|1,1,0]=4 11087 B12R1.71 CCCOc1ccc(nc1)S[13CH3] 62a_100000719977_200025704644 [0,2,0,0,0,0|1,1,0]=4 11088 B12R1.71 CCCOc1ccc(nc1)S[13CH3] 62a_200025704644_100000719977 [0,2,0,0,0,0|1,1,0]=4 11089 B12R1.71 CCCOc1cnc(nc1)OC 34a_100000099601_100000210303 [0,2,0,0,0,0|2,0,0]=4 11090 B12R1.71 CCCOc1cnc(nc1)OC 7a_100000099601_100000210303 [0,2,0,0,0,0|2,0,0]=4 11091 B12R1.71 CCCSc1ccc(cc1)C#N 62a_100000210303_100000184291 [0,2,0,0,0,0|1,1,0]=4 11092 B12R1.71 CCCSc1ccc(cc1)C=O 62a_100000188517_100000210303 [0,2,0,0,0,0|0,1,1]=4 11093 B12R1.71 CCCSc1ccc(cc1)C=O 62a_100000210303_100000188517 [0,2,0,0,0,0|0,1,1]=4 11094 B12R1.71 CCCSc1ccc(cc1)CC 62a_100000210303_100011215824 [0,2,0,0,0,0|1,1,0]=4 11095 B12R1.71 CCCSc1ccc(cc1)CC 62a_100011215824_100000210303 [0,2,0,0,0,0|1,1,0]=4 11096 B12R1.71 CCCSc1ccc(cc1)CF 62a_100000210303_100010268989 [0,2,0,0,0,0|1,1,0]=4 11097 B12R1.71 CCCSc1ccc(cc1)CF 62a_100010268989_100000210303 [0,2,0,0,0,0|1,1,0]=4 11098 B12R1.71 CCCSc1ccc(cc1)CN 62a_100000210303_100016989417 [0,2,0,0,0,0|1,1,0]=4 11099 B12R1.71 CCCSc1ccc(cc1)CN 62a_100016989417_100000210303 [0,2,0,0,0,0|1,1,0]=4 11100 B12R1.71 CCCSc1ccc(cc1)CO 62a_100000210303_100000690907 [0,2,0,0,0,0|0,1,0]=3 11101 B12R1.71 CCCSc1ccc(cc1)CO 62a_100000690907_100000210303 [0,2,0,0,0,0|0,1,0]=3 11102 B12R1.71 CCCSc1ccc(cc1)NC 34a_100015183887_200000210301 [0,2,0,0,0,0|1,1,0]=4 11103 B12R1.71 CCCSc1ccc(cc1)NC 62a_100000210303_100000743151 [0,2,0,0,0,0|1,1,0]=4 11104 B12R1.71 CCCSc1ccc(cc1)NC 62a_100000743151_100000210303 [0,2,0,0,0,0|1,1,0]=4 11105 B12R1.71 CCCSc1ccc(cc1)NC 7a_100015183887_200000210301 [0,2,0,0,0,0|1,1,0]=4 11106 B12R1.71 CCCSc1ccc(cc1)NN 62a_100000210303_100016988836 [0,2,0,0,0,0|1,1,0]=4 11107 B12R1.71 CCCSc1ccc(cc1)NN 62a_100016988836_100000210303 [0,2,0,0,0,0|1,1,0]=4 11108 B12R1.71 CCCSc1ccc(cc1)N[13CH3] 34a_100015183887_200025704644 [0,2,0,0,0,0|1,1,0]=4 11109 B12R1.71 CCCSc1ccc(cc1)N[13CH3] 7a_100015183887_200025704644 [0,2,0,0,0,0|1,1,0]=4 11110 B12R1.71 CCCSc1ccc(cc1)OC 62a_100000210303_100000171711 [0,2,0,0,0,0|0,1,0]=3 11111 B12R1.71 CCCSc1ccc(cc1)SC 62a_100000210303_100011263217 [0,2,0,0,0,0|0,2,0]=4 11112 B12R1.71 CCCSc1ccc(cc1)SC 62a_100011263217_100000210303 [0,2,0,0,0,0|0,2,0]=4 11113 B12R1.71 CCCSc1ccc(cc1)SC 62a_200000210301_200009811899 [0,2,0,0,0,0|0,2,0]=4 11114 B12R1.71 CCCSc1ccc(cc1)SC 62a_200009811899_200000210301 [0,2,0,0,0,0|0,2,0]=4 11115 B12R1.71 CCCSc1ccc(cc1)S[13CH3] 62a_200009811899_200025704644 [0,2,0,0,0,0|0,2,0]=4 11116 B12R1.71 CCCSc1ccc(cc1)S[13CH3] 62a_200025704644_200009811899 [0,2,0,0,0,0|0,2,0]=4 11117 B12R1.71 CCCSc1ccc(cn1)CO 62a_100000210303_100009816760 [0,2,0,0,0,0|1,1,0]=4 11118 B12R1.71 CCCSc1ccc(cn1)CO 62a_100009816760_100000210303 [0,2,0,0,0,0|1,1,0]=4 11119 B12R1.71 CCCSc1ccc(cn1)OC 62a_100000210303_100000744180 [0,2,0,0,0,0|1,1,0]=4 11120 B12R1.71 CCCSc1ccc(cn1)OC 62a_100000755202_100000210303 [0,2,0,0,0,0|1,1,0]=4 11121 B12R1.71 CCCSc1ccc(nc1)CO 62a_100000210303_100000754261 [0,2,0,0,0,0|1,1,0]=4 11122 B12R1.71 CCCSc1ccc(nc1)CO 62a_100000754261_100000210303 [0,2,0,0,0,0|1,1,0]=4 11123 B12R1.71 CCCSc1ccc(nc1)OC 62a_100000047065_100000210303 [0,2,0,0,0,0|1,1,0]=4 11124 B12R1.71 CCCSc1ccc(nc1)OC 62a_100000210303_100000047065 [0,2,0,0,0,0|1,1,0]=4 11125 B12R1.71 CCNCc1ccc(cc1)C#N 207a_100015525214_100000211122 [0,2,0,0,0,0|2,0,0]=4 11126 B12R1.71 CCNCc1ccc(cc1)C#N 2230a_100015525214_100000184898 [0,2,0,0,0,0|2,0,0]=4 11127 B12R1.71 CCNCc1ccc(cc1)C#N 270004a_100015525214_100000211122 [0,2,0,0,0,0|2,0,0]=4 11128 B12R1.71 CCNCc1ccc(cc1)C#N 34a_100015207190_100000210202 [0,2,0,0,0,0|2,0,0]=4 11129 B12R1.71 CCNCc1ccc(cc1)C=O 2230a_100015525214_100009816848 [0,2,0,0,0,0|1,0,1]=4 11130 B12R1.71 CCNCc1ccc(cc1)CC 207a_100015525214_100000211036 [0,2,0,0,0,0|2,0,0]=4 11131 B12R1.71 CCNCc1ccc(cc1)CC 2230a_100000721222_100000210202 [0,2,0,0,0,0|2,0,0]=4 11132 B12R1.71 CCNCc1ccc(cc1)CC 2230a_100015525214_100000747183 [0,2,0,0,0,0|2,0,0]=4 11133 B12R1.71 CCNCc1ccc(cc1)CC 270004a_100015525214_100000211036 [0,2,0,0,0,0|2,0,0]=4 11134 B12R1.71 CCNCc1ccc(cc1)CC 34a_100000721222_100000210202 [0,2,0,0,0,0|2,0,0]=4 11135 B12R1.71 CCNCc1ccc(cc1)CO 207a_100015525214_100009832023 [0,2,0,0,0,0|1,0,0]=3 11136 B12R1.71 CCNCc1ccc(cc1)CO 2230a_100015189231_100000210202 [0,2,0,0,0,0|1,0,0]=3 11137 B12R1.71 CCNCc1ccc(cc1)CO 2230a_100015525214_100000067286 [0,2,0,0,0,0|1,0,0]=3 11138 B12R1.71 CCNCc1ccc(cc1)CO 270004a_100015525214_100009832023 [0,2,0,0,0,0|1,0,0]=3 11139 B12R1.71 CCNCc1ccc(cc1)CO 34a_100015189231_100000210202 [0,2,0,0,0,0|1,0,0]=3 11140 B12R1.71 CCNCc1ccc(cc1)OC 207a_100015525214_100000169835 [0,2,0,0,0,0|1,0,0]=3 11141 B12R1.71 CCNCc1ccc(cc1)OC 2230a_100015525214_100000742318 [0,2,0,0,0,0|1,0,0]=3 11142 B12R1.71 CCNCc1ccc(cc1)OC 270004a_100015525214_100000169835 [0,2,0,0,0,0|1,0,0]=3 11143 B12R1.71 CCNCc1ccc(cc1)OC 34a_100000185587_100000210202 [0,2,0,0,0,0|1,0,0]=3 11144 B12R1.71 CCNCc1ccc(cc1)OC 34a_100000748449_200000210301 [0,2,0,0,0,0|1,0,0]=3 11145 B12R1.71 CCNCc1ccc(cc1)O[13CH3] 34a_100000748449_200025704644 [0,2,0,0,0,0|1,0,0]=3 11146 B12R1.71 CCNCc1ccc(cc1)SC 207a_100015525214_100000211154 [0,2,0,0,0,0|1,1,0]=4 11147 B12R1.71 CCNCc1ccc(cc1)SC 2230a_100000174980_100000210202 [0,2,0,0,0,0|1,1,0]=4 11148 B12R1.71 CCNCc1ccc(cc1)SC 2230a_100015525214_100000181263 [0,2,0,0,0,0|1,1,0]=4 11149 B12R1.71 CCNCc1ccc(cc1)SC 270004a_100015525214_100000211154 [0,2,0,0,0,0|1,1,0]=4 11150 B12R1.71 CCNCc1ccc(cc1)SC 34a_100000174980_100000210202 [0,2,0,0,0,0|1,1,0]=4 11151 B12R1.71 CCNCc1ccc(cc1)SC 62a_100000187385_200000210301 [0,2,0,0,0,0|1,1,0]=4 11152 B12R1.71 CCNCc1ccc(cc1)SC 62a_200000210301_100000187385 [0,2,0,0,0,0|1,1,0]=4 11153 B12R1.71 CCNCc1ccc(cc1)S[13CH3] 62a_100000187385_200025704644 [0,2,0,0,0,0|1,1,0]=4 11154 B12R1.71 CCNCc1ccc(cc1)S[13CH3] 62a_200025704644_100000187385 [0,2,0,0,0,0|1,1,0]=4 11155 B12R1.71 CCNCc1ccc(cn1)OC 207a_100015525214_100000701244 [0,2,0,0,0,0|2,0,0]=4 11156 B12R1.71 CCNCc1ccc(cn1)OC 2230a_100015525214_200000757186 [0,2,0,0,0,0|2,0,0]=4 11157 B12R1.71 CCNCc1ccc(cn1)OC 270004a_100015525214_100000701244 [0,2,0,0,0,0|2,0,0]=4 11158 B12R1.71 CCNCc1ccc(cn1)OC 34a_100000703904_100000210202 [0,2,0,0,0,0|2,0,0]=4 11159 B12R1.71 CCNCc1ccc(nc1)OC 207a_100015525214_100000761633 [0,2,0,0,0,0|2,0,0]=4 11160 B12R1.71 CCNCc1ccc(nc1)OC 2230a_100000241975_100000210202 [0,2,0,0,0,0|2,0,0]=4 11161 B12R1.71 CCNCc1ccc(nc1)OC 2230a_100015525214_100020631284 [0,2,0,0,0,0|2,0,0]=4 11162 B12R1.71 CCNCc1ccc(nc1)OC 270004a_100015525214_100000761633 [0,2,0,0,0,0|2,0,0]=4 11163 B12R1.71 CCNN=C1C=CC(=NCl)C=C1 4a_100000756455_100000088476 [0,2,0,0,0,0|2,0,0]=4 11164 B12R1.71 CCNN=C1C=CC(=NO)C=C1 4a_100000756455_200000095120 [0,2,0,0,0,0|1,0,0]=3 11165 B12R1.71 CCOCc1ccc(cc1)C#N 34a_100000238739_100000210202 [0,2,0,0,0,0|1,0,0]=3 11166 B12R1.71 CCOCc1ccc(cc1)C#N 34a_100121572206_100000184898 [0,2,0,0,0,0|1,0,0]=3 11167 B12R1.71 CCOCc1ccc(cc1)C#N 7a_100000238739_100000210202 [0,2,0,0,0,0|1,0,0]=3 11168 B12R1.71 CCOCc1ccc(cc1)C=O 34a_100121572206_100009816848 [0,2,0,0,0,0|0,0,1]=3 11169 B12R1.71 CCOCc1ccc(cc1)CBr 34a_100012353999_100000210202 [0,2,0,0,0,0|1,0,0]=3 11170 B12R1.71 CCOCc1ccc(cc1)CBr 7a_100012353999_100000210202 [0,2,0,0,0,0|1,0,0]=3 11171 B12R1.71 CCOCc1ccc(cc1)CC 34a_100000702245_100000210202 [0,2,0,0,0,0|1,0,0]=3 11172 B12R1.71 CCOCc1ccc(cc1)CC 34a_100121572206_100000747183 [0,2,0,0,0,0|1,0,0]=3 11173 B12R1.71 CCOCc1ccc(cc1)CC 7a_100000702245_100000210202 [0,2,0,0,0,0|1,0,0]=3 11174 B12R1.71 CCOCc1ccc(cc1)CCl 34a_100000067286_100000210202 [0,2,0,0,0,0|1,0,0]=3 11175 B12R1.71 CCOCc1ccc(cc1)CCl 7a_100000067286_100000210202 [0,2,0,0,0,0|1,0,0]=3 11176 B12R1.71 CCOCc1ccc(cc1)CN 34a_100015189231_100000210202 [0,2,0,0,0,0|1,0,0]=3 11177 B12R1.71 CCOCc1ccc(cc1)CO 34a_100121572206_100000067286 [0,2,0,0,0,0|0,0,0]=2 11178 B12R1.71 CCOCc1ccc(cc1)OC 34a_100000173359_100000210202 [0,2,0,0,0,0|0,0,0]=2 11179 B12R1.71 CCOCc1ccc(cc1)OC 34a_100121572206_100000742318 [0,2,0,0,0,0|0,0,0]=2 11180 B12R1.71 CCOCc1ccc(cc1)SC 34a_100011215404_100000210202 [0,2,0,0,0,0|0,1,0]=3 11181 B12R1.71 CCOCc1ccc(cc1)SC 34a_100121572206_100000181263 [0,2,0,0,0,0|0,1,0]=3 11182 B12R1.71 CCOCc1ccc(cc1)SC 62a_100000758564_200000210301 [0,2,0,0,0,0|0,1,0]=3 11183 B12R1.71 CCOCc1ccc(cc1)SC 62a_200000210301_100000758564 [0,2,0,0,0,0|0,1,0]=3 11184 B12R1.71 CCOCc1ccc(cc1)SC 7a_100011215404_100000210202 [0,2,0,0,0,0|0,1,0]=3 11185 B12R1.71 CCOCc1ccc(cc1)S[13CH3] 62a_100000758564_200025704644 [0,2,0,0,0,0|0,1,0]=3 11186 B12R1.71 CCOCc1ccc(cc1)S[13CH3] 62a_200025704644_100000758564 [0,2,0,0,0,0|0,1,0]=3 11187 B12R1.71 CCOCc1ccc(cn1)C#N 34a_100000101912_100000210202 [0,2,0,0,0,0|2,0,0]=4 11188 B12R1.71 CCOCc1ccc(cn1)C#N 34a_100121572206_100000693164 [0,2,0,0,0,0|2,0,0]=4 11189 B12R1.71 CCOCc1ccc(cn1)CC 34a_100000068455_100000210202 [0,2,0,0,0,0|2,0,0]=4 11190 B12R1.71 CCOCc1ccc(cn1)OC 34a_100011998694_100000210202 [0,2,0,0,0,0|1,0,0]=3 11191 B12R1.71 CCOCc1ccc(cn1)OC 34a_100121572206_200000757186 [0,2,0,0,0,0|1,0,0]=3 11192 B12R1.71 CCOCc1ccc(nc1)C#N 34a_100000090650_100000210202 [0,2,0,0,0,0|2,0,0]=4 11193 B12R1.71 CCOCc1ccc(nc1)C#N 34a_100121572206_100009816919 [0,2,0,0,0,0|2,0,0]=4 11194 B12R1.71 CCOCc1ccc(nc1)C#N 7a_100000090650_100000210202 [0,2,0,0,0,0|2,0,0]=4 11195 B12R1.71 CCOCc1ccc(nc1)OC 34a_100000763316_100000210202 [0,2,0,0,0,0|1,0,0]=3 11196 B12R1.71 CCOCc1ccc(nc1)OC 34a_100121572206_100020631284 [0,2,0,0,0,0|1,0,0]=3 11197 B12R1.71 CCOCc1ccc(nc1)SC 62a_100011206209_200000210301 [0,2,0,0,0,0|1,1,0]=4 11198 B12R1.71 CCOCc1ccc(nc1)SC 62a_200000210301_100011206209 [0,2,0,0,0,0|1,1,0]=4 11199 B12R1.71 CCOCc1ccc(nc1)S[13CH3] 62a_100011206209_200025704644 [0,2,0,0,0,0|1,1,0]=4 11200 B12R1.71 CCOCc1ccc(nc1)S[13CH3] 62a_200025704644_100011206209 [0,2,0,0,0,0|1,1,0]=4 11201 B12R1.71 CCSCc1ccc(cc1)C#N 62a_100000210202_100000184898 [0,2,0,0,0,0|1,1,0]=4 11202 B12R1.71 CCSCc1ccc(cc1)C=O 62a_100000210202_100009816848 [0,2,0,0,0,0|0,1,1]=4 11203 B12R1.71 CCSCc1ccc(cc1)C=O 62a_100009816848_100000210202 [0,2,0,0,0,0|0,1,1]=4 11204 B12R1.71 CCSCc1ccc(cc1)CC 62a_100000210202_100000747183 [0,2,0,0,0,0|1,1,0]=4 11205 B12R1.71 CCSCc1ccc(cc1)CC 62a_100000757233_100000210202 [0,2,0,0,0,0|1,1,0]=4 11206 B12R1.71 CCSCc1ccc(cc1)CO 62a_100000067286_100000210202 [0,2,0,0,0,0|0,1,0]=3 11207 B12R1.71 CCSCc1ccc(cc1)CO 62a_100000210202_100000067286 [0,2,0,0,0,0|0,1,0]=3 11208 B12R1.71 CCSCc1ccc(cc1)OC 62a_100000210202_100000742318 [0,2,0,0,0,0|0,1,0]=3 11209 B12R1.71 CCSCc1ccc(cc1)SC 62a_100000181263_100000210202 [0,2,0,0,0,0|0,2,0]=4 11210 B12R1.71 CCSCc1ccc(cc1)SC 62a_100000210202_100000181263 [0,2,0,0,0,0|0,2,0]=4 11211 B12R1.71 CCSCc1ccc(cn1)OC 62a_100000210202_200000757186 [0,2,0,0,0,0|1,1,0]=4 11212 B12R1.71 CCSCc1ccc(cn1)OC 62a_200000757186_100000210202 [0,2,0,0,0,0|1,1,0]=4 11213 B12R1.71 CCSCc1ccc(nc1)OC 62a_100000210202_100020631284 [0,2,0,0,0,0|1,1,0]=4 11214 B12R1.71 CCSCc1ccc(nc1)OC 62a_100020631284_100000210202 [0,2,0,0,0,0|1,1,0]=4 11215 B12R1.71 CCc1ccc(cc1)CCNC 2230a_100025712186_200000210301 [0,2,0,0,0,0|2,0,0]=4 11216 B12R1.71 CCc1ccc(cc1)CCNC 34a_100025712186_200000210301 [0,2,0,0,0,0|2,0,0]=4 11217 B12R1.71 CCc1ccc(cc1)CCN[13CH3] 2230a_100025712186_200025704644 [0,2,0,0,0,0|2,0,0]=4 11218 B12R1.71 CCc1ccc(cc1)CCN[13CH3] 34a_100025712186_200025704644 [0,2,0,0,0,0|2,0,0]=4 11219 B12R1.71 CCc1ccc(cc1)COCF 34a_100000702245_100015361967 [0,2,0,0,0,0|2,0,0]=4 11220 B12R1.71 CCc1ccc(cc1)COCF 7a_100000702245_100015361967 [0,2,0,0,0,0|2,0,0]=4 11221 B12R1.71 CCc1ccc(cc1)NCCF 2230a_100000211069_100011217306 [0,2,0,0,0,0|2,0,0]=4 11222 B12R1.71 CCc1ccc(cc1)NCCF 34a_100000211069_100011217306 [0,2,0,0,0,0|2,0,0]=4 11223 B12R1.71 CCc1ccc(cc1)NCCO 2230a_100000211069_100000211926 [0,2,0,0,0,0|2,0,0]=4 11224 B12R1.71 CCc1ccc(cc1)NCCO 34a_100000211069_100000211926 [0,2,0,0,0,0|2,0,0]=4 11225 B12R1.71 CCc1ccc(cc1)NCOC 2230a_100000211069_100000766300 [0,2,0,0,0,0|2,0,0]=4 11226 B12R1.71 CCc1ccc(cc1)NCSC 2230a_100000211069_100011218213 [0,2,0,0,0,0|2,0,0]=4 11227 B12R1.71 CCc1ccc(cc1)NCSC 34a_100000211069_100011218213 [0,2,0,0,0,0|2,0,0]=4 11228 B12R1.71 CCc1ccc(cc1)OCC#N 7a_100000211359_100011215382 [0,2,0,0,0,0|1,0,1]=4 11229 B12R1.71 CCc1ccc(cc1)OCC=O 34a_100000211359_200009817547 [0,2,0,0,0,0|1,0,1]=4 11230 B12R1.71 CCc1ccc(cc1)OCC=O 7a_100000211359_200015260668 [0,2,0,0,0,0|1,0,1]=4 11231 B12R1.71 CCc1ccc(cc1)OCCF 34a_100000211359_100011217306 [0,2,0,0,0,0|1,0,0]=3 11232 B12R1.71 CCc1ccc(cc1)OCCF 7a_100000211359_100011217306 [0,2,0,0,0,0|1,0,0]=3 11233 B12R1.71 CCc1ccc(cc1)OCCO 34a_100000211359_100000211926 [0,2,0,0,0,0|1,0,0]=3 11234 B12R1.71 CCc1ccc(cc1)OCCO 7a_100000211359_100000211926 [0,2,0,0,0,0|1,0,0]=3 11235 B12R1.71 CCc1ccc(cc1)OCSC 34a_100000211359_100011218213 [0,2,0,0,0,0|1,0,0]=3 11236 B12R1.71 CCc1ccc(cc1)SCCF 62a_100011215824_100011217306 [0,2,0,0,0,0|1,1,0]=4 11237 B12R1.71 CCc1ccc(cc1)SCCF 62a_100011217306_100011215824 [0,2,0,0,0,0|1,1,0]=4 11238 B12R1.71 CCc1ccc(cc1)SCCO 62a_100000211926_100011215824 [0,2,0,0,0,0|1,1,0]=4 11239 B12R1.71 CCc1ccc(cc1)SCCO 62a_100011215824_100000211926 [0,2,0,0,0,0|1,1,0]=4 11240 B12R1.71 CCc1ccc(cc1)SCOC 62a_100000766300_100011215824 [0,2,0,0,0,0|1,1,0]=4 11241 B12R1.71 CCc1ccc(cc1)SCOC 62a_100011215824_100000766300 [0,2,0,0,0,0|1,1,0]=4 11242 B12R1.71 CCc1ccc(cc1)SCSC 62a_100011215824_100011218213 [0,2,0,0,0,0|1,1,0]=4 11243 B12R1.71 CCc1ccc(cc1)SCSC 62a_100011218213_100011215824 [0,2,0,0,0,0|1,1,0]=4 11244 B12R1.71 CNCCc1ccc(cc1)C#N 2230a_100015189369_200000210301 [0,2,0,0,0,0|2,0,0]=4 11245 B12R1.71 CNCCc1ccc(cc1)C#N 2230a_106832991635_100012161189 [0,2,0,0,0,0|2,0,0]=4 11246 B12R1.71 CNCCc1ccc(cc1)C#N 34a_100015189369_200000210301 [0,2,0,0,0,0|2,0,0]=4 11247 B12R1.71 CNCCc1ccc(cc1)C#N 34a_100102657272_100012161189 [0,2,0,0,0,0|2,0,0]=4 11248 B12R1.71 CNCCc1ccc(cc1)C#N 7a_106832991635_100012161189 [0,2,0,0,0,0|2,0,0]=4 11249 B12R1.71 CNCCc1ccc(cc1)OC 2230a_100000210796_200000210301 [0,2,0,0,0,0|1,0,0]=3 11250 B12R1.71 CNCCc1ccc(cc1)OC 2230a_106832991635_100011713689 [0,2,0,0,0,0|1,0,0]=3 11251 B12R1.71 CNCCc1ccc(cc1)OC 270004a_106832991635_100011242372 [0,2,0,0,0,0|1,0,0]=3 11252 B12R1.71 CNCCc1ccc(cc1)OC 34a_100000210796_200000210301 [0,2,0,0,0,0|1,0,0]=3 11253 B12R1.71 CNCCc1ccc(cc1)OC 34a_100016989440_200000210301 [0,2,0,0,0,0|1,0,0]=3 11254 B12R1.71 CNCCc1ccc(cc1)OC 34a_100102657272_100000184700 [0,2,0,0,0,0|1,0,0]=3 11255 B12R1.71 CNCCc1ccc(cc1)OC 7a_106832991635_100000184700 [0,2,0,0,0,0|1,0,0]=3 11256 B12R1.71 CNCCc1ccc(cc1)O[13CH3] 34a_100016989440_200025704644 [0,2,0,0,0,0|1,0,0]=3 11257 B12R1.71 CNCCc1ccc(cc1)SC 62a_100000752880_200000210301 [0,2,0,0,0,0|1,1,0]=4 11258 B12R1.71 CNCCc1ccc(cc1)SC 62a_200000210301_100000752880 [0,2,0,0,0,0|1,1,0]=4 11259 B12R1.71 CNCCc1ccc(cc1)S[13CH3] 62a_100000752880_200025704644 [0,2,0,0,0,0|1,1,0]=4 11260 B12R1.71 CNCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000752880 [0,2,0,0,0,0|1,1,0]=4 11261 B12R1.71 CNCCc1ccc(nc1)OC 2230a_100011998949_200000210301 [0,2,0,0,0,0|2,0,0]=4 11262 B12R1.71 CNCCc1ccc(nc1)OC 34a_100011998949_200000210301 [0,2,0,0,0,0|2,0,0]=4 11263 B12R1.71 CNc1ccc(cc1)CCSC 2230a_100000750819_200000210301 [0,2,0,0,0,0|2,0,0]=4 11264 B12R1.71 CNc1ccc(cc1)CCSC 34a_100000750819_200000210301 [0,2,0,0,0,0|2,0,0]=4 11265 B12R1.71 CNc1ccc(cc1)CCSC 7a_100000750819_200000210301 [0,2,0,0,0,0|2,0,0]=4 11266 B12R1.71 CNc1ccc(cc1)OCC=O 34a_100000182112_200009817547 [0,2,0,0,0,0|1,0,1]=4 11267 B12R1.71 CNc1ccc(cc1)OCCF 34a_100000182112_100011217306 [0,2,0,0,0,0|1,0,0]=3 11268 B12R1.71 CNc1ccc(cc1)OCCF 34a_100012282086_200000210301 [0,2,0,0,0,0|1,0,0]=3 11269 B12R1.71 CNc1ccc(cc1)OCCO 2230a_100000754363_200000210301 [0,2,0,0,0,0|1,0,0]=3 11270 B12R1.71 CNc1ccc(cc1)OCCO 34a_100000182112_100000211926 [0,2,0,0,0,0|1,0,0]=3 11271 B12R1.71 CNc1ccc(cc1)OCCO 34a_100000754363_200000210301 [0,2,0,0,0,0|1,0,0]=3 11272 B12R1.71 CNc1ccc(cc1)OCSC 34a_100000182112_100011218213 [0,2,0,0,0,0|1,0,0]=3 11273 B12R1.71 CNc1ccc(cc1)SCCF 62a_100000743151_100011217306 [0,2,0,0,0,0|1,1,0]=4 11274 B12R1.71 CNc1ccc(cc1)SCCF 62a_100011217306_100000743151 [0,2,0,0,0,0|1,1,0]=4 11275 B12R1.71 CNc1ccc(cc1)SCCO 62a_100000211926_100000743151 [0,2,0,0,0,0|1,1,0]=4 11276 B12R1.71 CNc1ccc(cc1)SCCO 62a_100000743151_100000211926 [0,2,0,0,0,0|1,1,0]=4 11277 B12R1.71 CNc1ccc(cc1)SCOC 62a_100000743151_100000766300 [0,2,0,0,0,0|1,1,0]=4 11278 B12R1.71 CNc1ccc(cc1)SCOC 62a_100000766300_100000743151 [0,2,0,0,0,0|1,1,0]=4 11279 B12R1.71 CNc1ccc(cc1)SCSC 62a_100000743151_100011218213 [0,2,0,0,0,0|1,1,0]=4 11280 B12R1.71 CNc1ccc(cc1)SCSC 62a_100011218213_100000743151 [0,2,0,0,0,0|1,1,0]=4 11281 B12R1.71 COCCc1ccc(cc1)C#N 34a_100011219507_200000210301 [0,2,0,0,0,0|2,0,0]=4 11282 B12R1.71 COCCc1ccc(cc1)C#N 34a_100138415774_100012161189 [0,2,0,0,0,0|2,0,0]=4 11283 B12R1.71 COCCc1ccc(cc1)C#N 7a_100011219507_200000210301 [0,2,0,0,0,0|2,0,0]=4 11284 B12R1.71 COCCc1ccc(cc1)OC 34a_100000211638_200000210301 [0,2,0,0,0,0|1,0,0]=3 11285 B12R1.71 COCCc1ccc(cc1)OC 34a_100011219623_200000210301 [0,2,0,0,0,0|1,0,0]=3 11286 B12R1.71 COCCc1ccc(cc1)OC 34a_100138415774_100000184700 [0,2,0,0,0,0|1,0,0]=3 11287 B12R1.71 COCCc1ccc(cc1)OC 7a_100000211638_200000210301 [0,2,0,0,0,0|1,0,0]=3 11288 B12R1.71 COCCc1ccc(cc1)OC 7a_100011219623_200000210301 [0,2,0,0,0,0|1,0,0]=3 11289 B12R1.71 COCCc1ccc(cc1)O[13CH3] 34a_100000211638_200025704644 [0,2,0,0,0,0|1,0,0]=3 11290 B12R1.71 COCCc1ccc(cc1)O[13CH3] 7a_100000211638_200025704644 [0,2,0,0,0,0|1,0,0]=3 11291 B12R1.71 COCCc1ccc(cc1)SC 62a_100000739703_200000210301 [0,2,0,0,0,0|1,1,0]=4 11292 B12R1.71 COCCc1ccc(cc1)SC 62a_200000210301_100000739703 [0,2,0,0,0,0|1,1,0]=4 11293 B12R1.71 COCCc1ccc(cc1)S[13CH3] 62a_100000739703_200025704644 [0,2,0,0,0,0|1,1,0]=4 11294 B12R1.71 COCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000739703 [0,2,0,0,0,0|1,1,0]=4 11295 B12R1.71 COCNc1ccc(cc1)CO 2230a_100011215238_100000766300 [0,2,0,0,0,0|1,0,0]=3 11296 B12R1.71 COCOc1ccc(cc1)OC 34a_200012265912_200000210301 [0,2,0,0,0,0|0,0,0]=2 11297 B12R1.71 COCOc1ccc(cc1)O[13CH3] 34a_200012265912_200025704644 [0,2,0,0,0,0|0,0,0]=2 11298 B12R1.71 COCOc1ccc(cc1)SC 62a_100012265687_200000210301 [0,2,0,0,0,0|0,1,0]=3 11299 B12R1.71 COCOc1ccc(cc1)SC 62a_200000210301_100012265687 [0,2,0,0,0,0|0,1,0]=3 11300 B12R1.71 COCOc1ccc(cc1)S[13CH3] 62a_100012265687_200025704644 [0,2,0,0,0,0|0,1,0]=3 11301 B12R1.71 COCOc1ccc(cc1)S[13CH3] 62a_200025704644_100012265687 [0,2,0,0,0,0|0,1,0]=3 11302 B12R1.71 COCOc1ccc(nc1)SC 62a_100012568617_200000210301 [0,2,0,0,0,0|1,1,0]=4 11303 B12R1.71 COCOc1ccc(nc1)SC 62a_200000210301_100012568617 [0,2,0,0,0,0|1,1,0]=4 11304 B12R1.71 COCOc1ccc(nc1)S[13CH3] 62a_100012568617_200025704644 [0,2,0,0,0,0|1,1,0]=4 11305 B12R1.71 COCOc1ccc(nc1)S[13CH3] 62a_200025704644_100012568617 [0,2,0,0,0,0|1,1,0]=4 11306 B12R1.71 COCSc1ccc(cc1)C#N 62a_100000766300_100000184291 [0,2,0,0,0,0|1,1,0]=4 11307 B12R1.71 COCSc1ccc(cc1)C=O 62a_100000188517_100000766300 [0,2,0,0,0,0|0,1,1]=4 11308 B12R1.71 COCSc1ccc(cc1)C=O 62a_100000766300_100000188517 [0,2,0,0,0,0|0,1,1]=4 11309 B12R1.71 COCSc1ccc(cc1)CF 62a_100000766300_100010268989 [0,2,0,0,0,0|1,1,0]=4 11310 B12R1.71 COCSc1ccc(cc1)CF 62a_100010268989_100000766300 [0,2,0,0,0,0|1,1,0]=4 11311 B12R1.71 COCSc1ccc(cc1)CN 62a_100000766300_100016989417 [0,2,0,0,0,0|1,1,0]=4 11312 B12R1.71 COCSc1ccc(cc1)CN 62a_100016989417_100000766300 [0,2,0,0,0,0|1,1,0]=4 11313 B12R1.71 COCSc1ccc(cc1)CO 62a_100000690907_100000766300 [0,2,0,0,0,0|0,1,0]=3 11314 B12R1.71 COCSc1ccc(cc1)CO 62a_100000766300_100000690907 [0,2,0,0,0,0|0,1,0]=3 11315 B12R1.71 COCSc1ccc(cc1)NN 62a_100000766300_100016988836 [0,2,0,0,0,0|1,1,0]=4 11316 B12R1.71 COCSc1ccc(cc1)NN 62a_100016988836_100000766300 [0,2,0,0,0,0|1,1,0]=4 11317 B12R1.71 COCSc1ccc(cc1)OC 62a_100000766300_100000171711 [0,2,0,0,0,0|0,1,0]=3 11318 B12R1.71 COCSc1ccc(cc1)SC 62a_100000766300_100011263217 [0,2,0,0,0,0|0,2,0]=4 11319 B12R1.71 COCSc1ccc(cc1)SC 62a_100011263217_100000766300 [0,2,0,0,0,0|0,2,0]=4 11320 B12R1.71 COCSc1ccc(cn1)CO 62a_100000766300_100009816760 [0,2,0,0,0,0|1,1,0]=4 11321 B12R1.71 COCSc1ccc(cn1)CO 62a_100009816760_100000766300 [0,2,0,0,0,0|1,1,0]=4 11322 B12R1.71 COCSc1ccc(cn1)OC 62a_100000755202_100000766300 [0,2,0,0,0,0|1,1,0]=4 11323 B12R1.71 COCSc1ccc(cn1)OC 62a_100000766300_100000744180 [0,2,0,0,0,0|1,1,0]=4 11324 B12R1.71 COCSc1ccc(nc1)CO 62a_100000754261_100000766300 [0,2,0,0,0,0|1,1,0]=4 11325 B12R1.71 COCSc1ccc(nc1)CO 62a_100000766300_100000754261 [0,2,0,0,0,0|1,1,0]=4 11326 B12R1.71 COCSc1ccc(nc1)OC 62a_100000047065_100000766300 [0,2,0,0,0,0|1,1,0]=4 11327 B12R1.71 COCSc1ccc(nc1)OC 62a_100000766300_100000047065 [0,2,0,0,0,0|1,1,0]=4 11328 B12R1.71 COc1ccc(cc1)CCC#N 34a_200011217972_200000210301 [0,2,0,0,0,0|1,0,1]=4 11329 B12R1.71 COc1ccc(cc1)CCC#N 7a_200011217972_200000210301 [0,2,0,0,0,0|1,0,1]=4 11330 B12R1.71 COc1ccc(cc1)CCCO 34a_100011215268_200000210301 [0,2,0,0,0,0|1,0,0]=3 11331 B12R1.71 COc1ccc(cc1)CCCO 7a_100011215268_200000210301 [0,2,0,0,0,0|1,0,0]=3 11332 B12R1.71 COc1ccc(cc1)CCN[13CH3] 2230a_100000210796_200025704644 [0,2,0,0,0,0|1,0,0]=3 11333 B12R1.71 COc1ccc(cc1)CCN[13CH3] 34a_100000210796_200025704644 [0,2,0,0,0,0|1,0,0]=3 11334 B12R1.71 COc1ccc(cc1)CCO[13CH3] 34a_100011219623_200025704644 [0,2,0,0,0,0|1,0,0]=3 11335 B12R1.71 COc1ccc(cc1)CCO[13CH3] 7a_100011219623_200025704644 [0,2,0,0,0,0|1,0,0]=3 11336 B12R1.71 COc1ccc(cc1)CCSC 62a_100011713689_200000210301 [0,2,0,0,0,0|1,0,0]=3 11337 B12R1.71 COc1ccc(cc1)CCSC 62a_200000210301_100011713689 [0,2,0,0,0,0|1,0,0]=3 11338 B12R1.71 COc1ccc(cc1)CCS[13CH3] 62a_100011713689_200025704644 [0,2,0,0,0,0|1,0,0]=3 11339 B12R1.71 COc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713689 [0,2,0,0,0,0|1,0,0]=3 11340 B12R1.71 COc1ccc(cc1)CNCF 34a_100000185587_100015361967 [0,2,0,0,0,0|2,0,0]=4 11341 B12R1.71 COc1ccc(cc1)COCF 34a_100000173359_100015361967 [0,2,0,0,0,0|1,0,0]=3 11342 B12R1.71 COc1ccc(cc1)CSCF 62a_100015361967_100000742318 [0,2,0,0,0,0|1,1,0]=4 11343 B12R1.71 COc1ccc(cc1)NCC=O 34a_100000184247_200009817547 [0,2,0,0,0,0|1,0,1]=4 11344 B12R1.71 COc1ccc(cc1)NCCF 34a_100000184247_100011217306 [0,2,0,0,0,0|1,0,0]=3 11345 B12R1.71 COc1ccc(cc1)NCCO 34a_100000184247_100000211926 [0,2,0,0,0,0|1,0,0]=3 11346 B12R1.71 COc1ccc(cc1)NCSC 34a_100000184247_100011218213 [0,2,0,0,0,0|1,0,0]=3 11347 B12R1.71 COc1ccc(cc1)OCC=O 34a_100000210503_200009817547 [0,2,0,0,0,0|0,0,1]=3 11348 B12R1.71 COc1ccc(cc1)OCCF 34a_100000210503_100011217306 [0,2,0,0,0,0|0,0,0]=2 11349 B12R1.71 COc1ccc(cc1)OCCO 34a_100000210503_100000211926 [0,2,0,0,0,0|0,0,0]=2 11350 B12R1.71 COc1ccc(cc1)OCSC 34a_100000210503_100011218213 [0,2,0,0,0,0|0,0,0]=2 11351 B12R1.71 COc1ccc(cc1)SCC#N 62a_100011215382_100000171711 [0,2,0,0,0,0|0,1,1]=4 11352 B12R1.71 COc1ccc(cc1)SCC=O 62a_200015260668_100000171711 [0,2,0,0,0,0|0,1,1]=4 11353 B12R1.71 COc1ccc(cc1)SCCF 62a_100011217306_100000171711 [0,2,0,0,0,0|0,1,0]=3 11354 B12R1.71 COc1ccc(cc1)SCCO 62a_100000211926_100000171711 [0,2,0,0,0,0|0,1,0]=3 11355 B12R1.71 COc1ccc(cc1)SCSC 62a_100011218213_100000171711 [0,2,0,0,0,0|0,1,0]=3 11356 B12R1.71 COc1ccc(cn1)CCN[13CH3] 2230a_100011998949_200025704644 [0,2,0,0,0,0|2,0,0]=4 11357 B12R1.71 COc1ccc(cn1)CCN[13CH3] 34a_100011998949_200025704644 [0,2,0,0,0,0|2,0,0]=4 11358 B12R1.71 COc1ccc(cn1)COCF 34a_100000763316_100015361967 [0,2,0,0,0,0|2,0,0]=4 11359 B12R1.71 COc1ccc(cn1)OCC=O 34a_100011934560_200009817547 [0,2,0,0,0,0|1,0,1]=4 11360 B12R1.71 COc1ccc(cn1)OCCF 34a_100011934560_100011217306 [0,2,0,0,0,0|1,0,0]=3 11361 B12R1.71 COc1ccc(cn1)OCCO 34a_100011934560_100000211926 [0,2,0,0,0,0|1,0,0]=3 11362 B12R1.71 COc1ccc(cn1)OCSC 34a_100011934560_100011218213 [0,2,0,0,0,0|1,0,0]=3 11363 B12R1.71 COc1ccc(cn1)SCCF 62a_100000047065_100011217306 [0,2,0,0,0,0|1,1,0]=4 11364 B12R1.71 COc1ccc(cn1)SCCF 62a_100011217306_100000047065 [0,2,0,0,0,0|1,1,0]=4 11365 B12R1.71 COc1ccc(cn1)SCCO 62a_100000047065_100000211926 [0,2,0,0,0,0|1,1,0]=4 11366 B12R1.71 COc1ccc(cn1)SCCO 62a_100000211926_100000047065 [0,2,0,0,0,0|1,1,0]=4 11367 B12R1.71 COc1ccc(cn1)SCSC 62a_100000047065_100011218213 [0,2,0,0,0,0|1,1,0]=4 11368 B12R1.71 COc1ccc(cn1)SCSC 62a_100011218213_100000047065 [0,2,0,0,0,0|1,1,0]=4 11369 B12R1.71 COc1ccc(nc1)COCF 34a_100011998694_100015361967 [0,2,0,0,0,0|2,0,0]=4 11370 B12R1.71 COc1ccc(nc1)OCC=O 34a_100012002028_200009817547 [0,2,0,0,0,0|1,0,1]=4 11371 B12R1.71 COc1ccc(nc1)OCCF 34a_100012002028_100011217306 [0,2,0,0,0,0|1,0,0]=3 11372 B12R1.71 COc1ccc(nc1)OCCO 34a_100012002028_100000211926 [0,2,0,0,0,0|1,0,0]=3 11373 B12R1.71 COc1ccc(nc1)OCSC 34a_100012002028_100011218213 [0,2,0,0,0,0|1,0,0]=3 11374 B12R1.71 COc1ccc(nc1)SCCF 62a_100000755202_100011217306 [0,2,0,0,0,0|1,1,0]=4 11375 B12R1.71 COc1ccc(nc1)SCCF 62a_100011217306_100000744180 [0,2,0,0,0,0|1,1,0]=4 11376 B12R1.71 COc1ccc(nc1)SCCO 62a_100000211926_100000744180 [0,2,0,0,0,0|1,1,0]=4 11377 B12R1.71 COc1ccc(nc1)SCCO 62a_100000755202_100000211926 [0,2,0,0,0,0|1,1,0]=4 11378 B12R1.71 COc1ccc(nc1)SCSC 62a_100000755202_100011218213 [0,2,0,0,0,0|1,1,0]=4 11379 B12R1.71 COc1ccc(nc1)SCSC 62a_100011218213_100000744180 [0,2,0,0,0,0|1,1,0]=4 11380 B12R1.71 COc1ncc(cn1)OCCF 34a_100000099601_100011217306 [0,2,0,0,0,0|2,0,0]=4 11381 B12R1.71 COc1ncc(cn1)OCCF 7a_100000099601_100011217306 [0,2,0,0,0,0|2,0,0]=4 11382 B12R1.71 COc1ncc(cn1)OCCO 34a_100000099601_100000211926 [0,2,0,0,0,0|2,0,0]=4 11383 B12R1.71 COc1ncc(cn1)OCCO 7a_100000099601_100000211926 [0,2,0,0,0,0|2,0,0]=4 11384 B12R1.71 COc1ncc(cn1)OCSC 34a_100000099601_100011218213 [0,2,0,0,0,0|2,0,0]=4 11385 B12R1.71 CSCCc1ccc(cc1)C#N 62a_200000210301_100012161189 [0,2,0,0,0,0|2,0,0]=4 11386 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 2230a_100000750819_200025704644 [0,2,0,0,0,0|2,0,0]=4 11387 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 34a_100000750819_200025704644 [0,2,0,0,0,0|2,0,0]=4 11388 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 7a_100000750819_200025704644 [0,2,0,0,0,0|2,0,0]=4 11389 B12R1.71 CSCNc1ccc(cc1)C#N 34a_100000185469_100011218213 [0,2,0,0,0,0|2,0,0]=4 11390 B12R1.71 CSCNc1ccc(cc1)CO 2230a_100011215238_100011218213 [0,2,0,0,0,0|1,0,0]=3 11391 B12R1.71 CSCNc1ccc(cc1)CO 34a_100011215238_100011218213 [0,2,0,0,0,0|1,0,0]=3 11392 B12R1.71 CSCNc1ccc(cc1)SC 34a_100000212337_100011218213 [0,2,0,0,0,0|1,1,0]=4 11393 B12R1.71 CSCOc1ccc(cc1)C#N 34a_100000210344_100011218213 [0,2,0,0,0,0|1,0,0]=3 11394 B12R1.71 CSCOc1ccc(cc1)CN 34a_100000185549_100011218213 [0,2,0,0,0,0|1,0,0]=3 11395 B12R1.71 CSCOc1ccc(cc1)CO 34a_100000211755_100011218213 [0,2,0,0,0,0|0,0,0]=2 11396 B12R1.71 CSCOc1ccc(cc1)SC 34a_100000211864_100011218213 [0,2,0,0,0,0|0,1,0]=3 11397 B12R1.71 CSCOc1ccc(cn1)CN 34a_100000757128_100011218213 [0,2,0,0,0,0|2,0,0]=4 11398 B12R1.71 CSCOc1ccc(nc1)C#N 34a_100011934750_100011218213 [0,2,0,0,0,0|2,0,0]=4 11399 B12R1.71 CSCOc1ccc(nc1)CN 34a_100020605196_100011218213 [0,2,0,0,0,0|2,0,0]=4 11400 B12R1.71 CSCOc1ccc(nc1)CO 34a_103436540053_100011218213 [0,2,0,0,0,0|1,0,0]=3 11401 B12R1.71 CSCSc1ccc(cc1)C#N 62a_100011218213_100000184291 [0,2,0,0,0,0|1,1,0]=4 11402 B12R1.71 CSCSc1ccc(cc1)C=O 62a_100000188517_100011218213 [0,2,0,0,0,0|0,1,1]=4 11403 B12R1.71 CSCSc1ccc(cc1)C=O 62a_100011218213_100000188517 [0,2,0,0,0,0|0,1,1]=4 11404 B12R1.71 CSCSc1ccc(cc1)CF 62a_100010268989_100011218213 [0,2,0,0,0,0|1,1,0]=4 11405 B12R1.71 CSCSc1ccc(cc1)CF 62a_100011218213_100010268989 [0,2,0,0,0,0|1,1,0]=4 11406 B12R1.71 CSCSc1ccc(cc1)CN 62a_100011218213_100016989417 [0,2,0,0,0,0|1,1,0]=4 11407 B12R1.71 CSCSc1ccc(cc1)CN 62a_100016989417_100011218213 [0,2,0,0,0,0|1,1,0]=4 11408 B12R1.71 CSCSc1ccc(cc1)CO 62a_100000690907_100011218213 [0,2,0,0,0,0|0,1,0]=3 11409 B12R1.71 CSCSc1ccc(cc1)CO 62a_100011218213_100000690907 [0,2,0,0,0,0|0,1,0]=3 11410 B12R1.71 CSCSc1ccc(cc1)NN 62a_100011218213_100016988836 [0,2,0,0,0,0|1,1,0]=4 11411 B12R1.71 CSCSc1ccc(cc1)NN 62a_100016988836_100011218213 [0,2,0,0,0,0|1,1,0]=4 11412 B12R1.71 CSCSc1ccc(cc1)SC 62a_100011218213_100011263217 [0,2,0,0,0,0|0,2,0]=4 11413 B12R1.71 CSCSc1ccc(cc1)SC 62a_100011263217_100011218213 [0,2,0,0,0,0|0,2,0]=4 11414 B12R1.71 CSCSc1ccc(cn1)CO 62a_100009816760_100011218213 [0,2,0,0,0,0|1,1,0]=4 11415 B12R1.71 CSCSc1ccc(cn1)CO 62a_100011218213_100009816760 [0,2,0,0,0,0|1,1,0]=4 11416 B12R1.71 CSCSc1ccc(nc1)CO 62a_100000754261_100011218213 [0,2,0,0,0,0|1,1,0]=4 11417 B12R1.71 CSCSc1ccc(nc1)CO 62a_100011218213_100000754261 [0,2,0,0,0,0|1,1,0]=4 11418 B12R1.71 CSc1ccc(cc1)CCCN 62a_100011297623_200000210301 [0,2,0,0,0,0|1,1,0]=4 11419 B12R1.71 CSc1ccc(cc1)CCCN 62a_200000210301_100011297623 [0,2,0,0,0,0|1,1,0]=4 11420 B12R1.71 CSc1ccc(cc1)CCCO 62a_100011709247_200000210301 [0,2,0,0,0,0|1,1,0]=4 11421 B12R1.71 CSc1ccc(cc1)CCCO 62a_200000210301_100011709247 [0,2,0,0,0,0|1,1,0]=4 11422 B12R1.71 CSc1ccc(cc1)COCF 34a_100011215404_100015361967 [0,2,0,0,0,0|1,1,0]=4 11423 B12R1.71 CSc1ccc(cc1)COCF 7a_100011215404_100015361967 [0,2,0,0,0,0|1,1,0]=4 11424 B12R1.71 CSc1ccc(cc1)NCCF 34a_100000212337_100011217306 [0,2,0,0,0,0|1,1,0]=4 11425 B12R1.71 CSc1ccc(cc1)NCCO 34a_100000212337_100000211926 [0,2,0,0,0,0|1,1,0]=4 11426 B12R1.71 CSc1ccc(cc1)OCC#N 62a_200000169425_200000210301 [0,2,0,0,0,0|0,1,1]=4 11427 B12R1.71 CSc1ccc(cc1)OCC#N 62a_200000210301_200000169425 [0,2,0,0,0,0|0,1,1]=4 11428 B12R1.71 CSc1ccc(cc1)OCC=O 34a_100000211864_200009817547 [0,2,0,0,0,0|0,1,1]=4 11429 B12R1.71 CSc1ccc(cc1)OCCF 34a_100000211864_100011217306 [0,2,0,0,0,0|0,1,0]=3 11430 B12R1.71 CSc1ccc(cc1)OCCF 62a_100012347556_200000210301 [0,2,0,0,0,0|0,1,0]=3 11431 B12R1.71 CSc1ccc(cc1)OCCF 62a_200000210301_100012347556 [0,2,0,0,0,0|0,1,0]=3 11432 B12R1.71 CSc1ccc(cc1)OCCN 62a_100000746992_200000210301 [0,2,0,0,0,0|0,1,0]=3 11433 B12R1.71 CSc1ccc(cc1)OCCN 62a_200000210301_100000746992 [0,2,0,0,0,0|0,1,0]=3 11434 B12R1.71 CSc1ccc(cc1)OCCO 34a_100000211864_100000211926 [0,2,0,0,0,0|0,1,0]=3 11435 B12R1.71 CSc1ccc(cc1)OCCO 62a_100000686261_200000210301 [0,2,0,0,0,0|0,1,0]=3 11436 B12R1.71 CSc1ccc(cc1)OCCO 62a_200000210301_100000686261 [0,2,0,0,0,0|0,1,0]=3 11437 B12R1.71 CSc1ccc(cc1)SCCF 62a_100011217306_100011263217 [0,2,0,0,0,0|0,2,0]=4 11438 B12R1.71 CSc1ccc(cc1)SCCF 62a_100011263217_100011217306 [0,2,0,0,0,0|0,2,0]=4 11439 B12R1.71 CSc1ccc(cc1)SCCN 62a_100000184645_200000210301 [0,2,0,0,0,0|0,2,0]=4 11440 B12R1.71 CSc1ccc(cc1)SCCN 62a_200000210301_100000184645 [0,2,0,0,0,0|0,2,0]=4 11441 B12R1.71 CSc1ccc(cc1)SCCO 62a_100000211926_100011263217 [0,2,0,0,0,0|0,2,0]=4 11442 B12R1.71 CSc1ccc(cc1)SCCO 62a_100011263217_100000211926 [0,2,0,0,0,0|0,2,0]=4 11443 B12R1.71 CSc1ccc(cn1)OCCO 62a_200000210301_200013150534 [0,2,0,0,0,0|1,1,0]=4 11444 B12R1.71 CSc1ccc(cn1)OCCO 62a_200013150534_200000210301 [0,2,0,0,0,0|1,1,0]=4 11445 B12R1.71 FCCSc1ccc(cc1)CF 62a_100010268989_100011217306 [0,2,0,0,0,0|1,1,0]=4 11446 B12R1.71 FCCSc1ccc(cc1)CF 62a_100011217306_100010268989 [0,2,0,0,0,0|1,1,0]=4 11447 B12R1.71 FCOCc1ccc(cc1)CBr 34a_100012353999_100015361967 [0,2,0,0,0,0|2,0,0]=4 11448 B12R1.71 FCOCc1ccc(cc1)CBr 7a_100012353999_100015361967 [0,2,0,0,0,0|2,0,0]=4 11449 B12R1.71 FCOCc1ccc(cc1)CCl 34a_100000067286_100015361967 [0,2,0,0,0,0|2,0,0]=4 11450 B12R1.71 FCOCc1ccc(cc1)CCl 7a_100000067286_100015361967 [0,2,0,0,0,0|2,0,0]=4 11451 B12R1.71 N#CCNc1ccc(cc1)CO 2230a_100011215238_100011215382 [0,2,0,0,0,0|1,0,1]=4 11452 B12R1.71 N#CCOc1ccc(cc1)C#N 7a_100000210344_100011215382 [0,2,0,0,0,0|1,0,1]=4 11453 B12R1.71 N#CCSc1ccc(cc1)CO 62a_100000690907_100011215382 [0,2,0,0,0,0|0,1,1]=4 11454 B12R1.71 N#CCSc1ccc(cc1)CO 62a_100011215382_100000690907 [0,2,0,0,0,0|0,1,1]=4 11455 B12R1.71 N#Cc1ccc(cc1)COCF 34a_100000238739_100015361967 [0,2,0,0,0,0|2,0,0]=4 11456 B12R1.71 N#Cc1ccc(cc1)COCF 7a_100000238739_100015361967 [0,2,0,0,0,0|2,0,0]=4 11457 B12R1.71 N#Cc1ccc(cc1)NCCF 34a_100000185469_100011217306 [0,2,0,0,0,0|2,0,0]=4 11458 B12R1.71 N#Cc1ccc(cc1)NCCO 34a_100000185469_100000211926 [0,2,0,0,0,0|2,0,0]=4 11459 B12R1.71 N#Cc1ccc(cc1)OCC=O 34a_100000210344_200009817547 [0,2,0,0,0,0|1,0,1]=4 11460 B12R1.71 N#Cc1ccc(cc1)OCC=O 7a_100000210344_200015260668 [0,2,0,0,0,0|1,0,1]=4 11461 B12R1.71 N#Cc1ccc(cc1)OCCF 34a_100000210344_100011217306 [0,2,0,0,0,0|1,0,0]=3 11462 B12R1.71 N#Cc1ccc(cc1)OCCF 7a_100000210344_100011217306 [0,2,0,0,0,0|1,0,0]=3 11463 B12R1.71 N#Cc1ccc(cc1)OCCO 34a_100000210344_100000211926 [0,2,0,0,0,0|1,0,0]=3 11464 B12R1.71 N#Cc1ccc(cc1)OCCO 7a_100000210344_100000211926 [0,2,0,0,0,0|1,0,0]=3 11465 B12R1.71 N#Cc1ccc(cc1)SCCF 62a_100011217306_100000184291 [0,2,0,0,0,0|1,1,0]=4 11466 B12R1.71 N#Cc1ccc(cc1)SCCO 62a_100000211926_100000184291 [0,2,0,0,0,0|1,1,0]=4 11467 B12R1.71 N#Cc1ccc(cn1)OCCF 34a_100011934750_100011217306 [0,2,0,0,0,0|2,0,0]=4 11468 B12R1.71 N#Cc1ccc(cn1)OCCF 7a_100011934750_100011217306 [0,2,0,0,0,0|2,0,0]=4 11469 B12R1.71 N#Cc1ccc(cn1)OCCO 34a_100011934750_100000211926 [0,2,0,0,0,0|2,0,0]=4 11470 B12R1.71 N#Cc1ccc(cn1)OCCO 7a_100011934750_100000211926 [0,2,0,0,0,0|2,0,0]=4 11471 B12R1.71 NCc1ccc(cc1)COCF 34a_100015189231_100015361967 [0,2,0,0,0,0|2,0,0]=4 11472 B12R1.71 NCc1ccc(cc1)OCC=O 34a_100000185549_200009817547 [0,2,0,0,0,0|1,0,1]=4 11473 B12R1.71 NCc1ccc(cc1)OCCF 34a_100000185549_100011217306 [0,2,0,0,0,0|1,0,0]=3 11474 B12R1.71 NCc1ccc(cc1)OCCO 34a_100000185549_100000211926 [0,2,0,0,0,0|1,0,0]=3 11475 B12R1.71 NCc1ccc(cc1)SCCF 62a_100011217306_100016989417 [0,2,0,0,0,0|1,1,0]=4 11476 B12R1.71 NCc1ccc(cc1)SCCF 62a_100016989417_100011217306 [0,2,0,0,0,0|1,1,0]=4 11477 B12R1.71 NCc1ccc(cc1)SCCO 62a_100000211926_100016989417 [0,2,0,0,0,0|1,1,0]=4 11478 B12R1.71 NCc1ccc(cc1)SCCO 62a_100016989417_100000211926 [0,2,0,0,0,0|1,1,0]=4 11479 B12R1.71 NCc1ccc(cn1)OCCF 34a_100020605196_100011217306 [0,2,0,0,0,0|2,0,0]=4 11480 B12R1.71 NCc1ccc(cn1)OCCO 34a_100020605196_100000211926 [0,2,0,0,0,0|2,0,0]=4 11481 B12R1.71 NCc1ccc(nc1)OCCF 34a_100000757128_100011217306 [0,2,0,0,0,0|2,0,0]=4 11482 B12R1.71 NCc1ccc(nc1)OCCO 34a_100000757128_100000211926 [0,2,0,0,0,0|2,0,0]=4 11483 B12R1.71 NNc1ccc(cc1)SCCF 62a_100011217306_100016988836 [0,2,0,0,0,0|1,1,0]=4 11484 B12R1.71 NNc1ccc(cc1)SCCF 62a_100016988836_100011217306 [0,2,0,0,0,0|1,1,0]=4 11485 B12R1.71 NNc1ccc(cc1)SCCO 62a_100000211926_100016988836 [0,2,0,0,0,0|1,1,0]=4 11486 B12R1.71 NNc1ccc(cc1)SCCO 62a_100016988836_100000211926 [0,2,0,0,0,0|1,1,0]=4 11487 B12R1.71 O=CCNc1ccc(cc1)CO 2230a_100011215238_200015260668 [0,2,0,0,0,0|1,0,1]=4 11488 B12R1.71 O=CCNc1ccc(cc1)CO 34a_100011215238_200009817547 [0,2,0,0,0,0|1,0,1]=4 11489 B12R1.71 O=CCOc1ccc(cc1)CO 34a_100000211755_200009817547 [0,2,0,0,0,0|0,0,1]=3 11490 B12R1.71 O=CCOc1ccc(nc1)CO 34a_103436540053_200009817547 [0,2,0,0,0,0|1,0,1]=4 11491 B12R1.71 O=CCSc1ccc(cc1)CO 62a_100000690907_200015260668 [0,2,0,0,0,0|0,1,1]=4 11492 B12R1.71 O=CCSc1ccc(cc1)CO 62a_200015260668_100000690907 [0,2,0,0,0,0|0,1,1]=4 11493 B12R1.71 O=Cc1ccc(cc1)SCCF 62a_100000188517_100011217306 [0,2,0,0,0,0|0,1,1]=4 11494 B12R1.71 O=Cc1ccc(cc1)SCCF 62a_100011217306_100000188517 [0,2,0,0,0,0|0,1,1]=4 11495 B12R1.71 O=Cc1ccc(cc1)SCCO 62a_100000188517_100000211926 [0,2,0,0,0,0|0,1,1]=4 11496 B12R1.71 O=Cc1ccc(cc1)SCCO 62a_100000211926_100000188517 [0,2,0,0,0,0|0,1,1]=4 11497 B12R1.71 OCCNc1ccc(cc1)CO 2230a_100011215238_100000211926 [0,2,0,0,0,0|1,0,0]=3 11498 B12R1.71 OCCNc1ccc(cc1)CO 34a_100011215238_100000211926 [0,2,0,0,0,0|1,0,0]=3 11499 B12R1.71 OCCOc1ccc(cc1)CO 34a_100000211755_100000211926 [0,2,0,0,0,0|0,0,0]=2 11500 B12R1.71 OCCOc1ccc(nc1)CO 34a_103436540053_100000211926 [0,2,0,0,0,0|1,0,0]=3 11501 B12R1.71 OCCSc1ccc(cc1)CF 62a_100000211926_100010268989 [0,2,0,0,0,0|1,1,0]=4 11502 B12R1.71 OCCSc1ccc(cc1)CF 62a_100010268989_100000211926 [0,2,0,0,0,0|1,1,0]=4 11503 B12R1.71 OCCSc1ccc(cc1)CO 62a_100000211926_100000690907 [0,2,0,0,0,0|0,1,0]=3 11504 B12R1.71 OCCSc1ccc(cc1)CO 62a_100000690907_100000211926 [0,2,0,0,0,0|0,1,0]=3 11505 B12R1.71 OCCSc1ccc(cn1)CO 62a_100000211926_100009816760 [0,2,0,0,0,0|1,1,0]=4 11506 B12R1.71 OCCSc1ccc(cn1)CO 62a_100009816760_100000211926 [0,2,0,0,0,0|1,1,0]=4 11507 B12R1.71 OCCSc1ccc(nc1)CO 62a_100000211926_100000754261 [0,2,0,0,0,0|1,1,0]=4 11508 B12R1.71 OCCSc1ccc(nc1)CO 62a_100000754261_100000211926 [0,2,0,0,0,0|1,1,0]=4 11509 B12R1.71 OCc1ccc(cc1)CNCF 34a_100015189231_100015361967 [0,2,0,0,0,0|2,0,0]=4 11510 B12R1.71 OCc1ccc(cc1)CSCF 62a_100000067286_100015361967 [0,2,0,0,0,0|1,1,0]=4 11511 B12R1.71 OCc1ccc(cc1)CSCF 62a_100015361967_100000067286 [0,2,0,0,0,0|1,1,0]=4 11512 B12R1.71 OCc1ccc(cc1)NCCF 2230a_100011215238_100011217306 [0,2,0,0,0,0|1,0,0]=3 11513 B12R1.71 OCc1ccc(cc1)NCCF 34a_100011215238_100011217306 [0,2,0,0,0,0|1,0,0]=3 11514 B12R1.71 OCc1ccc(cc1)OCCF 34a_100000211755_100011217306 [0,2,0,0,0,0|0,0,0]=2 11515 B12R1.71 OCc1ccc(cc1)SCCF 62a_100000690907_100011217306 [0,2,0,0,0,0|0,1,0]=3 11516 B12R1.71 OCc1ccc(cc1)SCCF 62a_100011217306_100000690907 [0,2,0,0,0,0|0,1,0]=3 11517 B12R1.71 OCc1ccc(cn1)OCCF 34a_103436540053_100011217306 [0,2,0,0,0,0|1,0,0]=3 11518 B12R1.71 OCc1ccc(cn1)SCCF 62a_100000754261_100011217306 [0,2,0,0,0,0|1,1,0]=4 11519 B12R1.71 OCc1ccc(cn1)SCCF 62a_100011217306_100000754261 [0,2,0,0,0,0|1,1,0]=4 11520 B12R1.71 OCc1ccc(nc1)SCCF 62a_100009816760_100011217306 [0,2,0,0,0,0|1,1,0]=4 11521 B12R1.71 OCc1ccc(nc1)SCCF 62a_100011217306_100009816760 [0,2,0,0,0,0|1,1,0]=4 11522 B12R1.71 [13CH3]NCCc1ccc(cc1)C#N 2230a_100015189369_200025704644 [0,2,0,0,0,0|2,0,0]=4 11523 B12R1.71 [13CH3]NCCc1ccc(cc1)C#N 34a_100015189369_200025704644 [0,2,0,0,0,0|2,0,0]=4 11524 B12R1.71 [13CH3]Nc1ccc(cc1)OCCF 34a_100012282086_200025704644 [0,2,0,0,0,0|1,0,0]=3 11525 B12R1.71 [13CH3]Nc1ccc(cc1)OCCO 2230a_100000754363_200025704644 [0,2,0,0,0,0|1,0,0]=3 11526 B12R1.71 [13CH3]Nc1ccc(cc1)OCCO 34a_100000754363_200025704644 [0,2,0,0,0,0|1,0,0]=3 11527 B12R1.71 [13CH3]OCCc1ccc(cc1)C#N 34a_100011219507_200025704644 [0,2,0,0,0,0|2,0,0]=4 11528 B12R1.71 [13CH3]OCCc1ccc(cc1)C#N 7a_100011219507_200025704644 [0,2,0,0,0,0|2,0,0]=4 11529 B12R1.71 [13CH3]Oc1ccc(cc1)CCC#N 34a_200011217972_200025704644 [0,2,0,0,0,0|1,0,1]=4 11530 B12R1.71 [13CH3]Oc1ccc(cc1)CCC#N 7a_200011217972_200025704644 [0,2,0,0,0,0|1,0,1]=4 11531 B12R1.71 [13CH3]Oc1ccc(cc1)CCCO 34a_100011215268_200025704644 [0,2,0,0,0,0|1,0,0]=3 11532 B12R1.71 [13CH3]Oc1ccc(cc1)CCCO 7a_100011215268_200025704644 [0,2,0,0,0,0|1,0,0]=3 11533 B12R1.71 [13CH3]SCCc1ccc(cc1)C#N 62a_200025704644_100012161189 [0,2,0,0,0,0|2,0,0]=4 11534 B12R1.71 [13CH3]Sc1ccc(cc1)CCCN 62a_100011297623_200025704644 [0,2,0,0,0,0|1,1,0]=4 11535 B12R1.71 [13CH3]Sc1ccc(cc1)CCCN 62a_200025704644_100011297623 [0,2,0,0,0,0|1,1,0]=4 11536 B12R1.71 [13CH3]Sc1ccc(cc1)CCCO 62a_100011709247_200025704644 [0,2,0,0,0,0|1,1,0]=4 11537 B12R1.71 [13CH3]Sc1ccc(cc1)CCCO 62a_200025704644_100011709247 [0,2,0,0,0,0|1,1,0]=4 11538 B12R1.71 [13CH3]Sc1ccc(cc1)OCC#N 62a_200000169425_200025704644 [0,2,0,0,0,0|0,1,1]=4 11539 B12R1.71 [13CH3]Sc1ccc(cc1)OCC#N 62a_200025704644_200000169425 [0,2,0,0,0,0|0,1,1]=4 11540 B12R1.71 [13CH3]Sc1ccc(cc1)OCCF 62a_100012347556_200025704644 [0,2,0,0,0,0|0,1,0]=3 11541 B12R1.71 [13CH3]Sc1ccc(cc1)OCCF 62a_200025704644_100012347556 [0,2,0,0,0,0|0,1,0]=3 11542 B12R1.71 [13CH3]Sc1ccc(cc1)OCCN 62a_100000746992_200025704644 [0,2,0,0,0,0|0,1,0]=3 11543 B12R1.71 [13CH3]Sc1ccc(cc1)OCCN 62a_200025704644_100000746992 [0,2,0,0,0,0|0,1,0]=3 11544 B12R1.71 [13CH3]Sc1ccc(cc1)OCCO 62a_100000686261_200025704644 [0,2,0,0,0,0|0,1,0]=3 11545 B12R1.71 [13CH3]Sc1ccc(cc1)OCCO 62a_200025704644_100000686261 [0,2,0,0,0,0|0,1,0]=3 11546 B12R1.71 [13CH3]Sc1ccc(cc1)SCCN 62a_100000184645_200025704644 [0,2,0,0,0,0|0,2,0]=4 11547 B12R1.71 [13CH3]Sc1ccc(cc1)SCCN 62a_200025704644_100000184645 [0,2,0,0,0,0|0,2,0]=4 11548 B12R1.71 [13CH3]Sc1ccc(cn1)OCCO 62a_200013150534_200025704644 [0,2,0,0,0,0|1,1,0]=4 11549 B12R1.71 [13CH3]Sc1ccc(cn1)OCCO 62a_200025704644_200013150534 [0,2,0,0,0,0|1,1,0]=4 11550 B12R1.385 C#CCNc1ccc(c(c1)Br)O 34a_100011534360_100000184674 [0,2,0,0,0,0|1,0,1]=4 11551 B12R1.385 C#CCNc1ccc(c(c1)C)O 34a_100011218179_100000184674 [0,2,0,0,0,0|1,0,1]=4 11552 B12R1.385 C#CCNc1ccc(c(c1)C)O 7a_100011218179_100000038162 [0,2,0,0,0,0|1,0,1]=4 11553 B12R1.385 C#CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000184674 [0,2,0,0,0,0|1,0,1]=4 11554 B12R1.385 C#CCNc1ccc(c(c1)F)O 34a_100011220035_100000184674 [0,2,0,0,0,0|1,0,1]=4 11555 B12R1.385 C#CCNc1ccc(c(c1)F)O 7a_100011220035_100000038162 [0,2,0,0,0,0|1,0,1]=4 11556 B12R1.385 C#CCNc1ccc(c(c1)O)O 34a_100102946323_100000184674 [0,2,0,0,0,0|1,0,1]=4 11557 B12R1.385 C#CCOc1ccc(c(c1)Br)C 34a_100011380479_100000184674 [0,2,0,0,0,0|1,0,1]=4 11558 B12R1.385 C#CCOc1ccc(c(c1)Br)C 7a_100011380479_100000038162 [0,2,0,0,0,0|1,0,1]=4 11559 B12R1.385 C#CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000184674 [0,2,0,0,0,0|1,0,1]=4 11560 B12R1.385 C#CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000038162 [0,2,0,0,0,0|1,0,1]=4 11561 B12R1.385 C#CCOc1ccc(c(c1)Br)F 34a_100000693481_100000184674 [0,2,0,0,0,0|1,0,1]=4 11562 B12R1.385 C#CCOc1ccc(c(c1)Br)F 7a_100000693481_100000038162 [0,2,0,0,0,0|1,0,1]=4 11563 B12R1.385 C#CCOc1ccc(c(c1)Br)I 34a_100000701344_100000184674 [0,2,0,0,0,0|1,0,1]=4 11564 B12R1.385 C#CCOc1ccc(c(c1)Br)I 7a_100000701344_100000038162 [0,2,0,0,0,0|1,0,1]=4 11565 B12R1.385 C#CCOc1ccc(c(c1)Br)N 34a_100012001276_100000184674 [0,2,0,0,0,0|1,0,1]=4 11566 B12R1.385 C#CCOc1ccc(c(c1)Br)N 7a_100012001276_100000038162 [0,2,0,0,0,0|1,0,1]=4 11567 B12R1.385 C#CCOc1ccc(c(c1)C)Br 34a_100000690111_100000184674 [0,2,0,0,0,0|1,0,1]=4 11568 B12R1.385 C#CCOc1ccc(c(c1)C)Br 7a_100000690111_100000038162 [0,2,0,0,0,0|1,0,1]=4 11569 B12R1.385 C#CCOc1ccc(c(c1)C)C 34a_100000210932_100000184674 [0,2,0,0,0,0|1,0,1]=4 11570 B12R1.385 C#CCOc1ccc(c(c1)C)C 7a_100000210932_100000038162 [0,2,0,0,0,0|1,0,1]=4 11571 B12R1.385 C#CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000184674 [0,2,0,0,0,0|1,0,1]=4 11572 B12R1.385 C#CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000038162 [0,2,0,0,0,0|1,0,1]=4 11573 B12R1.385 C#CCOc1ccc(c(c1)C)F 34a_100000751312_100000184674 [0,2,0,0,0,0|1,0,1]=4 11574 B12R1.385 C#CCOc1ccc(c(c1)C)F 7a_100000751312_100000038162 [0,2,0,0,0,0|1,0,1]=4 11575 B12R1.385 C#CCOc1ccc(c(c1)C)I 34a_100000729255_100000184674 [0,2,0,0,0,0|1,0,1]=4 11576 B12R1.385 C#CCOc1ccc(c(c1)C)I 7a_100000729255_100000038162 [0,2,0,0,0,0|1,0,1]=4 11577 B12R1.385 C#CCOc1ccc(c(c1)C)N 34a_100000756630_100000184674 [0,2,0,0,0,0|1,0,1]=4 11578 B12R1.385 C#CCOc1ccc(c(c1)C)N 7a_100000756630_100000038162 [0,2,0,0,0,0|1,0,1]=4 11579 B12R1.385 C#CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000184674 [0,2,0,0,0,0|1,0,1]=4 11580 B12R1.385 C#CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000038162 [0,2,0,0,0,0|1,0,1]=4 11581 B12R1.385 C#CCOc1ccc(c(c1)Cl)C 34a_100011265682_100000184674 [0,2,0,0,0,0|1,0,1]=4 11582 B12R1.385 C#CCOc1ccc(c(c1)Cl)C 7a_100011265682_100000038162 [0,2,0,0,0,0|1,0,1]=4 11583 B12R1.385 C#CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000184674 [0,2,0,0,0,0|1,0,1]=4 11584 B12R1.385 C#CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000038162 [0,2,0,0,0,0|1,0,1]=4 11585 B12R1.385 C#CCOc1ccc(c(c1)Cl)F 34a_100000211030_100000184674 [0,2,0,0,0,0|1,0,1]=4 11586 B12R1.385 C#CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000038162 [0,2,0,0,0,0|1,0,1]=4 11587 B12R1.385 C#CCOc1ccc(c(c1)Cl)I 34a_100000047559_100000184674 [0,2,0,0,0,0|1,0,1]=4 11588 B12R1.385 C#CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000038162 [0,2,0,0,0,0|1,0,1]=4 11589 B12R1.385 C#CCOc1ccc(c(c1)Cl)N 34a_100011215599_100000184674 [0,2,0,0,0,0|1,0,1]=4 11590 B12R1.385 C#CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000038162 [0,2,0,0,0,0|1,0,1]=4 11591 B12R1.385 C#CCOc1ccc(c(c1)F)Br 34a_100000755031_100000184674 [0,2,0,0,0,0|1,0,1]=4 11592 B12R1.385 C#CCOc1ccc(c(c1)F)Br 7a_100000755031_100000038162 [0,2,0,0,0,0|1,0,1]=4 11593 B12R1.385 C#CCOc1ccc(c(c1)F)C 34a_100000722560_100000184674 [0,2,0,0,0,0|1,0,1]=4 11594 B12R1.385 C#CCOc1ccc(c(c1)F)C 7a_100000722560_100000038162 [0,2,0,0,0,0|1,0,1]=4 11595 B12R1.385 C#CCOc1ccc(c(c1)F)Cl 34a_100000691581_100000184674 [0,2,0,0,0,0|1,0,1]=4 11596 B12R1.385 C#CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000038162 [0,2,0,0,0,0|1,0,1]=4 11597 B12R1.385 C#CCOc1ccc(c(c1)F)F 34a_100000181275_100000184674 [0,2,0,0,0,0|1,0,1]=4 11598 B12R1.385 C#CCOc1ccc(c(c1)F)F 7a_100000181275_100000038162 [0,2,0,0,0,0|1,0,1]=4 11599 B12R1.385 C#CCOc1ccc(c(c1)F)I 34a_100009990212_100000184674 [0,2,0,0,0,0|1,0,1]=4 11600 B12R1.385 C#CCOc1ccc(c(c1)F)I 7a_100009990212_100000038162 [0,2,0,0,0,0|1,0,1]=4 11601 B12R1.385 C#CCOc1ccc(c(c1)F)N 34a_100000759473_100000184674 [0,2,0,0,0,0|1,0,1]=4 11602 B12R1.385 C#CCOc1ccc(c(c1)F)N 7a_100000759473_100000038162 [0,2,0,0,0,0|1,0,1]=4 11603 B12R1.385 C#CCOc1ccc(c(c1)I)Br 34a_100012339312_100000184674 [0,2,0,0,0,0|1,0,1]=4 11604 B12R1.385 C#CCOc1ccc(c(c1)I)Br 7a_100012339312_100000038162 [0,2,0,0,0,0|1,0,1]=4 11605 B12R1.385 C#CCOc1ccc(c(c1)I)Cl 34a_100000049588_100000184674 [0,2,0,0,0,0|1,0,1]=4 11606 B12R1.385 C#CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000038162 [0,2,0,0,0,0|1,0,1]=4 11607 B12R1.385 C#CCOc1ccc(c(c1)I)N 34a_100010084370_100000184674 [0,2,0,0,0,0|1,0,1]=4 11608 B12R1.385 C#CCOc1ccc(c(c1)I)N 7a_100010084370_100000038162 [0,2,0,0,0,0|1,0,1]=4 11609 B12R1.385 C#CCOc1ccc(c(c1)N)Br 34a_100011999798_100000184674 [0,2,0,0,0,0|1,0,1]=4 11610 B12R1.385 C#CCOc1ccc(c(c1)N)Br 7a_100011999798_100000038162 [0,2,0,0,0,0|1,0,1]=4 11611 B12R1.385 C#CCOc1ccc(c(c1)N)C 34a_100011216113_100000184674 [0,2,0,0,0,0|1,0,1]=4 11612 B12R1.385 C#CCOc1ccc(c(c1)N)C 7a_100011216113_100000038162 [0,2,0,0,0,0|1,0,1]=4 11613 B12R1.385 C#CCOc1ccc(c(c1)N)Cl 34a_100011934297_100000184674 [0,2,0,0,0,0|1,0,1]=4 11614 B12R1.385 C#CCOc1ccc(c(c1)N)F 34a_100012017239_100000184674 [0,2,0,0,0,0|1,0,1]=4 11615 B12R1.385 C#CCOc1ccc(c(c1)N)F 7a_100012017239_100000038162 [0,2,0,0,0,0|1,0,1]=4 11616 B12R1.385 C#CCOc1ccc(c(c1)N)N 34a_100025771000_100000184674 [0,2,0,0,0,0|1,0,1]=4 11617 B12R1.385 C#CCSc1ccc(c(c1)Br)O 62a_100000038162_100012361655 [0,2,0,0,0,0|0,1,1]=4 11618 B12R1.385 C#CCSc1ccc(c(c1)C)O 62a_100000038162_100000186361 [0,2,0,0,0,0|0,1,1]=4 11619 B12R1.385 C#CCSc1ccc(c(c1)Cl)O 62a_100000038162_100012360047 [0,2,0,0,0,0|0,1,1]=4 11620 B12R1.385 C#CCSc1ccc(c(c1)F)O 62a_100000038162_100000185481 [0,2,0,0,0,0|0,1,1]=4 11621 B12R1.385 C#CCSc1ccc(c(c1)N)O 62a_100000038162_100000752626 [0,2,0,0,0,0|0,1,1]=4 11622 B12R1.385 C#CCSc1ccc(c(c1)O)O 62a_100000038162_100009813601 [0,2,0,0,0,0|0,1,1]=4 11623 B12R1.385 C=CCNc1ccc(c(c1)Br)O 34a_100011534360_100015514636 [0,2,0,0,0,0|1,0,1]=4 11624 B12R1.385 C=CCNc1ccc(c(c1)C)O 34a_100011218179_100015514636 [0,2,0,0,0,0|1,0,1]=4 11625 B12R1.385 C=CCNc1ccc(c(c1)C)O 7a_100011218179_100015514636 [0,2,0,0,0,0|1,0,1]=4 11626 B12R1.385 C=CCNc1ccc(c(c1)Cl)O 34a_100000744943_100015514636 [0,2,0,0,0,0|1,0,1]=4 11627 B12R1.385 C=CCNc1ccc(c(c1)F)O 34a_100011220035_100015514636 [0,2,0,0,0,0|1,0,1]=4 11628 B12R1.385 C=CCNc1ccc(c(c1)F)O 7a_100011220035_100015514636 [0,2,0,0,0,0|1,0,1]=4 11629 B12R1.385 C=CCNc1ccc(c(c1)O)O 34a_100102946323_100015514636 [0,2,0,0,0,0|1,0,1]=4 11630 B12R1.385 C=CCOc1ccc(c(c1)Br)C 34a_100011380479_100015514636 [0,2,0,0,0,0|1,0,1]=4 11631 B12R1.385 C=CCOc1ccc(c(c1)Br)C 7a_100011380479_100015514636 [0,2,0,0,0,0|1,0,1]=4 11632 B12R1.385 C=CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100015514636 [0,2,0,0,0,0|1,0,1]=4 11633 B12R1.385 C=CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100015514636 [0,2,0,0,0,0|1,0,1]=4 11634 B12R1.385 C=CCOc1ccc(c(c1)Br)F 34a_100000693481_100015514636 [0,2,0,0,0,0|1,0,1]=4 11635 B12R1.385 C=CCOc1ccc(c(c1)Br)F 7a_100000693481_100015514636 [0,2,0,0,0,0|1,0,1]=4 11636 B12R1.385 C=CCOc1ccc(c(c1)Br)I 34a_100000701344_100015514636 [0,2,0,0,0,0|1,0,1]=4 11637 B12R1.385 C=CCOc1ccc(c(c1)Br)I 7a_100000701344_100015514636 [0,2,0,0,0,0|1,0,1]=4 11638 B12R1.385 C=CCOc1ccc(c(c1)Br)N 34a_100012001276_100015514636 [0,2,0,0,0,0|1,0,1]=4 11639 B12R1.385 C=CCOc1ccc(c(c1)Br)N 7a_100012001276_100015514636 [0,2,0,0,0,0|1,0,1]=4 11640 B12R1.385 C=CCOc1ccc(c(c1)C)Br 34a_100000690111_100015514636 [0,2,0,0,0,0|1,0,1]=4 11641 B12R1.385 C=CCOc1ccc(c(c1)C)Br 7a_100000690111_100015514636 [0,2,0,0,0,0|1,0,1]=4 11642 B12R1.385 C=CCOc1ccc(c(c1)C)C 34a_100000210932_100015514636 [0,2,0,0,0,0|1,0,1]=4 11643 B12R1.385 C=CCOc1ccc(c(c1)C)C 7a_100000210932_100015514636 [0,2,0,0,0,0|1,0,1]=4 11644 B12R1.385 C=CCOc1ccc(c(c1)C)Cl 34a_100000211092_100015514636 [0,2,0,0,0,0|1,0,1]=4 11645 B12R1.385 C=CCOc1ccc(c(c1)C)Cl 7a_100000211092_100015514636 [0,2,0,0,0,0|1,0,1]=4 11646 B12R1.385 C=CCOc1ccc(c(c1)C)F 34a_100000751312_100015514636 [0,2,0,0,0,0|1,0,1]=4 11647 B12R1.385 C=CCOc1ccc(c(c1)C)F 7a_100000751312_100015514636 [0,2,0,0,0,0|1,0,1]=4 11648 B12R1.385 C=CCOc1ccc(c(c1)C)I 34a_100000729255_100015514636 [0,2,0,0,0,0|1,0,1]=4 11649 B12R1.385 C=CCOc1ccc(c(c1)C)I 7a_100000729255_100015514636 [0,2,0,0,0,0|1,0,1]=4 11650 B12R1.385 C=CCOc1ccc(c(c1)C)N 34a_100000756630_100015514636 [0,2,0,0,0,0|1,0,1]=4 11651 B12R1.385 C=CCOc1ccc(c(c1)C)N 7a_100000756630_100015514636 [0,2,0,0,0,0|1,0,1]=4 11652 B12R1.385 C=CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100015514636 [0,2,0,0,0,0|1,0,1]=4 11653 B12R1.385 C=CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100015514636 [0,2,0,0,0,0|1,0,1]=4 11654 B12R1.385 C=CCOc1ccc(c(c1)Cl)C 34a_100011265682_100015514636 [0,2,0,0,0,0|1,0,1]=4 11655 B12R1.385 C=CCOc1ccc(c(c1)Cl)C 7a_100011265682_100015514636 [0,2,0,0,0,0|1,0,1]=4 11656 B12R1.385 C=CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100015514636 [0,2,0,0,0,0|1,0,1]=4 11657 B12R1.385 C=CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100015514636 [0,2,0,0,0,0|1,0,1]=4 11658 B12R1.385 C=CCOc1ccc(c(c1)Cl)F 34a_100000211030_100015514636 [0,2,0,0,0,0|1,0,1]=4 11659 B12R1.385 C=CCOc1ccc(c(c1)Cl)F 7a_100000211030_100015514636 [0,2,0,0,0,0|1,0,1]=4 11660 B12R1.385 C=CCOc1ccc(c(c1)Cl)I 34a_100000047559_100015514636 [0,2,0,0,0,0|1,0,1]=4 11661 B12R1.385 C=CCOc1ccc(c(c1)Cl)I 7a_100000047559_100015514636 [0,2,0,0,0,0|1,0,1]=4 11662 B12R1.385 C=CCOc1ccc(c(c1)Cl)N 34a_100011215599_100015514636 [0,2,0,0,0,0|1,0,1]=4 11663 B12R1.385 C=CCOc1ccc(c(c1)Cl)N 7a_100011215599_100015514636 [0,2,0,0,0,0|1,0,1]=4 11664 B12R1.385 C=CCOc1ccc(c(c1)F)Br 34a_100000755031_100015514636 [0,2,0,0,0,0|1,0,1]=4 11665 B12R1.385 C=CCOc1ccc(c(c1)F)Br 7a_100000755031_100015514636 [0,2,0,0,0,0|1,0,1]=4 11666 B12R1.385 C=CCOc1ccc(c(c1)F)C 34a_100000722560_100015514636 [0,2,0,0,0,0|1,0,1]=4 11667 B12R1.385 C=CCOc1ccc(c(c1)F)C 7a_100000722560_100015514636 [0,2,0,0,0,0|1,0,1]=4 11668 B12R1.385 C=CCOc1ccc(c(c1)F)Cl 34a_100000691581_100015514636 [0,2,0,0,0,0|1,0,1]=4 11669 B12R1.385 C=CCOc1ccc(c(c1)F)Cl 7a_100000691581_100015514636 [0,2,0,0,0,0|1,0,1]=4 11670 B12R1.385 C=CCOc1ccc(c(c1)F)F 34a_100000181275_100015514636 [0,2,0,0,0,0|1,0,1]=4 11671 B12R1.385 C=CCOc1ccc(c(c1)F)F 7a_100000181275_100015514636 [0,2,0,0,0,0|1,0,1]=4 11672 B12R1.385 C=CCOc1ccc(c(c1)F)I 34a_100009990212_100015514636 [0,2,0,0,0,0|1,0,1]=4 11673 B12R1.385 C=CCOc1ccc(c(c1)F)I 7a_100009990212_100015514636 [0,2,0,0,0,0|1,0,1]=4 11674 B12R1.385 C=CCOc1ccc(c(c1)F)N 34a_100000759473_100015514636 [0,2,0,0,0,0|1,0,1]=4 11675 B12R1.385 C=CCOc1ccc(c(c1)F)N 7a_100000759473_100015514636 [0,2,0,0,0,0|1,0,1]=4 11676 B12R1.385 C=CCOc1ccc(c(c1)I)Br 34a_100012339312_100015514636 [0,2,0,0,0,0|1,0,1]=4 11677 B12R1.385 C=CCOc1ccc(c(c1)I)Br 7a_100012339312_100015514636 [0,2,0,0,0,0|1,0,1]=4 11678 B12R1.385 C=CCOc1ccc(c(c1)I)Cl 34a_100000049588_100015514636 [0,2,0,0,0,0|1,0,1]=4 11679 B12R1.385 C=CCOc1ccc(c(c1)I)Cl 7a_100000049588_100015514636 [0,2,0,0,0,0|1,0,1]=4 11680 B12R1.385 C=CCOc1ccc(c(c1)I)N 34a_100010084370_100015514636 [0,2,0,0,0,0|1,0,1]=4 11681 B12R1.385 C=CCOc1ccc(c(c1)I)N 7a_100010084370_100015514636 [0,2,0,0,0,0|1,0,1]=4 11682 B12R1.385 C=CCOc1ccc(c(c1)N)Br 34a_100011999798_100015514636 [0,2,0,0,0,0|1,0,1]=4 11683 B12R1.385 C=CCOc1ccc(c(c1)N)Br 7a_100011999798_100015514636 [0,2,0,0,0,0|1,0,1]=4 11684 B12R1.385 C=CCOc1ccc(c(c1)N)C 34a_100011216113_100015514636 [0,2,0,0,0,0|1,0,1]=4 11685 B12R1.385 C=CCOc1ccc(c(c1)N)C 7a_100011216113_100015514636 [0,2,0,0,0,0|1,0,1]=4 11686 B12R1.385 C=CCOc1ccc(c(c1)N)Cl 34a_100011934297_100015514636 [0,2,0,0,0,0|1,0,1]=4 11687 B12R1.385 C=CCOc1ccc(c(c1)N)F 34a_100012017239_100015514636 [0,2,0,0,0,0|1,0,1]=4 11688 B12R1.385 C=CCOc1ccc(c(c1)N)F 7a_100012017239_100015514636 [0,2,0,0,0,0|1,0,1]=4 11689 B12R1.385 C=CCOc1ccc(c(c1)N)N 34a_100025771000_100015514636 [0,2,0,0,0,0|1,0,1]=4 11690 B12R1.385 C=CCSc1ccc(c(c1)Br)O 62a_100000210623_100012361655 [0,2,0,0,0,0|0,1,1]=4 11691 B12R1.385 C=CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210623 [0,2,0,0,0,0|0,1,1]=4 11692 B12R1.385 C=CCSc1ccc(c(c1)C)O 62a_100000210623_100000186361 [0,2,0,0,0,0|0,1,1]=4 11693 B12R1.385 C=CCSc1ccc(c(c1)Cl)O 62a_100000210623_100012360047 [0,2,0,0,0,0|0,1,1]=4 11694 B12R1.385 C=CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210623 [0,2,0,0,0,0|0,1,1]=4 11695 B12R1.385 C=CCSc1ccc(c(c1)F)O 62a_100000185481_100000210623 [0,2,0,0,0,0|0,1,1]=4 11696 B12R1.385 C=CCSc1ccc(c(c1)F)O 62a_100000210623_100000185481 [0,2,0,0,0,0|0,1,1]=4 11697 B12R1.385 C=CCSc1ccc(c(c1)N)O 62a_100000210623_100000752626 [0,2,0,0,0,0|0,1,1]=4 11698 B12R1.385 C=CCSc1ccc(c(c1)N)O 62a_100000752626_100000210623 [0,2,0,0,0,0|0,1,1]=4 11699 B12R1.385 C=CCSc1ccc(c(c1)O)O 62a_100000210623_100009813601 [0,2,0,0,0,0|0,1,1]=4 11700 B12R1.385 CCCCc1cc(c(cn1)O)C 271570a_100020621405_100000692680 [0,2,0,0,0,0|2,0,0]=4 11701 B12R1.385 CCCCc1cc(c(cn1)O)N 271570a_100020621405_100009819941 [0,2,0,0,0,0|2,0,0]=4 11702 B12R1.385 CCCCc1ccc(c(c1)Br)Br 271570a_100020621405_100012356285 [0,2,0,0,0,0|2,0,0]=4 11703 B12R1.385 CCCCc1ccc(c(c1)Br)C 271570a_100020621405_100011847877 [0,2,0,0,0,0|2,0,0]=4 11704 B12R1.385 CCCCc1ccc(c(c1)Br)Cl 271570a_100020621405_100012353702 [0,2,0,0,0,0|2,0,0]=4 11705 B12R1.385 CCCCc1ccc(c(c1)Br)F 271570a_100020621405_100012047266 [0,2,0,0,0,0|2,0,0]=4 11706 B12R1.385 CCCCc1ccc(c(c1)Br)N 271570a_100020621405_100000750455 [0,2,0,0,0,0|2,0,0]=4 11707 B12R1.385 CCCCc1ccc(c(c1)Br)O 271570a_100020621405_100012361655 [0,2,0,0,0,0|1,0,0]=3 11708 B12R1.385 CCCCc1ccc(c(c1)C)Br 271570a_100020621405_100009813585 [0,2,0,0,0,0|2,0,0]=4 11709 B12R1.385 CCCCc1ccc(c(c1)C)C 271570a_100020621405_100011215607 [0,2,0,0,0,0|2,0,0]=4 11710 B12R1.385 CCCCc1ccc(c(c1)C)Cl 271570a_100020621405_100000049509 [0,2,0,0,0,0|2,0,0]=4 11711 B12R1.385 CCCCc1ccc(c(c1)C)F 271570a_100020621405_100011218330 [0,2,0,0,0,0|2,0,0]=4 11712 B12R1.385 CCCCc1ccc(c(c1)C)N 271570a_100020621405_100000211769 [0,2,0,0,0,0|2,0,0]=4 11713 B12R1.385 CCCCc1ccc(c(c1)C)O 271570a_100020621405_100000186361 [0,2,0,0,0,0|1,0,0]=3 11714 B12R1.385 CCCCc1ccc(c(c1)Cl)Br 271570a_100020621405_100012047281 [0,2,0,0,0,0|2,0,0]=4 11715 B12R1.385 CCCCc1ccc(c(c1)Cl)C 271570a_100020621405_100011216363 [0,2,0,0,0,0|2,0,0]=4 11716 B12R1.385 CCCCc1ccc(c(c1)Cl)Cl 271570a_100020621405_100011214914 [0,2,0,0,0,0|2,0,0]=4 11717 B12R1.385 CCCCc1ccc(c(c1)Cl)F 271570a_100020621405_100011215976 [0,2,0,0,0,0|2,0,0]=4 11718 B12R1.385 CCCCc1ccc(c(c1)Cl)N 271570a_100020621405_100011218065 [0,2,0,0,0,0|2,0,0]=4 11719 B12R1.385 CCCCc1ccc(c(c1)Cl)O 271570a_100020621405_100012360047 [0,2,0,0,0,0|1,0,0]=3 11720 B12R1.385 CCCCc1ccc(c(c1)F)Br 271570a_100020621405_100000685389 [0,2,0,0,0,0|2,0,0]=4 11721 B12R1.385 CCCCc1ccc(c(c1)F)C 271570a_100020621405_100000720648 [0,2,0,0,0,0|2,0,0]=4 11722 B12R1.385 CCCCc1ccc(c(c1)F)Cl 271570a_100020621405_100011216805 [0,2,0,0,0,0|2,0,0]=4 11723 B12R1.385 CCCCc1ccc(c(c1)F)F 271570a_100020621405_100000750028 [0,2,0,0,0,0|2,0,0]=4 11724 B12R1.385 CCCCc1ccc(c(c1)F)N 271570a_100020621405_100011215594 [0,2,0,0,0,0|2,0,0]=4 11725 B12R1.385 CCCCc1ccc(c(c1)F)O 271570a_100020621405_100000185481 [0,2,0,0,0,0|1,0,0]=3 11726 B12R1.385 CCCCc1ccc(c(c1)N)Br 271570a_100020621405_100000750456 [0,2,0,0,0,0|2,0,0]=4 11727 B12R1.385 CCCCc1ccc(c(c1)N)C 271570a_100020621405_100000761890 [0,2,0,0,0,0|2,0,0]=4 11728 B12R1.385 CCCCc1ccc(c(c1)N)Cl 271570a_100020621405_200000761891 [0,2,0,0,0,0|2,0,0]=4 11729 B12R1.385 CCCCc1ccc(c(c1)N)F 271570a_100020621405_100000740924 [0,2,0,0,0,0|2,0,0]=4 11730 B12R1.385 CCCCc1ccc(c(c1)N)N 271570a_100020621405_100000741789 [0,2,0,0,0,0|2,0,0]=4 11731 B12R1.385 CCCCc1ccc(c(c1)N)O 271570a_100020621405_100000752626 [0,2,0,0,0,0|1,0,0]=3 11732 B12R1.385 CCCCc1ccc(c(c1)O)Br 271570a_100020621405_100012356990 [0,2,0,0,0,0|2,0,0]=4 11733 B12R1.385 CCCCc1ccc(c(c1)O)C 271570a_100020621405_100000766334 [0,2,0,0,0,0|2,0,0]=4 11734 B12R1.385 CCCCc1ccc(c(c1)O)Cl 271570a_100020621405_100011356854 [0,2,0,0,0,0|2,0,0]=4 11735 B12R1.385 CCCCc1ccc(c(c1)O)F 271570a_100020621405_100000686035 [0,2,0,0,0,0|2,0,0]=4 11736 B12R1.385 CCCCc1ccc(c(c1)O)N 271570a_100020621405_100000739049 [0,2,0,0,0,0|2,0,0]=4 11737 B12R1.385 CCCCc1ccc(c(c1)O)O 271570a_100020621405_100009813601 [0,2,0,0,0,0|1,0,0]=3 11738 B12R1.385 CCCCc1ccc(c(n1)Br)O 271570a_100020621405_100000725334 [0,2,0,0,0,0|2,0,0]=4 11739 B12R1.385 CCCCc1ccc(c(n1)C)O 271570a_100020621405_100010233687 [0,2,0,0,0,0|2,0,0]=4 11740 B12R1.385 CCCCc1ccc(c(n1)Cl)O 271570a_100020621405_100000721234 [0,2,0,0,0,0|2,0,0]=4 11741 B12R1.385 CCCCc1ccc(c(n1)F)O 271570a_100020621405_100009819667 [0,2,0,0,0,0|2,0,0]=4 11742 B12R1.385 CCCCc1ccc(c(n1)N)O 271570a_100020621405_100000685527 [0,2,0,0,0,0|2,0,0]=4 11743 B12R1.385 CCCCc1cnc(c(c1)C)O 271570a_100020621405_100000685391 [0,2,0,0,0,0|2,0,0]=4 11744 B12R1.385 CCCCc1cnc(c(c1)Cl)O 271570a_100020621405_100010238531 [0,2,0,0,0,0|2,0,0]=4 11745 B12R1.385 CCCCc1cnc(c(c1)N)O 271570a_100020621405_100000743729 [0,2,0,0,0,0|2,0,0]=4 11746 B12R1.385 CCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210303 [0,2,0,0,0,0|2,0,0]=4 11747 B12R1.385 CCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210303 [0,2,0,0,0,0|2,0,0]=4 11748 B12R1.385 CCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210303 [0,2,0,0,0,0|2,0,0]=4 11749 B12R1.385 CCCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210303 [0,2,0,0,0,0|2,0,0]=4 11750 B12R1.385 CCCNc1ccc(c(c1)Br)C 34a_100000736455_100000210303 [0,2,0,0,0,0|2,0,0]=4 11751 B12R1.385 CCCNc1ccc(c(c1)Br)C 7a_100000736455_100000210303 [0,2,0,0,0,0|2,0,0]=4 11752 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210303 [0,2,0,0,0,0|2,0,0]=4 11753 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210303 [0,2,0,0,0,0|2,0,0]=4 11754 B12R1.385 CCCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210303 [0,2,0,0,0,0|2,0,0]=4 11755 B12R1.385 CCCNc1ccc(c(c1)Br)F 34a_100000760356_100000210303 [0,2,0,0,0,0|2,0,0]=4 11756 B12R1.385 CCCNc1ccc(c(c1)Br)F 7a_100000760356_100000210303 [0,2,0,0,0,0|2,0,0]=4 11757 B12R1.385 CCCNc1ccc(c(c1)Br)I 34a_100000750458_100000210303 [0,2,0,0,0,0|2,0,0]=4 11758 B12R1.385 CCCNc1ccc(c(c1)Br)O 34a_100011534360_100000210303 [0,2,0,0,0,0|1,0,0]=3 11759 B12R1.385 CCCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210303 [0,2,0,0,0,0|2,0,0]=4 11760 B12R1.385 CCCNc1ccc(c(c1)C)Br 34a_100000210723_100000210303 [0,2,0,0,0,0|2,0,0]=4 11761 B12R1.385 CCCNc1ccc(c(c1)C)Br 7a_100000210723_100000210303 [0,2,0,0,0,0|2,0,0]=4 11762 B12R1.385 CCCNc1ccc(c(c1)C)C 2230a_100000724040_100000210303 [0,2,0,0,0,0|2,0,0]=4 11763 B12R1.385 CCCNc1ccc(c(c1)C)C 34a_100000724040_100000210303 [0,2,0,0,0,0|2,0,0]=4 11764 B12R1.385 CCCNc1ccc(c(c1)C)C 7a_100000724040_100000210303 [0,2,0,0,0,0|2,0,0]=4 11765 B12R1.385 CCCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210303 [0,2,0,0,0,0|2,0,0]=4 11766 B12R1.385 CCCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210303 [0,2,0,0,0,0|2,0,0]=4 11767 B12R1.385 CCCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210303 [0,2,0,0,0,0|2,0,0]=4 11768 B12R1.385 CCCNc1ccc(c(c1)C)F 2230a_100000750164_100000210303 [0,2,0,0,0,0|2,0,0]=4 11769 B12R1.385 CCCNc1ccc(c(c1)C)F 34a_100000750164_100000210303 [0,2,0,0,0,0|2,0,0]=4 11770 B12R1.385 CCCNc1ccc(c(c1)C)F 7a_100000750164_100000210303 [0,2,0,0,0,0|2,0,0]=4 11771 B12R1.385 CCCNc1ccc(c(c1)C)I 34a_100000198070_100000210303 [0,2,0,0,0,0|2,0,0]=4 11772 B12R1.385 CCCNc1ccc(c(c1)C)I 7a_100000198070_100000210303 [0,2,0,0,0,0|2,0,0]=4 11773 B12R1.385 CCCNc1ccc(c(c1)C)O 34a_100011218179_100000210303 [0,2,0,0,0,0|1,0,0]=3 11774 B12R1.385 CCCNc1ccc(c(c1)C)O 7a_100011218179_100000210303 [0,2,0,0,0,0|1,0,0]=3 11775 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210303 [0,2,0,0,0,0|2,0,0]=4 11776 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210303 [0,2,0,0,0,0|2,0,0]=4 11777 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210303 [0,2,0,0,0,0|2,0,0]=4 11778 B12R1.385 CCCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210303 [0,2,0,0,0,0|2,0,0]=4 11779 B12R1.385 CCCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210303 [0,2,0,0,0,0|2,0,0]=4 11780 B12R1.385 CCCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210303 [0,2,0,0,0,0|2,0,0]=4 11781 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210303 [0,2,0,0,0,0|2,0,0]=4 11782 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210303 [0,2,0,0,0,0|2,0,0]=4 11783 B12R1.385 CCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210303 [0,2,0,0,0,0|2,0,0]=4 11784 B12R1.385 CCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210303 [0,2,0,0,0,0|2,0,0]=4 11785 B12R1.385 CCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210303 [0,2,0,0,0,0|2,0,0]=4 11786 B12R1.385 CCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210303 [0,2,0,0,0,0|2,0,0]=4 11787 B12R1.385 CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210303 [0,2,0,0,0,0|1,0,0]=3 11788 B12R1.385 CCCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210303 [0,2,0,0,0,0|2,0,0]=4 11789 B12R1.385 CCCNc1ccc(c(c1)F)Br 34a_100000759894_100000210303 [0,2,0,0,0,0|2,0,0]=4 11790 B12R1.385 CCCNc1ccc(c(c1)F)Br 7a_100000759894_100000210303 [0,2,0,0,0,0|2,0,0]=4 11791 B12R1.385 CCCNc1ccc(c(c1)F)C 2230a_100000210958_100000210303 [0,2,0,0,0,0|2,0,0]=4 11792 B12R1.385 CCCNc1ccc(c(c1)F)C 34a_100000210958_100000210303 [0,2,0,0,0,0|2,0,0]=4 11793 B12R1.385 CCCNc1ccc(c(c1)F)C 7a_100000210958_100000210303 [0,2,0,0,0,0|2,0,0]=4 11794 B12R1.385 CCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210303 [0,2,0,0,0,0|2,0,0]=4 11795 B12R1.385 CCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210303 [0,2,0,0,0,0|2,0,0]=4 11796 B12R1.385 CCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210303 [0,2,0,0,0,0|2,0,0]=4 11797 B12R1.385 CCCNc1ccc(c(c1)F)F 2230a_100000210724_100000210303 [0,2,0,0,0,0|2,0,0]=4 11798 B12R1.385 CCCNc1ccc(c(c1)F)F 34a_100000210724_100000210303 [0,2,0,0,0,0|2,0,0]=4 11799 B12R1.385 CCCNc1ccc(c(c1)F)F 7a_100000210724_100000210303 [0,2,0,0,0,0|2,0,0]=4 11800 B12R1.385 CCCNc1ccc(c(c1)F)I 34a_100011356925_100000210303 [0,2,0,0,0,0|2,0,0]=4 11801 B12R1.385 CCCNc1ccc(c(c1)F)I 7a_100011356925_100000210303 [0,2,0,0,0,0|2,0,0]=4 11802 B12R1.385 CCCNc1ccc(c(c1)F)O 34a_100011220035_100000210303 [0,2,0,0,0,0|1,0,0]=3 11803 B12R1.385 CCCNc1ccc(c(c1)F)O 7a_100011220035_100000210303 [0,2,0,0,0,0|1,0,0]=3 11804 B12R1.385 CCCNc1ccc(c(c1)I)Br 34a_100000750459_100000210303 [0,2,0,0,0,0|2,0,0]=4 11805 B12R1.385 CCCNc1ccc(c(c1)I)C 34a_100000184131_100000210303 [0,2,0,0,0,0|2,0,0]=4 11806 B12R1.385 CCCNc1ccc(c(c1)I)C 7a_100000184131_100000210303 [0,2,0,0,0,0|2,0,0]=4 11807 B12R1.385 CCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210303 [0,2,0,0,0,0|2,0,0]=4 11808 B12R1.385 CCCNc1ccc(c(c1)I)F 34a_114828291077_100000210303 [0,2,0,0,0,0|2,0,0]=4 11809 B12R1.385 CCCNc1ccc(c(c1)I)F 7a_114828291077_100000210303 [0,2,0,0,0,0|2,0,0]=4 11810 B12R1.385 CCCNc1ccc(c(c1)O)C 34a_100000759471_100000210303 [0,2,0,0,0,0|2,0,0]=4 11811 B12R1.385 CCCNc1ccc(c(c1)O)C 7a_100000759471_100000210303 [0,2,0,0,0,0|2,0,0]=4 11812 B12R1.385 CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210303 [0,2,0,0,0,0|2,0,0]=4 11813 B12R1.385 CCCNc1ccc(c(c1)O)F 34a_100012017398_100000210303 [0,2,0,0,0,0|2,0,0]=4 11814 B12R1.385 CCCNc1ccc(c(c1)O)F 7a_100012017398_100000210303 [0,2,0,0,0,0|2,0,0]=4 11815 B12R1.385 CCCNc1ccc(c(c1)O)O 34a_100102946323_100000210303 [0,2,0,0,0,0|1,0,0]=3 11816 B12R1.385 CCCOc1cc(c(cn1)Br)C 34a_100000766222_100000210303 [0,2,0,0,0,0|2,0,0]=4 11817 B12R1.385 CCCOc1cc(c(cn1)Br)Cl 34a_100010369989_100000210303 [0,2,0,0,0,0|2,0,0]=4 11818 B12R1.385 CCCOc1cc(c(cn1)C)Br 34a_100009831917_100000210303 [0,2,0,0,0,0|2,0,0]=4 11819 B12R1.385 CCCOc1cc(c(cn1)Cl)C 34a_200000085746_100000210303 [0,2,0,0,0,0|2,0,0]=4 11820 B12R1.385 CCCOc1cc(c(cn1)Cl)Cl 34a_200000099200_100000210303 [0,2,0,0,0,0|2,0,0]=4 11821 B12R1.385 CCCOc1ccc(c(c1)Br)C 34a_100011380479_100000210303 [0,2,0,0,0,0|1,0,0]=3 11822 B12R1.385 CCCOc1ccc(c(c1)Br)C 7a_100011380479_100000210303 [0,2,0,0,0,0|1,0,0]=3 11823 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210303 [0,2,0,0,0,0|1,0,0]=3 11824 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210303 [0,2,0,0,0,0|1,0,0]=3 11825 B12R1.385 CCCOc1ccc(c(c1)Br)F 34a_100000693481_100000210303 [0,2,0,0,0,0|1,0,0]=3 11826 B12R1.385 CCCOc1ccc(c(c1)Br)F 7a_100000693481_100000210303 [0,2,0,0,0,0|1,0,0]=3 11827 B12R1.385 CCCOc1ccc(c(c1)Br)I 34a_100000701344_100000210303 [0,2,0,0,0,0|1,0,0]=3 11828 B12R1.385 CCCOc1ccc(c(c1)Br)I 7a_100000701344_100000210303 [0,2,0,0,0,0|1,0,0]=3 11829 B12R1.385 CCCOc1ccc(c(c1)Br)N 34a_100012001276_100000210303 [0,2,0,0,0,0|1,0,0]=3 11830 B12R1.385 CCCOc1ccc(c(c1)Br)N 7a_100012001276_100000210303 [0,2,0,0,0,0|1,0,0]=3 11831 B12R1.385 CCCOc1ccc(c(c1)C)Br 34a_100000690111_100000210303 [0,2,0,0,0,0|1,0,0]=3 11832 B12R1.385 CCCOc1ccc(c(c1)C)Br 7a_100000690111_100000210303 [0,2,0,0,0,0|1,0,0]=3 11833 B12R1.385 CCCOc1ccc(c(c1)C)C 34a_100000210932_100000210303 [0,2,0,0,0,0|1,0,0]=3 11834 B12R1.385 CCCOc1ccc(c(c1)C)C 7a_100000210932_100000210303 [0,2,0,0,0,0|1,0,0]=3 11835 B12R1.385 CCCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210303 [0,2,0,0,0,0|1,0,0]=3 11836 B12R1.385 CCCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210303 [0,2,0,0,0,0|1,0,0]=3 11837 B12R1.385 CCCOc1ccc(c(c1)C)F 34a_100000751312_100000210303 [0,2,0,0,0,0|1,0,0]=3 11838 B12R1.385 CCCOc1ccc(c(c1)C)F 7a_100000751312_100000210303 [0,2,0,0,0,0|1,0,0]=3 11839 B12R1.385 CCCOc1ccc(c(c1)C)I 34a_100000729255_100000210303 [0,2,0,0,0,0|1,0,0]=3 11840 B12R1.385 CCCOc1ccc(c(c1)C)I 7a_100000729255_100000210303 [0,2,0,0,0,0|1,0,0]=3 11841 B12R1.385 CCCOc1ccc(c(c1)C)N 34a_100000756630_100000210303 [0,2,0,0,0,0|1,0,0]=3 11842 B12R1.385 CCCOc1ccc(c(c1)C)N 7a_100000756630_100000210303 [0,2,0,0,0,0|1,0,0]=3 11843 B12R1.385 CCCOc1ccc(c(c1)C)O 271570a_203496583355_200012361509 [0,2,0,0,0,0|0,0,0]=2 11844 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210303 [0,2,0,0,0,0|1,0,0]=3 11845 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210303 [0,2,0,0,0,0|1,0,0]=3 11846 B12R1.385 CCCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210303 [0,2,0,0,0,0|1,0,0]=3 11847 B12R1.385 CCCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210303 [0,2,0,0,0,0|1,0,0]=3 11848 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210303 [0,2,0,0,0,0|1,0,0]=3 11849 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210303 [0,2,0,0,0,0|1,0,0]=3 11850 B12R1.385 CCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210303 [0,2,0,0,0,0|1,0,0]=3 11851 B12R1.385 CCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210303 [0,2,0,0,0,0|1,0,0]=3 11852 B12R1.385 CCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210303 [0,2,0,0,0,0|1,0,0]=3 11853 B12R1.385 CCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210303 [0,2,0,0,0,0|1,0,0]=3 11854 B12R1.385 CCCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210303 [0,2,0,0,0,0|1,0,0]=3 11855 B12R1.385 CCCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210303 [0,2,0,0,0,0|1,0,0]=3 11856 B12R1.385 CCCOc1ccc(c(c1)F)Br 34a_100000755031_100000210303 [0,2,0,0,0,0|1,0,0]=3 11857 B12R1.385 CCCOc1ccc(c(c1)F)Br 7a_100000755031_100000210303 [0,2,0,0,0,0|1,0,0]=3 11858 B12R1.385 CCCOc1ccc(c(c1)F)C 34a_100000722560_100000210303 [0,2,0,0,0,0|1,0,0]=3 11859 B12R1.385 CCCOc1ccc(c(c1)F)C 7a_100000722560_100000210303 [0,2,0,0,0,0|1,0,0]=3 11860 B12R1.385 CCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210303 [0,2,0,0,0,0|1,0,0]=3 11861 B12R1.385 CCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210303 [0,2,0,0,0,0|1,0,0]=3 11862 B12R1.385 CCCOc1ccc(c(c1)F)F 34a_100000181275_100000210303 [0,2,0,0,0,0|1,0,0]=3 11863 B12R1.385 CCCOc1ccc(c(c1)F)F 7a_100000181275_100000210303 [0,2,0,0,0,0|1,0,0]=3 11864 B12R1.385 CCCOc1ccc(c(c1)F)I 34a_100009990212_100000210303 [0,2,0,0,0,0|1,0,0]=3 11865 B12R1.385 CCCOc1ccc(c(c1)F)I 7a_100009990212_100000210303 [0,2,0,0,0,0|1,0,0]=3 11866 B12R1.385 CCCOc1ccc(c(c1)F)N 34a_100000759473_100000210303 [0,2,0,0,0,0|1,0,0]=3 11867 B12R1.385 CCCOc1ccc(c(c1)F)N 7a_100000759473_100000210303 [0,2,0,0,0,0|1,0,0]=3 11868 B12R1.385 CCCOc1ccc(c(c1)F)O 271570a_203496583355_200012236930 [0,2,0,0,0,0|0,0,0]=2 11869 B12R1.385 CCCOc1ccc(c(c1)I)Br 34a_100012339312_100000210303 [0,2,0,0,0,0|1,0,0]=3 11870 B12R1.385 CCCOc1ccc(c(c1)I)Br 7a_100012339312_100000210303 [0,2,0,0,0,0|1,0,0]=3 11871 B12R1.385 CCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210303 [0,2,0,0,0,0|1,0,0]=3 11872 B12R1.385 CCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210303 [0,2,0,0,0,0|1,0,0]=3 11873 B12R1.385 CCCOc1ccc(c(c1)I)N 34a_100010084370_100000210303 [0,2,0,0,0,0|1,0,0]=3 11874 B12R1.385 CCCOc1ccc(c(c1)I)N 7a_100010084370_100000210303 [0,2,0,0,0,0|1,0,0]=3 11875 B12R1.385 CCCOc1ccc(c(c1)N)Br 34a_100011999798_100000210303 [0,2,0,0,0,0|1,0,0]=3 11876 B12R1.385 CCCOc1ccc(c(c1)N)Br 7a_100011999798_100000210303 [0,2,0,0,0,0|1,0,0]=3 11877 B12R1.385 CCCOc1ccc(c(c1)N)C 34a_100011216113_100000210303 [0,2,0,0,0,0|1,0,0]=3 11878 B12R1.385 CCCOc1ccc(c(c1)N)C 7a_100011216113_100000210303 [0,2,0,0,0,0|1,0,0]=3 11879 B12R1.385 CCCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210303 [0,2,0,0,0,0|1,0,0]=3 11880 B12R1.385 CCCOc1ccc(c(c1)N)F 34a_100012017239_100000210303 [0,2,0,0,0,0|1,0,0]=3 11881 B12R1.385 CCCOc1ccc(c(c1)N)F 7a_100012017239_100000210303 [0,2,0,0,0,0|1,0,0]=3 11882 B12R1.385 CCCOc1ccc(c(c1)N)N 34a_100025771000_100000210303 [0,2,0,0,0,0|1,0,0]=3 11883 B12R1.385 CCCOc1ccc(c(n1)C)Br 34a_100000691680_100000210303 [0,2,0,0,0,0|2,0,0]=4 11884 B12R1.385 CCCOc1ccc(c(n1)C)Cl 34a_200009863735_100000210303 [0,2,0,0,0,0|2,0,0]=4 11885 B12R1.385 CCCOc1ccc(c(n1)C)O 271570a_203496583355_200012343549 [0,2,0,0,0,0|1,0,0]=3 11886 B12R1.385 CCCOc1ccc(c(n1)F)Br 34a_100009879308_100000210303 [0,2,0,0,0,0|2,0,0]=4 11887 B12R1.385 CCCOc1cnc(c(c1)Br)C 34a_100009819603_100000210303 [0,2,0,0,0,0|2,0,0]=4 11888 B12R1.385 CCCOc1cnc(c(c1)Br)C 7a_100009819603_100000210303 [0,2,0,0,0,0|2,0,0]=4 11889 B12R1.385 CCCOc1cnc(c(c1)Br)Cl 34a_100012356455_100000210303 [0,2,0,0,0,0|2,0,0]=4 11890 B12R1.385 CCCOc1cnc(c(c1)Br)Cl 7a_100012356455_100000210303 [0,2,0,0,0,0|2,0,0]=4 11891 B12R1.385 CCCOc1cnc(c(c1)Br)F 34a_100009817267_100000210303 [0,2,0,0,0,0|2,0,0]=4 11892 B12R1.385 CCCOc1cnc(c(c1)Br)F 7a_100009817267_100000210303 [0,2,0,0,0,0|2,0,0]=4 11893 B12R1.385 CCCOc1cnc(c(c1)C)Br 34a_100012000486_100000210303 [0,2,0,0,0,0|2,0,0]=4 11894 B12R1.385 CCCOc1cnc(c(c1)C)Br 7a_100012000486_100000210303 [0,2,0,0,0,0|2,0,0]=4 11895 B12R1.385 CCCOc1cnc(c(c1)C)C 34a_100009854398_100000210303 [0,2,0,0,0,0|2,0,0]=4 11896 B12R1.385 CCCOc1cnc(c(c1)C)C 7a_100009854398_100000210303 [0,2,0,0,0,0|2,0,0]=4 11897 B12R1.385 CCCOc1cnc(c(c1)C)Cl 34a_100012002680_100000210303 [0,2,0,0,0,0|2,0,0]=4 11898 B12R1.385 CCCOc1cnc(c(c1)C)Cl 7a_100012002680_100000210303 [0,2,0,0,0,0|2,0,0]=4 11899 B12R1.385 CCCOc1cnc(c(c1)C)F 34a_100000094615_100000210303 [0,2,0,0,0,0|2,0,0]=4 11900 B12R1.385 CCCOc1cnc(c(c1)C)F 7a_100000094615_100000210303 [0,2,0,0,0,0|2,0,0]=4 11901 B12R1.385 CCCOc1cnc(c(c1)Cl)Br 34a_100010209684_100000210303 [0,2,0,0,0,0|2,0,0]=4 11902 B12R1.385 CCCOc1cnc(c(c1)Cl)Br 7a_100010209684_100000210303 [0,2,0,0,0,0|2,0,0]=4 11903 B12R1.385 CCCOc1cnc(c(c1)Cl)Cl 34a_100000094354_100000210303 [0,2,0,0,0,0|2,0,0]=4 11904 B12R1.385 CCCOc1cnc(c(c1)Cl)Cl 7a_100000094354_100000210303 [0,2,0,0,0,0|2,0,0]=4 11905 B12R1.385 CCCOc1cnc(c(c1)Cl)F 34a_100000087088_100000210303 [0,2,0,0,0,0|2,0,0]=4 11906 B12R1.385 CCCOc1cnc(c(c1)Cl)F 7a_100000087088_100000210303 [0,2,0,0,0,0|2,0,0]=4 11907 B12R1.385 CCCOc1cnc(c(c1)F)Cl 34a_100000063512_100000210303 [0,2,0,0,0,0|2,0,0]=4 11908 B12R1.385 CCCOc1cnc(c(c1)F)Cl 7a_100000063512_100000210303 [0,2,0,0,0,0|2,0,0]=4 11909 B12R1.385 CCCSc1cc(c(cn1)O)C 62a_100000210303_100000692680 [0,2,0,0,0,0|1,1,0]=4 11910 B12R1.385 CCCSc1cc(c(cn1)O)N 62a_100000210303_100009819941 [0,2,0,0,0,0|1,1,0]=4 11911 B12R1.385 CCCSc1cc(c(cn1)O)N 62a_100009819941_100000210303 [0,2,0,0,0,0|1,1,0]=4 11912 B12R1.385 CCCSc1ccc(c(c1)Br)Br 62a_100000210303_100012356285 [0,2,0,0,0,0|1,1,0]=4 11913 B12R1.385 CCCSc1ccc(c(c1)Br)Br 62a_100012356285_100000210303 [0,2,0,0,0,0|1,1,0]=4 11914 B12R1.385 CCCSc1ccc(c(c1)Br)C 62a_100000210303_100011847877 [0,2,0,0,0,0|1,1,0]=4 11915 B12R1.385 CCCSc1ccc(c(c1)Br)C 62a_100011847877_100000210303 [0,2,0,0,0,0|1,1,0]=4 11916 B12R1.385 CCCSc1ccc(c(c1)Br)Cl 62a_100000210303_100012353702 [0,2,0,0,0,0|1,1,0]=4 11917 B12R1.385 CCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210303 [0,2,0,0,0,0|1,1,0]=4 11918 B12R1.385 CCCSc1ccc(c(c1)Br)F 62a_100000210303_100012047266 [0,2,0,0,0,0|1,1,0]=4 11919 B12R1.385 CCCSc1ccc(c(c1)Br)F 62a_100012047266_100000210303 [0,2,0,0,0,0|1,1,0]=4 11920 B12R1.385 CCCSc1ccc(c(c1)Br)N 62a_100000210303_100000750455 [0,2,0,0,0,0|1,1,0]=4 11921 B12R1.385 CCCSc1ccc(c(c1)Br)N 62a_100000750455_100000210303 [0,2,0,0,0,0|1,1,0]=4 11922 B12R1.385 CCCSc1ccc(c(c1)Br)O 62a_100000210303_100012361655 [0,2,0,0,0,0|0,1,0]=3 11923 B12R1.385 CCCSc1ccc(c(c1)Br)O 62a_100012361655_100000210303 [0,2,0,0,0,0|0,1,0]=3 11924 B12R1.385 CCCSc1ccc(c(c1)C)Br 62a_100000210303_100009813585 [0,2,0,0,0,0|1,1,0]=4 11925 B12R1.385 CCCSc1ccc(c(c1)C)Br 62a_100009813585_100000210303 [0,2,0,0,0,0|1,1,0]=4 11926 B12R1.385 CCCSc1ccc(c(c1)C)C 62a_100000210303_100011215607 [0,2,0,0,0,0|1,1,0]=4 11927 B12R1.385 CCCSc1ccc(c(c1)C)C 62a_100011215607_100000210303 [0,2,0,0,0,0|1,1,0]=4 11928 B12R1.385 CCCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210303 [0,2,0,0,0,0|1,1,0]=4 11929 B12R1.385 CCCSc1ccc(c(c1)C)Cl 62a_100000210303_100000049509 [0,2,0,0,0,0|1,1,0]=4 11930 B12R1.385 CCCSc1ccc(c(c1)C)F 62a_100000210303_100011218330 [0,2,0,0,0,0|1,1,0]=4 11931 B12R1.385 CCCSc1ccc(c(c1)C)F 62a_100011218330_100000210303 [0,2,0,0,0,0|1,1,0]=4 11932 B12R1.385 CCCSc1ccc(c(c1)C)N 62a_100000210303_100000211769 [0,2,0,0,0,0|1,1,0]=4 11933 B12R1.385 CCCSc1ccc(c(c1)C)N 62a_100000211769_100000210303 [0,2,0,0,0,0|1,1,0]=4 11934 B12R1.385 CCCSc1ccc(c(c1)C)O 62a_100000210303_100000186361 [0,2,0,0,0,0|0,1,0]=3 11935 B12R1.385 CCCSc1ccc(c(c1)Cl)Br 62a_100000210303_100012047281 [0,2,0,0,0,0|1,1,0]=4 11936 B12R1.385 CCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210303 [0,2,0,0,0,0|1,1,0]=4 11937 B12R1.385 CCCSc1ccc(c(c1)Cl)C 62a_100000210303_100011216363 [0,2,0,0,0,0|1,1,0]=4 11938 B12R1.385 CCCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210303 [0,2,0,0,0,0|1,1,0]=4 11939 B12R1.385 CCCSc1ccc(c(c1)Cl)Cl 62a_100000210303_100011214914 [0,2,0,0,0,0|1,1,0]=4 11940 B12R1.385 CCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210303 [0,2,0,0,0,0|1,1,0]=4 11941 B12R1.385 CCCSc1ccc(c(c1)Cl)F 62a_100000210303_100011215976 [0,2,0,0,0,0|1,1,0]=4 11942 B12R1.385 CCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210303 [0,2,0,0,0,0|1,1,0]=4 11943 B12R1.385 CCCSc1ccc(c(c1)Cl)N 62a_100000210303_100011218065 [0,2,0,0,0,0|1,1,0]=4 11944 B12R1.385 CCCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210303 [0,2,0,0,0,0|1,1,0]=4 11945 B12R1.385 CCCSc1ccc(c(c1)Cl)O 62a_100000210303_100012360047 [0,2,0,0,0,0|0,1,0]=3 11946 B12R1.385 CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210303 [0,2,0,0,0,0|0,1,0]=3 11947 B12R1.385 CCCSc1ccc(c(c1)F)Br 62a_100000210303_100000685389 [0,2,0,0,0,0|1,1,0]=4 11948 B12R1.385 CCCSc1ccc(c(c1)F)Br 62a_100000685389_100000210303 [0,2,0,0,0,0|1,1,0]=4 11949 B12R1.385 CCCSc1ccc(c(c1)F)C 62a_100000210303_100000720648 [0,2,0,0,0,0|1,1,0]=4 11950 B12R1.385 CCCSc1ccc(c(c1)F)C 62a_100000720648_100000210303 [0,2,0,0,0,0|1,1,0]=4 11951 B12R1.385 CCCSc1ccc(c(c1)F)Cl 62a_100000210303_100011216805 [0,2,0,0,0,0|1,1,0]=4 11952 B12R1.385 CCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210303 [0,2,0,0,0,0|1,1,0]=4 11953 B12R1.385 CCCSc1ccc(c(c1)F)F 62a_100000210303_100000703953 [0,2,0,0,0,0|1,1,0]=4 11954 B12R1.385 CCCSc1ccc(c(c1)F)F 62a_100000703953_100000210303 [0,2,0,0,0,0|1,1,0]=4 11955 B12R1.385 CCCSc1ccc(c(c1)F)N 62a_100000210303_100011215594 [0,2,0,0,0,0|1,1,0]=4 11956 B12R1.385 CCCSc1ccc(c(c1)F)N 62a_100011215594_100000210303 [0,2,0,0,0,0|1,1,0]=4 11957 B12R1.385 CCCSc1ccc(c(c1)F)O 62a_100000185481_100000210303 [0,2,0,0,0,0|0,1,0]=3 11958 B12R1.385 CCCSc1ccc(c(c1)F)O 62a_100000210303_100000185481 [0,2,0,0,0,0|0,1,0]=3 11959 B12R1.385 CCCSc1ccc(c(c1)N)Br 62a_100000210303_100000750456 [0,2,0,0,0,0|1,1,0]=4 11960 B12R1.385 CCCSc1ccc(c(c1)N)Br 62a_100000750456_100000210303 [0,2,0,0,0,0|1,1,0]=4 11961 B12R1.385 CCCSc1ccc(c(c1)N)C 62a_100000210303_100000761890 [0,2,0,0,0,0|1,1,0]=4 11962 B12R1.385 CCCSc1ccc(c(c1)N)C 62a_100000761890_100000210303 [0,2,0,0,0,0|1,1,0]=4 11963 B12R1.385 CCCSc1ccc(c(c1)N)Cl 62a_100000210303_200000761891 [0,2,0,0,0,0|1,1,0]=4 11964 B12R1.385 CCCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210303 [0,2,0,0,0,0|1,1,0]=4 11965 B12R1.385 CCCSc1ccc(c(c1)N)F 62a_100000210303_100000740924 [0,2,0,0,0,0|1,1,0]=4 11966 B12R1.385 CCCSc1ccc(c(c1)N)F 62a_100000740924_100000210303 [0,2,0,0,0,0|1,1,0]=4 11967 B12R1.385 CCCSc1ccc(c(c1)N)N 62a_100000210303_100011534411 [0,2,0,0,0,0|1,1,0]=4 11968 B12R1.385 CCCSc1ccc(c(c1)N)N 62a_100000741789_100000210303 [0,2,0,0,0,0|1,1,0]=4 11969 B12R1.385 CCCSc1ccc(c(c1)N)O 62a_100000210303_100000752626 [0,2,0,0,0,0|0,1,0]=3 11970 B12R1.385 CCCSc1ccc(c(c1)N)O 62a_100000752626_100000210303 [0,2,0,0,0,0|0,1,0]=3 11971 B12R1.385 CCCSc1ccc(c(c1)O)Br 62a_100000210303_100012356990 [0,2,0,0,0,0|1,1,0]=4 11972 B12R1.385 CCCSc1ccc(c(c1)O)Br 62a_100012356990_100000210303 [0,2,0,0,0,0|1,1,0]=4 11973 B12R1.385 CCCSc1ccc(c(c1)O)C 62a_100000210303_100000685420 [0,2,0,0,0,0|1,1,0]=4 11974 B12R1.385 CCCSc1ccc(c(c1)O)C 62a_100000685420_100000210303 [0,2,0,0,0,0|1,1,0]=4 11975 B12R1.385 CCCSc1ccc(c(c1)O)Cl 62a_100000210303_100011356854 [0,2,0,0,0,0|1,1,0]=4 11976 B12R1.385 CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210303 [0,2,0,0,0,0|1,1,0]=4 11977 B12R1.385 CCCSc1ccc(c(c1)O)F 62a_100000210303_100000686035 [0,2,0,0,0,0|1,1,0]=4 11978 B12R1.385 CCCSc1ccc(c(c1)O)F 62a_100000686035_100000210303 [0,2,0,0,0,0|1,1,0]=4 11979 B12R1.385 CCCSc1ccc(c(c1)O)N 62a_100000210303_100000739049 [0,2,0,0,0,0|1,1,0]=4 11980 B12R1.385 CCCSc1ccc(c(c1)O)N 62a_100000739049_100000210303 [0,2,0,0,0,0|1,1,0]=4 11981 B12R1.385 CCCSc1ccc(c(c1)O)O 62a_100000210303_100009813601 [0,2,0,0,0,0|0,1,0]=3 11982 B12R1.385 CCCSc1ccc(c(n1)Br)O 62a_100000210303_100000725334 [0,2,0,0,0,0|1,1,0]=4 11983 B12R1.385 CCCSc1ccc(c(n1)Br)O 62a_100000725334_100000210303 [0,2,0,0,0,0|1,1,0]=4 11984 B12R1.385 CCCSc1ccc(c(n1)C)O 62a_100000210303_100010233687 [0,2,0,0,0,0|1,1,0]=4 11985 B12R1.385 CCCSc1ccc(c(n1)C)O 62a_100010233687_100000210303 [0,2,0,0,0,0|1,1,0]=4 11986 B12R1.385 CCCSc1ccc(c(n1)Cl)O 62a_100000210303_100000721234 [0,2,0,0,0,0|1,1,0]=4 11987 B12R1.385 CCCSc1ccc(c(n1)F)O 62a_100000210303_100009819667 [0,2,0,0,0,0|1,1,0]=4 11988 B12R1.385 CCCSc1ccc(c(n1)F)O 62a_100009819667_100000210303 [0,2,0,0,0,0|1,1,0]=4 11989 B12R1.385 CCCSc1ccc(c(n1)N)O 62a_100000210303_100000685527 [0,2,0,0,0,0|1,1,0]=4 11990 B12R1.385 CCCSc1ccc(c(n1)N)O 62a_100000685527_100000210303 [0,2,0,0,0,0|1,1,0]=4 11991 B12R1.385 CCCSc1cnc(c(c1)C)O 62a_100000210303_100000685391 [0,2,0,0,0,0|1,1,0]=4 11992 B12R1.385 CCCSc1cnc(c(c1)C)O 62a_100000685391_100000210303 [0,2,0,0,0,0|1,1,0]=4 11993 B12R1.385 CCCSc1cnc(c(c1)Cl)O 62a_100000210303_100010238531 [0,2,0,0,0,0|1,1,0]=4 11994 B12R1.385 CCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210303 [0,2,0,0,0,0|1,1,0]=4 11995 B12R1.385 CCCSc1cnc(c(c1)N)O 62a_100000210303_100000743729 [0,2,0,0,0,0|1,1,0]=4 11996 B12R1.385 CCCSc1cnc(c(c1)N)O 62a_100000743729_100000210303 [0,2,0,0,0,0|1,1,0]=4 11997 B12R1.385 CCNCc1cc(=O)c(co1)O 2230a_100015525214_100000010605 [0,2,0,0,0,0|2,0,0]=4 11998 B12R1.385 CCNCc1ccc(c(c1)Br)Br 207a_100015525214_100011215943 [0,2,0,0,0,0|2,0,0]=4 11999 B12R1.385 CCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000210202 [0,2,0,0,0,0|2,0,0]=4 12000 B12R1.385 CCNCc1ccc(c(c1)Br)Br 2230a_100015525214_100012353900 [0,2,0,0,0,0|2,0,0]=4 12001 B12R1.385 CCNCc1ccc(c(c1)Br)Br 270004a_100015525214_100011215943 [0,2,0,0,0,0|2,0,0]=4 12002 B12R1.385 CCNCc1ccc(c(c1)Br)Br 34a_100012351559_100000210202 [0,2,0,0,0,0|2,0,0]=4 12003 B12R1.385 CCNCc1ccc(c(c1)Br)C 207a_100015525214_100000695567 [0,2,0,0,0,0|2,0,0]=4 12004 B12R1.385 CCNCc1ccc(c(c1)Br)C 2230a_100015525214_100012232412 [0,2,0,0,0,0|2,0,0]=4 12005 B12R1.385 CCNCc1ccc(c(c1)Br)C 270004a_100015525214_100000695567 [0,2,0,0,0,0|2,0,0]=4 12006 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 207a_100015525214_100000693810 [0,2,0,0,0,0|2,0,0]=4 12007 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000210202 [0,2,0,0,0,0|2,0,0]=4 12008 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 2230a_100015525214_100012353894 [0,2,0,0,0,0|2,0,0]=4 12009 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 270004a_100015525214_100000693810 [0,2,0,0,0,0|2,0,0]=4 12010 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000210202 [0,2,0,0,0,0|2,0,0]=4 12011 B12R1.385 CCNCc1ccc(c(c1)Br)F 207a_100015525214_100000211747 [0,2,0,0,0,0|2,0,0]=4 12012 B12R1.385 CCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000210202 [0,2,0,0,0,0|2,0,0]=4 12013 B12R1.385 CCNCc1ccc(c(c1)Br)F 2230a_100015525214_100011206884 [0,2,0,0,0,0|2,0,0]=4 12014 B12R1.385 CCNCc1ccc(c(c1)Br)F 270004a_100015525214_100000211747 [0,2,0,0,0,0|2,0,0]=4 12015 B12R1.385 CCNCc1ccc(c(c1)Br)F 34a_100015193890_100000210202 [0,2,0,0,0,0|2,0,0]=4 12016 B12R1.385 CCNCc1ccc(c(c1)C)Br 207a_100015525214_100000765772 [0,2,0,0,0,0|2,0,0]=4 12017 B12R1.385 CCNCc1ccc(c(c1)C)Br 2230a_100015205234_100000210202 [0,2,0,0,0,0|2,0,0]=4 12018 B12R1.385 CCNCc1ccc(c(c1)C)Br 2230a_100015525214_100000727479 [0,2,0,0,0,0|2,0,0]=4 12019 B12R1.385 CCNCc1ccc(c(c1)C)Br 270004a_100015525214_100000765772 [0,2,0,0,0,0|2,0,0]=4 12020 B12R1.385 CCNCc1ccc(c(c1)C)Br 34a_100015205234_100000210202 [0,2,0,0,0,0|2,0,0]=4 12021 B12R1.385 CCNCc1ccc(c(c1)C)C 207a_100015525214_100000229942 [0,2,0,0,0,0|2,0,0]=4 12022 B12R1.385 CCNCc1ccc(c(c1)C)C 2230a_100015525214_100000742320 [0,2,0,0,0,0|2,0,0]=4 12023 B12R1.385 CCNCc1ccc(c(c1)C)C 2230a_100025706692_100000210202 [0,2,0,0,0,0|2,0,0]=4 12024 B12R1.385 CCNCc1ccc(c(c1)C)C 270004a_100015525214_100000229942 [0,2,0,0,0,0|2,0,0]=4 12025 B12R1.385 CCNCc1ccc(c(c1)C)C 34a_100025706692_100000210202 [0,2,0,0,0,0|2,0,0]=4 12026 B12R1.385 CCNCc1ccc(c(c1)C)Cl 207a_100015525214_100000698814 [0,2,0,0,0,0|2,0,0]=4 12027 B12R1.385 CCNCc1ccc(c(c1)C)Cl 2230a_100015525214_100012184735 [0,2,0,0,0,0|2,0,0]=4 12028 B12R1.385 CCNCc1ccc(c(c1)C)Cl 270004a_100015525214_100000698814 [0,2,0,0,0,0|2,0,0]=4 12029 B12R1.385 CCNCc1ccc(c(c1)C)F 207a_100015525214_100000748208 [0,2,0,0,0,0|2,0,0]=4 12030 B12R1.385 CCNCc1ccc(c(c1)C)F 2230a_100000239911_100000210202 [0,2,0,0,0,0|2,0,0]=4 12031 B12R1.385 CCNCc1ccc(c(c1)C)F 2230a_100015525214_100011216667 [0,2,0,0,0,0|2,0,0]=4 12032 B12R1.385 CCNCc1ccc(c(c1)C)F 270004a_100015525214_100000748208 [0,2,0,0,0,0|2,0,0]=4 12033 B12R1.385 CCNCc1ccc(c(c1)C)F 34a_100000239911_100000210202 [0,2,0,0,0,0|2,0,0]=4 12034 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 207a_100015525214_100000690054 [0,2,0,0,0,0|2,0,0]=4 12035 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000210202 [0,2,0,0,0,0|2,0,0]=4 12036 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 2230a_100015525214_100012353895 [0,2,0,0,0,0|2,0,0]=4 12037 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 270004a_100015525214_100000690054 [0,2,0,0,0,0|2,0,0]=4 12038 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100000210202 [0,2,0,0,0,0|2,0,0]=4 12039 B12R1.385 CCNCc1ccc(c(c1)Cl)C 207a_100015525214_100000760539 [0,2,0,0,0,0|2,0,0]=4 12040 B12R1.385 CCNCc1ccc(c(c1)Cl)C 2230a_100015525214_100011823929 [0,2,0,0,0,0|2,0,0]=4 12041 B12R1.385 CCNCc1ccc(c(c1)Cl)C 2230a_102495364989_100000210202 [0,2,0,0,0,0|2,0,0]=4 12042 B12R1.385 CCNCc1ccc(c(c1)Cl)C 270004a_100015525214_100000760539 [0,2,0,0,0,0|2,0,0]=4 12043 B12R1.385 CCNCc1ccc(c(c1)Cl)C 34a_102495364989_100000210202 [0,2,0,0,0,0|2,0,0]=4 12044 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 207a_100015525214_100000188533 [0,2,0,0,0,0|2,0,0]=4 12045 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000210202 [0,2,0,0,0,0|2,0,0]=4 12046 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 2230a_100015525214_100000184707 [0,2,0,0,0,0|2,0,0]=4 12047 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 270004a_100015525214_100000188533 [0,2,0,0,0,0|2,0,0]=4 12048 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000210202 [0,2,0,0,0,0|2,0,0]=4 12049 B12R1.385 CCNCc1ccc(c(c1)Cl)F 207a_100015525214_100000742290 [0,2,0,0,0,0|2,0,0]=4 12050 B12R1.385 CCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000210202 [0,2,0,0,0,0|2,0,0]=4 12051 B12R1.385 CCNCc1ccc(c(c1)Cl)F 2230a_100015525214_100000717365 [0,2,0,0,0,0|2,0,0]=4 12052 B12R1.385 CCNCc1ccc(c(c1)Cl)F 270004a_100015525214_100000742290 [0,2,0,0,0,0|2,0,0]=4 12053 B12R1.385 CCNCc1ccc(c(c1)Cl)F 34a_100000749334_100000210202 [0,2,0,0,0,0|2,0,0]=4 12054 B12R1.385 CCNCc1ccc(c(c1)Cl)I 2230a_100015525214_100012349665 [0,2,0,0,0,0|2,0,0]=4 12055 B12R1.385 CCNCc1ccc(c(c1)F)Br 207a_100015525214_100000686674 [0,2,0,0,0,0|2,0,0]=4 12056 B12R1.385 CCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000210202 [0,2,0,0,0,0|2,0,0]=4 12057 B12R1.385 CCNCc1ccc(c(c1)F)Br 2230a_100015525214_100000767054 [0,2,0,0,0,0|2,0,0]=4 12058 B12R1.385 CCNCc1ccc(c(c1)F)Br 270004a_100015525214_100000686674 [0,2,0,0,0,0|2,0,0]=4 12059 B12R1.385 CCNCc1ccc(c(c1)F)Br 34a_100000755036_100000210202 [0,2,0,0,0,0|2,0,0]=4 12060 B12R1.385 CCNCc1ccc(c(c1)F)C 207a_100015525214_100000753222 [0,2,0,0,0,0|2,0,0]=4 12061 B12R1.385 CCNCc1ccc(c(c1)F)C 2230a_100015525214_100011217369 [0,2,0,0,0,0|2,0,0]=4 12062 B12R1.385 CCNCc1ccc(c(c1)F)C 2230a_100102708794_100000210202 [0,2,0,0,0,0|2,0,0]=4 12063 B12R1.385 CCNCc1ccc(c(c1)F)C 270004a_100015525214_100000753222 [0,2,0,0,0,0|2,0,0]=4 12064 B12R1.385 CCNCc1ccc(c(c1)F)C 34a_100102708794_100000210202 [0,2,0,0,0,0|2,0,0]=4 12065 B12R1.385 CCNCc1ccc(c(c1)F)Cl 207a_100015525214_100000745630 [0,2,0,0,0,0|2,0,0]=4 12066 B12R1.385 CCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000210202 [0,2,0,0,0,0|2,0,0]=4 12067 B12R1.385 CCNCc1ccc(c(c1)F)Cl 2230a_100015525214_100000716492 [0,2,0,0,0,0|2,0,0]=4 12068 B12R1.385 CCNCc1ccc(c(c1)F)Cl 270004a_100015525214_100000745630 [0,2,0,0,0,0|2,0,0]=4 12069 B12R1.385 CCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000210202 [0,2,0,0,0,0|2,0,0]=4 12070 B12R1.385 CCNCc1ccc(c(c1)F)F 207a_100015525214_100000211062 [0,2,0,0,0,0|2,0,0]=4 12071 B12R1.385 CCNCc1ccc(c(c1)F)F 2230a_100000737897_100000210202 [0,2,0,0,0,0|2,0,0]=4 12072 B12R1.385 CCNCc1ccc(c(c1)F)F 2230a_100015525214_100000757363 [0,2,0,0,0,0|2,0,0]=4 12073 B12R1.385 CCNCc1ccc(c(c1)F)F 270004a_100015525214_100000211062 [0,2,0,0,0,0|2,0,0]=4 12074 B12R1.385 CCNCc1ccc(c(c1)F)F 34a_100000737897_100000210202 [0,2,0,0,0,0|2,0,0]=4 12075 B12R1.385 CCNCc1ccc(c(c1)F)I 207a_100015525214_100000050832 [0,2,0,0,0,0|2,0,0]=4 12076 B12R1.385 CCNCc1ccc(c(c1)F)I 2230a_100015525214_100010149604 [0,2,0,0,0,0|2,0,0]=4 12077 B12R1.385 CCNCc1ccc(c(c1)F)I 270004a_100015525214_100000050832 [0,2,0,0,0,0|2,0,0]=4 12078 B12R1.385 CCNCc1ccc(c(c1)F)O 34a_100000758358_100000210202 [0,2,0,0,0,0|1,0,0]=3 12079 B12R1.385 CCNCc1ccc(c(c1)I)Br 207a_100015525214_100010146563 [0,2,0,0,0,0|2,0,0]=4 12080 B12R1.385 CCNCc1ccc(c(c1)I)Br 2230a_100015525214_100010146616 [0,2,0,0,0,0|2,0,0]=4 12081 B12R1.385 CCNCc1ccc(c(c1)I)Br 270004a_100015525214_100010146563 [0,2,0,0,0,0|2,0,0]=4 12082 B12R1.385 CCNCc1ccc(c(c1)I)C 207a_100015525214_100010197721 [0,2,0,0,0,0|2,0,0]=4 12083 B12R1.385 CCNCc1ccc(c(c1)I)C 2230a_100015525214_100010206137 [0,2,0,0,0,0|2,0,0]=4 12084 B12R1.385 CCNCc1ccc(c(c1)I)C 270004a_100015525214_100010197721 [0,2,0,0,0,0|2,0,0]=4 12085 B12R1.385 CCNCc1ccc(c(c1)I)Cl 207a_100015525214_100010209939 [0,2,0,0,0,0|2,0,0]=4 12086 B12R1.385 CCNCc1ccc(c(c1)I)Cl 270004a_100015525214_100010209939 [0,2,0,0,0,0|2,0,0]=4 12087 B12R1.385 CCNCc1ccc(c(c1)I)F 207a_100015525214_100010188209 [0,2,0,0,0,0|2,0,0]=4 12088 B12R1.385 CCNCc1ccc(c(c1)I)F 2230a_100015525214_100010188208 [0,2,0,0,0,0|2,0,0]=4 12089 B12R1.385 CCNCc1ccc(c(c1)I)F 270004a_100015525214_100010188209 [0,2,0,0,0,0|2,0,0]=4 12090 B12R1.385 CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210202 [0,2,0,0,0,0|2,0,0]=4 12091 B12R1.385 CCNCc1ccc(c(c1)O)F 34a_100160469508_100000210202 [0,2,0,0,0,0|2,0,0]=4 12092 B12R1.385 CCNCc1ccc(c(c1)O)O 34a_100000010075_100000210202 [0,2,0,0,0,0|1,0,0]=3 12093 B12R1.385 CCNCc1cnc(c(c1)Br)O 207a_100015525214_100010064886 [0,2,0,0,0,0|2,0,0]=4 12094 B12R1.385 CCNCc1cnc(c(c1)Br)O 270004a_100015525214_100010064886 [0,2,0,0,0,0|2,0,0]=4 12095 B12R1.385 CCOCc1cc(c(cn1)Br)C 34a_200010713146_100000210202 [0,2,0,0,0,0|2,0,0]=4 12096 B12R1.385 CCOCc1cc(c(cn1)C)Br 34a_100010113723_100000210202 [0,2,0,0,0,0|2,0,0]=4 12097 B12R1.385 CCOCc1cc(c(cn1)C)Br 7a_100010113723_100000210202 [0,2,0,0,0,0|2,0,0]=4 12098 B12R1.385 CCOCc1cc(c(cn1)C)Cl 34a_200000144627_100000210202 [0,2,0,0,0,0|2,0,0]=4 12099 B12R1.385 CCOCc1cc(c(cn1)C)Cl 7a_200000144627_100000210202 [0,2,0,0,0,0|2,0,0]=4 12100 B12R1.385 CCOCc1ccc(c(c1)Br)Br 34a_100121572206_100012353900 [0,2,0,0,0,0|1,0,0]=3 12101 B12R1.385 CCOCc1ccc(c(c1)Br)C 34a_100000708995_100000210202 [0,2,0,0,0,0|1,0,0]=3 12102 B12R1.385 CCOCc1ccc(c(c1)Br)C 34a_100121572206_100012232412 [0,2,0,0,0,0|1,0,0]=3 12103 B12R1.385 CCOCc1ccc(c(c1)Br)C 7a_100000708995_100000210202 [0,2,0,0,0,0|1,0,0]=3 12104 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100000210202 [0,2,0,0,0,0|1,0,0]=3 12105 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 34a_100121572206_100012353894 [0,2,0,0,0,0|1,0,0]=3 12106 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000210202 [0,2,0,0,0,0|1,0,0]=3 12107 B12R1.385 CCOCc1ccc(c(c1)Br)F 34a_100000246287_100000210202 [0,2,0,0,0,0|1,0,0]=3 12108 B12R1.385 CCOCc1ccc(c(c1)Br)F 34a_100121572206_100011206884 [0,2,0,0,0,0|1,0,0]=3 12109 B12R1.385 CCOCc1ccc(c(c1)Br)F 7a_100000246287_100000210202 [0,2,0,0,0,0|1,0,0]=3 12110 B12R1.385 CCOCc1ccc(c(c1)C)Br 34a_100000718852_100000210202 [0,2,0,0,0,0|1,0,0]=3 12111 B12R1.385 CCOCc1ccc(c(c1)C)Br 34a_100121572206_100000727479 [0,2,0,0,0,0|1,0,0]=3 12112 B12R1.385 CCOCc1ccc(c(c1)C)Br 7a_100000718852_100000210202 [0,2,0,0,0,0|1,0,0]=3 12113 B12R1.385 CCOCc1ccc(c(c1)C)C 34a_100011215342_100000210202 [0,2,0,0,0,0|1,0,0]=3 12114 B12R1.385 CCOCc1ccc(c(c1)C)C 34a_100121572206_100000742320 [0,2,0,0,0,0|1,0,0]=3 12115 B12R1.385 CCOCc1ccc(c(c1)C)C 7a_100011215342_100000210202 [0,2,0,0,0,0|1,0,0]=3 12116 B12R1.385 CCOCc1ccc(c(c1)C)Cl 34a_100121572206_100012184735 [0,2,0,0,0,0|1,0,0]=3 12117 B12R1.385 CCOCc1ccc(c(c1)C)F 34a_100011219793_100000210202 [0,2,0,0,0,0|1,0,0]=3 12118 B12R1.385 CCOCc1ccc(c(c1)C)F 34a_100121572206_100011216667 [0,2,0,0,0,0|1,0,0]=3 12119 B12R1.385 CCOCc1ccc(c(c1)C)F 7a_100011219793_100000210202 [0,2,0,0,0,0|1,0,0]=3 12120 B12R1.385 CCOCc1ccc(c(c1)C)N 34a_200011997030_100000210202 [0,2,0,0,0,0|1,0,0]=3 12121 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100000210202 [0,2,0,0,0,0|1,0,0]=3 12122 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 34a_100121572206_100012353895 [0,2,0,0,0,0|1,0,0]=3 12123 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100000210202 [0,2,0,0,0,0|1,0,0]=3 12124 B12R1.385 CCOCc1ccc(c(c1)Cl)C 34a_100011290783_100000210202 [0,2,0,0,0,0|1,0,0]=3 12125 B12R1.385 CCOCc1ccc(c(c1)Cl)C 34a_100121572206_100011823929 [0,2,0,0,0,0|1,0,0]=3 12126 B12R1.385 CCOCc1ccc(c(c1)Cl)C 7a_100011290783_100000210202 [0,2,0,0,0,0|1,0,0]=3 12127 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100000210202 [0,2,0,0,0,0|1,0,0]=3 12128 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 34a_100121572206_100000184707 [0,2,0,0,0,0|1,0,0]=3 12129 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000210202 [0,2,0,0,0,0|1,0,0]=3 12130 B12R1.385 CCOCc1ccc(c(c1)Cl)F 34a_100011217911_100000210202 [0,2,0,0,0,0|1,0,0]=3 12131 B12R1.385 CCOCc1ccc(c(c1)Cl)F 34a_100121572206_100011934319 [0,2,0,0,0,0|1,0,0]=3 12132 B12R1.385 CCOCc1ccc(c(c1)Cl)F 7a_100011217911_100000210202 [0,2,0,0,0,0|1,0,0]=3 12133 B12R1.385 CCOCc1ccc(c(c1)Cl)I 34a_100000718186_100000210202 [0,2,0,0,0,0|1,0,0]=3 12134 B12R1.385 CCOCc1ccc(c(c1)Cl)I 34a_100121572206_100012349665 [0,2,0,0,0,0|1,0,0]=3 12135 B12R1.385 CCOCc1ccc(c(c1)Cl)I 7a_100000718186_100000210202 [0,2,0,0,0,0|1,0,0]=3 12136 B12R1.385 CCOCc1ccc(c(c1)F)Br 34a_100011533735_100000210202 [0,2,0,0,0,0|1,0,0]=3 12137 B12R1.385 CCOCc1ccc(c(c1)F)Br 34a_100121572206_100000767054 [0,2,0,0,0,0|1,0,0]=3 12138 B12R1.385 CCOCc1ccc(c(c1)F)Br 7a_100011533735_100000210202 [0,2,0,0,0,0|1,0,0]=3 12139 B12R1.385 CCOCc1ccc(c(c1)F)C 34a_100000702247_100000210202 [0,2,0,0,0,0|1,0,0]=3 12140 B12R1.385 CCOCc1ccc(c(c1)F)C 34a_100121572206_100011217369 [0,2,0,0,0,0|1,0,0]=3 12141 B12R1.385 CCOCc1ccc(c(c1)F)C 7a_100000702247_100000210202 [0,2,0,0,0,0|1,0,0]=3 12142 B12R1.385 CCOCc1ccc(c(c1)F)Cl 34a_100011218299_100000210202 [0,2,0,0,0,0|1,0,0]=3 12143 B12R1.385 CCOCc1ccc(c(c1)F)Cl 34a_100121572206_100011519011 [0,2,0,0,0,0|1,0,0]=3 12144 B12R1.385 CCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000210202 [0,2,0,0,0,0|1,0,0]=3 12145 B12R1.385 CCOCc1ccc(c(c1)F)F 34a_100011215442_100000210202 [0,2,0,0,0,0|1,0,0]=3 12146 B12R1.385 CCOCc1ccc(c(c1)F)F 34a_100121572206_100000757363 [0,2,0,0,0,0|1,0,0]=3 12147 B12R1.385 CCOCc1ccc(c(c1)F)F 7a_100011215442_100000210202 [0,2,0,0,0,0|1,0,0]=3 12148 B12R1.385 CCOCc1ccc(c(c1)F)I 34a_100010149597_100000210202 [0,2,0,0,0,0|1,0,0]=3 12149 B12R1.385 CCOCc1ccc(c(c1)F)I 34a_100121572206_100010149604 [0,2,0,0,0,0|1,0,0]=3 12150 B12R1.385 CCOCc1ccc(c(c1)F)I 7a_100010149597_100000210202 [0,2,0,0,0,0|1,0,0]=3 12151 B12R1.385 CCOCc1ccc(c(c1)F)N 34a_100011217239_100000210202 [0,2,0,0,0,0|1,0,0]=3 12152 B12R1.385 CCOCc1ccc(c(c1)I)Br 34a_100121572206_100010146616 [0,2,0,0,0,0|1,0,0]=3 12153 B12R1.385 CCOCc1ccc(c(c1)I)C 34a_100000050133_100000210202 [0,2,0,0,0,0|1,0,0]=3 12154 B12R1.385 CCOCc1ccc(c(c1)I)C 34a_100121572206_100010206137 [0,2,0,0,0,0|1,0,0]=3 12155 B12R1.385 CCOCc1ccc(c(c1)I)C 7a_100000050133_100000210202 [0,2,0,0,0,0|1,0,0]=3 12156 B12R1.385 CCOCc1ccc(c(c1)I)F 34a_100000049585_100000210202 [0,2,0,0,0,0|1,0,0]=3 12157 B12R1.385 CCOCc1ccc(c(c1)I)F 34a_100121572206_100010188208 [0,2,0,0,0,0|1,0,0]=3 12158 B12R1.385 CCOCc1ccc(c(c1)I)F 7a_100000049585_100000210202 [0,2,0,0,0,0|1,0,0]=3 12159 B12R1.385 CCOCc1ccc(c(c1)N)Br 34a_100012347568_100000210202 [0,2,0,0,0,0|1,0,0]=3 12160 B12R1.385 CCOCc1ccc(c(c1)N)C 34a_100000758420_100000210202 [0,2,0,0,0,0|1,0,0]=3 12161 B12R1.385 CCOCc1ccc(c(c1)N)Cl 34a_106256033963_100000210202 [0,2,0,0,0,0|1,0,0]=3 12162 B12R1.385 CCOCc1ccc(c(c1)N)F 34a_102125399562_100000210202 [0,2,0,0,0,0|1,0,0]=3 12163 B12R1.385 CCOCc1ccc(c(n1)C)Br 34a_100010114280_100000210202 [0,2,0,0,0,0|2,0,0]=4 12164 B12R1.385 CCOCc1ccc(c(n1)C)F 34a_200009884719_100000210202 [0,2,0,0,0,0|2,0,0]=4 12165 B12R1.385 CCOCc1ccc(c(n1)Cl)Br 34a_100010065236_100000210202 [0,2,0,0,0,0|2,0,0]=4 12166 B12R1.385 CCOCc1cnc(c(c1)Br)Cl 34a_100010201731_100000210202 [0,2,0,0,0,0|2,0,0]=4 12167 B12R1.385 CCOCc1cnc(c(c1)Br)Cl 7a_100010201731_100000210202 [0,2,0,0,0,0|2,0,0]=4 12168 B12R1.385 CCOCc1cnc(c(c1)Br)F 34a_100121572206_200010066439 [0,2,0,0,0,0|2,0,0]=4 12169 B12R1.385 CCOCc1cnc(c(c1)Br)N 34a_100012343677_100000210202 [0,2,0,0,0,0|2,0,0]=4 12170 B12R1.385 CCOCc1cnc(c(c1)Br)N 7a_100012343677_100000210202 [0,2,0,0,0,0|2,0,0]=4 12171 B12R1.385 CCOCc1cnc(c(c1)C)Cl 34a_200000092119_100000210202 [0,2,0,0,0,0|2,0,0]=4 12172 B12R1.385 CCOCc1cnc(c(c1)C)Cl 7a_200000092119_100000210202 [0,2,0,0,0,0|2,0,0]=4 12173 B12R1.385 CCOCc1cnc(c(c1)Cl)Cl 34a_100000042784_100000210202 [0,2,0,0,0,0|2,0,0]=4 12174 B12R1.385 CCOCc1cnc(c(c1)Cl)Cl 34a_100121572206_100009843750 [0,2,0,0,0,0|2,0,0]=4 12175 B12R1.385 CCOCc1cnc(c(c1)Cl)Cl 7a_100000042784_100000210202 [0,2,0,0,0,0|2,0,0]=4 12176 B12R1.385 CCOCc1cnc(c(c1)F)Br 34a_100010065243_100000210202 [0,2,0,0,0,0|2,0,0]=4 12177 B12R1.385 CCOCc1cnc(c(c1)F)Br 7a_100010065243_100000210202 [0,2,0,0,0,0|2,0,0]=4 12178 B12R1.385 CCOCc1cnc(c(c1)F)C 34a_100009839834_100000210202 [0,2,0,0,0,0|2,0,0]=4 12179 B12R1.385 CCOCc1cnc(c(c1)F)C 7a_100009839834_100000210202 [0,2,0,0,0,0|2,0,0]=4 12180 B12R1.385 CCOCc1cnc(c(c1)I)Cl 34a_100121572206_100011072623 [0,2,0,0,0,0|2,0,0]=4 12181 B12R1.385 CCOCc1cnc(c(c1)I)Cl 34a_200015217190_100000210202 [0,2,0,0,0,0|2,0,0]=4 12182 B12R1.385 CCOCc1cnc(c(c1)I)Cl 7a_200015217190_100000210202 [0,2,0,0,0,0|2,0,0]=4 12183 B12R1.385 CCSCc1cc(=O)c(co1)O 62a_100000210202_100000010605 [0,2,0,0,0,0|1,1,0]=4 12184 B12R1.385 CCSCc1ccc(c(c1)Br)Br 62a_100000210202_100012353900 [0,2,0,0,0,0|1,1,0]=4 12185 B12R1.385 CCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000210202 [0,2,0,0,0,0|1,1,0]=4 12186 B12R1.385 CCSCc1ccc(c(c1)Br)C 62a_100000210202_100012232412 [0,2,0,0,0,0|1,1,0]=4 12187 B12R1.385 CCSCc1ccc(c(c1)Br)C 62a_100012232412_100000210202 [0,2,0,0,0,0|1,1,0]=4 12188 B12R1.385 CCSCc1ccc(c(c1)Br)Cl 62a_100000210202_100012353894 [0,2,0,0,0,0|1,1,0]=4 12189 B12R1.385 CCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000210202 [0,2,0,0,0,0|1,1,0]=4 12190 B12R1.385 CCSCc1ccc(c(c1)Br)F 62a_100000210202_100011206884 [0,2,0,0,0,0|1,1,0]=4 12191 B12R1.385 CCSCc1ccc(c(c1)Br)F 62a_100011206884_100000210202 [0,2,0,0,0,0|1,1,0]=4 12192 B12R1.385 CCSCc1ccc(c(c1)C)Br 62a_100000210202_100000727479 [0,2,0,0,0,0|1,1,0]=4 12193 B12R1.385 CCSCc1ccc(c(c1)C)Br 62a_100000727479_100000210202 [0,2,0,0,0,0|1,1,0]=4 12194 B12R1.385 CCSCc1ccc(c(c1)C)C 62a_100000210202_100000742320 [0,2,0,0,0,0|1,1,0]=4 12195 B12R1.385 CCSCc1ccc(c(c1)C)C 62a_100000742320_100000210202 [0,2,0,0,0,0|1,1,0]=4 12196 B12R1.385 CCSCc1ccc(c(c1)C)Cl 62a_100000210202_100012184735 [0,2,0,0,0,0|1,1,0]=4 12197 B12R1.385 CCSCc1ccc(c(c1)C)Cl 62a_100012184735_100000210202 [0,2,0,0,0,0|1,1,0]=4 12198 B12R1.385 CCSCc1ccc(c(c1)C)F 62a_100000210202_100011216667 [0,2,0,0,0,0|1,1,0]=4 12199 B12R1.385 CCSCc1ccc(c(c1)C)F 62a_100011216667_100000210202 [0,2,0,0,0,0|1,1,0]=4 12200 B12R1.385 CCSCc1ccc(c(c1)Cl)Br 62a_100000210202_100012353895 [0,2,0,0,0,0|1,1,0]=4 12201 B12R1.385 CCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000210202 [0,2,0,0,0,0|1,1,0]=4 12202 B12R1.385 CCSCc1ccc(c(c1)Cl)C 62a_100000210202_100011823929 [0,2,0,0,0,0|1,1,0]=4 12203 B12R1.385 CCSCc1ccc(c(c1)Cl)C 62a_100011823929_100000210202 [0,2,0,0,0,0|1,1,0]=4 12204 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000210202 [0,2,0,0,0,0|1,1,0]=4 12205 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl 62a_100000210202_100000184707 [0,2,0,0,0,0|1,1,0]=4 12206 B12R1.385 CCSCc1ccc(c(c1)Cl)F 62a_100000210202_100011934319 [0,2,0,0,0,0|1,1,0]=4 12207 B12R1.385 CCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000210202 [0,2,0,0,0,0|1,1,0]=4 12208 B12R1.385 CCSCc1ccc(c(c1)Cl)I 62a_100000210202_100012349665 [0,2,0,0,0,0|1,1,0]=4 12209 B12R1.385 CCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000210202 [0,2,0,0,0,0|1,1,0]=4 12210 B12R1.385 CCSCc1ccc(c(c1)F)Br 62a_100000210202_100000767054 [0,2,0,0,0,0|1,1,0]=4 12211 B12R1.385 CCSCc1ccc(c(c1)F)Br 62a_100000767054_100000210202 [0,2,0,0,0,0|1,1,0]=4 12212 B12R1.385 CCSCc1ccc(c(c1)F)C 62a_100000210202_100011217369 [0,2,0,0,0,0|1,1,0]=4 12213 B12R1.385 CCSCc1ccc(c(c1)F)C 62a_100011217369_100000210202 [0,2,0,0,0,0|1,1,0]=4 12214 B12R1.385 CCSCc1ccc(c(c1)F)Cl 62a_100000210202_100000716492 [0,2,0,0,0,0|1,1,0]=4 12215 B12R1.385 CCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000210202 [0,2,0,0,0,0|1,1,0]=4 12216 B12R1.385 CCSCc1ccc(c(c1)F)F 62a_100000210202_100000757363 [0,2,0,0,0,0|1,1,0]=4 12217 B12R1.385 CCSCc1ccc(c(c1)F)F 62a_100000757363_100000210202 [0,2,0,0,0,0|1,1,0]=4 12218 B12R1.385 CCSCc1ccc(c(c1)F)I 62a_100000210202_100010149604 [0,2,0,0,0,0|1,1,0]=4 12219 B12R1.385 CCSCc1ccc(c(c1)F)I 62a_100010149604_100000210202 [0,2,0,0,0,0|1,1,0]=4 12220 B12R1.385 CCSCc1ccc(c(c1)I)Br 62a_100000210202_100010146616 [0,2,0,0,0,0|1,1,0]=4 12221 B12R1.385 CCSCc1ccc(c(c1)I)Br 62a_100010146616_100000210202 [0,2,0,0,0,0|1,1,0]=4 12222 B12R1.385 CCSCc1ccc(c(c1)I)C 62a_100000210202_100010206137 [0,2,0,0,0,0|1,1,0]=4 12223 B12R1.385 CCSCc1ccc(c(c1)I)C 62a_100010206137_100000210202 [0,2,0,0,0,0|1,1,0]=4 12224 B12R1.385 CCSCc1ccc(c(c1)I)F 62a_100000210202_100010188208 [0,2,0,0,0,0|1,1,0]=4 12225 B12R1.385 CCSCc1ccc(c(c1)I)F 62a_100010188208_100000210202 [0,2,0,0,0,0|1,1,0]=4 12226 B12R1.385 CNCCc1ccc(c(c1)C)C 2230a_100020591374_200000210301 [0,2,0,0,0,0|2,0,0]=4 12227 B12R1.385 CNCCc1ccc(c(c1)C)C 34a_100020591374_200000210301 [0,2,0,0,0,0|2,0,0]=4 12228 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200000210301 [0,2,0,0,0,0|2,0,0]=4 12229 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100011713676 [0,2,0,0,0,0|2,0,0]=4 12230 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200000210301 [0,2,0,0,0,0|2,0,0]=4 12231 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 34a_100102657272_100011713676 [0,2,0,0,0,0|2,0,0]=4 12232 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 7a_106832991635_100011713676 [0,2,0,0,0,0|2,0,0]=4 12233 B12R1.385 CNCCc1ccc(c(c1)Cl)F 2230a_106832991635_100012361305 [0,2,0,0,0,0|2,0,0]=4 12234 B12R1.385 CNCCc1ccc(c(c1)Cl)F 2230a_200011997520_200000210301 [0,2,0,0,0,0|2,0,0]=4 12235 B12R1.385 CNCCc1ccc(c(c1)Cl)F 34a_100102657272_100012361305 [0,2,0,0,0,0|2,0,0]=4 12236 B12R1.385 CNCCc1ccc(c(c1)Cl)F 34a_200011997520_200000210301 [0,2,0,0,0,0|2,0,0]=4 12237 B12R1.385 CNCCc1ccc(c(c1)Cl)F 7a_106832991635_100012361305 [0,2,0,0,0,0|2,0,0]=4 12238 B12R1.385 CNCCc1ccc(c(c1)F)F 2230a_106832991635_100000690553 [0,2,0,0,0,0|2,0,0]=4 12239 B12R1.385 CNCCc1ccc(c(c1)F)F 2230a_200000706328_200000210301 [0,2,0,0,0,0|2,0,0]=4 12240 B12R1.385 CNCCc1ccc(c(c1)F)F 34a_100102657272_100000690553 [0,2,0,0,0,0|2,0,0]=4 12241 B12R1.385 CNCCc1ccc(c(c1)F)F 34a_200000706328_200000210301 [0,2,0,0,0,0|2,0,0]=4 12242 B12R1.385 CNCCc1ccc(c(c1)F)F 7a_106832991635_100000690553 [0,2,0,0,0,0|2,0,0]=4 12243 B12R1.385 CNCCc1ccc(c(c1)O)O 34a_100000210387_200000210301 [0,2,0,0,0,0|1,0,0]=3 12244 B12R1.385 CNCCc1ccc(c(c1)O)O 7a_106832991635_200010393615 [0,2,0,0,0,0|1,0,0]=3 12245 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 34a_100011709245_200000210301 [0,2,0,0,0,0|2,0,0]=4 12246 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 34a_100138415774_100011713676 [0,2,0,0,0,0|2,0,0]=4 12247 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 7a_100011709245_200000210301 [0,2,0,0,0,0|2,0,0]=4 12248 B12R1.385 COCCc1ccc(c(c1)Cl)F 34a_100011830478_200000210301 [0,2,0,0,0,0|2,0,0]=4 12249 B12R1.385 COCCc1ccc(c(c1)Cl)F 34a_100138415774_100012361305 [0,2,0,0,0,0|2,0,0]=4 12250 B12R1.385 COCCc1ccc(c(c1)Cl)F 7a_100011830478_200000210301 [0,2,0,0,0,0|2,0,0]=4 12251 B12R1.385 COCCc1ccc(c(c1)F)Br 34a_100012921202_200000210301 [0,2,0,0,0,0|2,0,0]=4 12252 B12R1.385 COCCc1ccc(c(c1)F)Br 7a_100012921202_200000210301 [0,2,0,0,0,0|2,0,0]=4 12253 B12R1.385 COCCc1ccc(c(c1)F)Cl 34a_100011934464_200000210301 [0,2,0,0,0,0|2,0,0]=4 12254 B12R1.385 COCCc1ccc(c(c1)F)Cl 7a_100011934464_200000210301 [0,2,0,0,0,0|2,0,0]=4 12255 B12R1.385 COCCc1ccc(c(c1)F)F 34a_100000690376_200000210301 [0,2,0,0,0,0|2,0,0]=4 12256 B12R1.385 COCCc1ccc(c(c1)F)F 34a_100138415774_100000690553 [0,2,0,0,0,0|2,0,0]=4 12257 B12R1.385 COCCc1ccc(c(c1)F)F 7a_100000690376_200000210301 [0,2,0,0,0,0|2,0,0]=4 12258 B12R1.385 COCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000766300 [0,2,0,0,0,0|2,0,0]=4 12259 B12R1.385 COCNc1ccc(c(c1)Br)C 2230a_100000736455_100000766300 [0,2,0,0,0,0|2,0,0]=4 12260 B12R1.385 COCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000766300 [0,2,0,0,0,0|2,0,0]=4 12261 B12R1.385 COCNc1ccc(c(c1)Br)F 2230a_100000760356_100000766300 [0,2,0,0,0,0|2,0,0]=4 12262 B12R1.385 COCNc1ccc(c(c1)C)Br 2230a_100000210723_100000766300 [0,2,0,0,0,0|2,0,0]=4 12263 B12R1.385 COCNc1ccc(c(c1)C)C 2230a_100000724040_100000766300 [0,2,0,0,0,0|2,0,0]=4 12264 B12R1.385 COCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000766300 [0,2,0,0,0,0|2,0,0]=4 12265 B12R1.385 COCNc1ccc(c(c1)C)F 2230a_100000750164_100000766300 [0,2,0,0,0,0|2,0,0]=4 12266 B12R1.385 COCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000766300 [0,2,0,0,0,0|2,0,0]=4 12267 B12R1.385 COCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000766300 [0,2,0,0,0,0|2,0,0]=4 12268 B12R1.385 COCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000766300 [0,2,0,0,0,0|2,0,0]=4 12269 B12R1.385 COCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000766300 [0,2,0,0,0,0|2,0,0]=4 12270 B12R1.385 COCNc1ccc(c(c1)F)Br 2230a_100000759894_100000766300 [0,2,0,0,0,0|2,0,0]=4 12271 B12R1.385 COCNc1ccc(c(c1)F)C 2230a_100000210958_100000766300 [0,2,0,0,0,0|2,0,0]=4 12272 B12R1.385 COCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000766300 [0,2,0,0,0,0|2,0,0]=4 12273 B12R1.385 COCNc1ccc(c(c1)F)F 2230a_100000210724_100000766300 [0,2,0,0,0,0|2,0,0]=4 12274 B12R1.385 COCOc1ccc(c(c1)F)O 271570a_203496583355_100012265695 [0,2,0,0,0,0|0,0,0]=2 12275 B12R1.385 COCOc1ccc(c(c1)O)C 271570a_203496583355_200015918306 [0,2,0,0,0,0|1,0,0]=3 12276 B12R1.385 COCSc1cc(c(cn1)O)C 62a_100000766300_100000692680 [0,2,0,0,0,0|1,1,0]=4 12277 B12R1.385 COCSc1cc(c(cn1)O)N 62a_100000766300_100009819941 [0,2,0,0,0,0|1,1,0]=4 12278 B12R1.385 COCSc1cc(c(cn1)O)N 62a_100009819941_100000766300 [0,2,0,0,0,0|1,1,0]=4 12279 B12R1.385 COCSc1ccc(c(c1)Br)Br 62a_100000766300_100012356285 [0,2,0,0,0,0|1,1,0]=4 12280 B12R1.385 COCSc1ccc(c(c1)Br)Br 62a_100012356285_100000766300 [0,2,0,0,0,0|1,1,0]=4 12281 B12R1.385 COCSc1ccc(c(c1)Br)C 62a_100000766300_100011847877 [0,2,0,0,0,0|1,1,0]=4 12282 B12R1.385 COCSc1ccc(c(c1)Br)C 62a_100011847877_100000766300 [0,2,0,0,0,0|1,1,0]=4 12283 B12R1.385 COCSc1ccc(c(c1)Br)Cl 62a_100000766300_100012353702 [0,2,0,0,0,0|1,1,0]=4 12284 B12R1.385 COCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000766300 [0,2,0,0,0,0|1,1,0]=4 12285 B12R1.385 COCSc1ccc(c(c1)Br)F 62a_100000766300_100012047266 [0,2,0,0,0,0|1,1,0]=4 12286 B12R1.385 COCSc1ccc(c(c1)Br)F 62a_100012047266_100000766300 [0,2,0,0,0,0|1,1,0]=4 12287 B12R1.385 COCSc1ccc(c(c1)Br)N 62a_100000750455_100000766300 [0,2,0,0,0,0|1,1,0]=4 12288 B12R1.385 COCSc1ccc(c(c1)Br)N 62a_100000766300_100000750455 [0,2,0,0,0,0|1,1,0]=4 12289 B12R1.385 COCSc1ccc(c(c1)Br)O 62a_100000766300_100012361655 [0,2,0,0,0,0|0,1,0]=3 12290 B12R1.385 COCSc1ccc(c(c1)Br)O 62a_100012361655_100000766300 [0,2,0,0,0,0|0,1,0]=3 12291 B12R1.385 COCSc1ccc(c(c1)C)Br 62a_100000766300_100009813585 [0,2,0,0,0,0|1,1,0]=4 12292 B12R1.385 COCSc1ccc(c(c1)C)Br 62a_100009813585_100000766300 [0,2,0,0,0,0|1,1,0]=4 12293 B12R1.385 COCSc1ccc(c(c1)C)C 62a_100000766300_100011215607 [0,2,0,0,0,0|1,1,0]=4 12294 B12R1.385 COCSc1ccc(c(c1)C)C 62a_100011215607_100000766300 [0,2,0,0,0,0|1,1,0]=4 12295 B12R1.385 COCSc1ccc(c(c1)C)Cl 62a_100000049509_100000766300 [0,2,0,0,0,0|1,1,0]=4 12296 B12R1.385 COCSc1ccc(c(c1)C)Cl 62a_100000766300_100000049509 [0,2,0,0,0,0|1,1,0]=4 12297 B12R1.385 COCSc1ccc(c(c1)C)F 62a_100000766300_100011218330 [0,2,0,0,0,0|1,1,0]=4 12298 B12R1.385 COCSc1ccc(c(c1)C)F 62a_100011218330_100000766300 [0,2,0,0,0,0|1,1,0]=4 12299 B12R1.385 COCSc1ccc(c(c1)C)N 62a_100000211769_100000766300 [0,2,0,0,0,0|1,1,0]=4 12300 B12R1.385 COCSc1ccc(c(c1)C)N 62a_100000766300_100000211769 [0,2,0,0,0,0|1,1,0]=4 12301 B12R1.385 COCSc1ccc(c(c1)C)O 62a_100000766300_100000186361 [0,2,0,0,0,0|0,1,0]=3 12302 B12R1.385 COCSc1ccc(c(c1)Cl)Br 62a_100000766300_100012047281 [0,2,0,0,0,0|1,1,0]=4 12303 B12R1.385 COCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000766300 [0,2,0,0,0,0|1,1,0]=4 12304 B12R1.385 COCSc1ccc(c(c1)Cl)C 62a_100000766300_100011216363 [0,2,0,0,0,0|1,1,0]=4 12305 B12R1.385 COCSc1ccc(c(c1)Cl)C 62a_100011216363_100000766300 [0,2,0,0,0,0|1,1,0]=4 12306 B12R1.385 COCSc1ccc(c(c1)Cl)Cl 62a_100000766300_100011214914 [0,2,0,0,0,0|1,1,0]=4 12307 B12R1.385 COCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000766300 [0,2,0,0,0,0|1,1,0]=4 12308 B12R1.385 COCSc1ccc(c(c1)Cl)F 62a_100000766300_100011215976 [0,2,0,0,0,0|1,1,0]=4 12309 B12R1.385 COCSc1ccc(c(c1)Cl)F 62a_100011215976_100000766300 [0,2,0,0,0,0|1,1,0]=4 12310 B12R1.385 COCSc1ccc(c(c1)Cl)N 62a_100000766300_100011218065 [0,2,0,0,0,0|1,1,0]=4 12311 B12R1.385 COCSc1ccc(c(c1)Cl)N 62a_100011218065_100000766300 [0,2,0,0,0,0|1,1,0]=4 12312 B12R1.385 COCSc1ccc(c(c1)Cl)O 62a_100000766300_100012360047 [0,2,0,0,0,0|0,1,0]=3 12313 B12R1.385 COCSc1ccc(c(c1)Cl)O 62a_100012360047_100000766300 [0,2,0,0,0,0|0,1,0]=3 12314 B12R1.385 COCSc1ccc(c(c1)F)Br 62a_100000685389_100000766300 [0,2,0,0,0,0|1,1,0]=4 12315 B12R1.385 COCSc1ccc(c(c1)F)Br 62a_100000766300_100000685389 [0,2,0,0,0,0|1,1,0]=4 12316 B12R1.385 COCSc1ccc(c(c1)F)C 62a_100000720648_100000766300 [0,2,0,0,0,0|1,1,0]=4 12317 B12R1.385 COCSc1ccc(c(c1)F)C 62a_100000766300_100000720648 [0,2,0,0,0,0|1,1,0]=4 12318 B12R1.385 COCSc1ccc(c(c1)F)Cl 62a_100000766300_100011216805 [0,2,0,0,0,0|1,1,0]=4 12319 B12R1.385 COCSc1ccc(c(c1)F)Cl 62a_100011216805_100000766300 [0,2,0,0,0,0|1,1,0]=4 12320 B12R1.385 COCSc1ccc(c(c1)F)F 62a_100000703953_100000766300 [0,2,0,0,0,0|1,1,0]=4 12321 B12R1.385 COCSc1ccc(c(c1)F)F 62a_100000766300_100000703953 [0,2,0,0,0,0|1,1,0]=4 12322 B12R1.385 COCSc1ccc(c(c1)F)N 62a_100000766300_100011215594 [0,2,0,0,0,0|1,1,0]=4 12323 B12R1.385 COCSc1ccc(c(c1)F)N 62a_100011215594_100000766300 [0,2,0,0,0,0|1,1,0]=4 12324 B12R1.385 COCSc1ccc(c(c1)F)O 62a_100000185481_100000766300 [0,2,0,0,0,0|0,1,0]=3 12325 B12R1.385 COCSc1ccc(c(c1)F)O 62a_100000766300_100000185481 [0,2,0,0,0,0|0,1,0]=3 12326 B12R1.385 COCSc1ccc(c(c1)N)Br 62a_100000750456_100000766300 [0,2,0,0,0,0|1,1,0]=4 12327 B12R1.385 COCSc1ccc(c(c1)N)Br 62a_100000766300_100000750456 [0,2,0,0,0,0|1,1,0]=4 12328 B12R1.385 COCSc1ccc(c(c1)N)C 62a_100000761890_100000766300 [0,2,0,0,0,0|1,1,0]=4 12329 B12R1.385 COCSc1ccc(c(c1)N)C 62a_100000766300_100000761890 [0,2,0,0,0,0|1,1,0]=4 12330 B12R1.385 COCSc1ccc(c(c1)N)Cl 62a_100000766300_200000761891 [0,2,0,0,0,0|1,1,0]=4 12331 B12R1.385 COCSc1ccc(c(c1)N)Cl 62a_200000761891_100000766300 [0,2,0,0,0,0|1,1,0]=4 12332 B12R1.385 COCSc1ccc(c(c1)N)F 62a_100000740924_100000766300 [0,2,0,0,0,0|1,1,0]=4 12333 B12R1.385 COCSc1ccc(c(c1)N)F 62a_100000766300_100000740924 [0,2,0,0,0,0|1,1,0]=4 12334 B12R1.385 COCSc1ccc(c(c1)N)N 62a_100000741789_100000766300 [0,2,0,0,0,0|1,1,0]=4 12335 B12R1.385 COCSc1ccc(c(c1)N)N 62a_100000766300_100011534411 [0,2,0,0,0,0|1,1,0]=4 12336 B12R1.385 COCSc1ccc(c(c1)N)O 62a_100000752626_100000766300 [0,2,0,0,0,0|0,1,0]=3 12337 B12R1.385 COCSc1ccc(c(c1)N)O 62a_100000766300_100000752626 [0,2,0,0,0,0|0,1,0]=3 12338 B12R1.385 COCSc1ccc(c(c1)O)Br 62a_100000766300_100012356990 [0,2,0,0,0,0|1,1,0]=4 12339 B12R1.385 COCSc1ccc(c(c1)O)Br 62a_100012356990_100000766300 [0,2,0,0,0,0|1,1,0]=4 12340 B12R1.385 COCSc1ccc(c(c1)O)C 62a_100000685420_100000766300 [0,2,0,0,0,0|1,1,0]=4 12341 B12R1.385 COCSc1ccc(c(c1)O)C 62a_100000766300_100000685420 [0,2,0,0,0,0|1,1,0]=4 12342 B12R1.385 COCSc1ccc(c(c1)O)Cl 62a_100000766300_100011356854 [0,2,0,0,0,0|1,1,0]=4 12343 B12R1.385 COCSc1ccc(c(c1)O)Cl 62a_100011356854_100000766300 [0,2,0,0,0,0|1,1,0]=4 12344 B12R1.385 COCSc1ccc(c(c1)O)F 62a_100000686035_100000766300 [0,2,0,0,0,0|1,1,0]=4 12345 B12R1.385 COCSc1ccc(c(c1)O)F 62a_100000766300_100000686035 [0,2,0,0,0,0|1,1,0]=4 12346 B12R1.385 COCSc1ccc(c(c1)O)N 62a_100000739049_100000766300 [0,2,0,0,0,0|1,1,0]=4 12347 B12R1.385 COCSc1ccc(c(c1)O)N 62a_100000766300_100000739049 [0,2,0,0,0,0|1,1,0]=4 12348 B12R1.385 COCSc1ccc(c(c1)O)O 62a_100000766300_100009813601 [0,2,0,0,0,0|0,1,0]=3 12349 B12R1.385 COCSc1ccc(c(n1)Br)O 62a_100000725334_100000766300 [0,2,0,0,0,0|1,1,0]=4 12350 B12R1.385 COCSc1ccc(c(n1)Br)O 62a_100000766300_100000725334 [0,2,0,0,0,0|1,1,0]=4 12351 B12R1.385 COCSc1ccc(c(n1)C)O 62a_100000766300_100010233687 [0,2,0,0,0,0|1,1,0]=4 12352 B12R1.385 COCSc1ccc(c(n1)C)O 62a_100010233687_100000766300 [0,2,0,0,0,0|1,1,0]=4 12353 B12R1.385 COCSc1ccc(c(n1)Cl)O 62a_100000766300_100000721234 [0,2,0,0,0,0|1,1,0]=4 12354 B12R1.385 COCSc1ccc(c(n1)F)O 62a_100000766300_100009819667 [0,2,0,0,0,0|1,1,0]=4 12355 B12R1.385 COCSc1ccc(c(n1)F)O 62a_100009819667_100000766300 [0,2,0,0,0,0|1,1,0]=4 12356 B12R1.385 COCSc1ccc(c(n1)N)O 62a_100000685527_100000766300 [0,2,0,0,0,0|1,1,0]=4 12357 B12R1.385 COCSc1ccc(c(n1)N)O 62a_100000766300_100000685527 [0,2,0,0,0,0|1,1,0]=4 12358 B12R1.385 COCSc1cnc(c(c1)C)O 62a_100000685391_100000766300 [0,2,0,0,0,0|1,1,0]=4 12359 B12R1.385 COCSc1cnc(c(c1)C)O 62a_100000766300_100000685391 [0,2,0,0,0,0|1,1,0]=4 12360 B12R1.385 COCSc1cnc(c(c1)Cl)O 62a_100000766300_100010238531 [0,2,0,0,0,0|1,1,0]=4 12361 B12R1.385 COCSc1cnc(c(c1)Cl)O 62a_100010238531_100000766300 [0,2,0,0,0,0|1,1,0]=4 12362 B12R1.385 COCSc1cnc(c(c1)N)O 62a_100000743729_100000766300 [0,2,0,0,0,0|1,1,0]=4 12363 B12R1.385 COCSc1cnc(c(c1)N)O 62a_100000766300_100000743729 [0,2,0,0,0,0|1,1,0]=4 12364 B12R1.385 CSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_200000210301 [0,2,0,0,0,0|2,0,0]=4 12365 B12R1.385 CSCCc1ccc(c(c1)Cl)Cl 62a_200000210301_100011713676 [0,2,0,0,0,0|2,0,0]=4 12366 B12R1.385 CSCCc1ccc(c(c1)Cl)F 62a_100012361305_200000210301 [0,2,0,0,0,0|2,0,0]=4 12367 B12R1.385 CSCCc1ccc(c(c1)Cl)F 62a_200000210301_100012361305 [0,2,0,0,0,0|2,0,0]=4 12368 B12R1.385 CSCCc1ccc(c(c1)F)F 62a_100000690553_200000210301 [0,2,0,0,0,0|2,0,0]=4 12369 B12R1.385 CSCCc1ccc(c(c1)F)F 62a_200000210301_100000690553 [0,2,0,0,0,0|2,0,0]=4 12370 B12R1.385 CSCCc1ccc(c(c1)O)O 62a_200000210301_200010393615 [0,2,0,0,0,0|1,0,0]=3 12371 B12R1.385 CSCNc1ccc(c(c1)Br)Br 2230a_100011306057_100011218213 [0,2,0,0,0,0|2,0,0]=4 12372 B12R1.385 CSCNc1ccc(c(c1)Br)Br 34a_100011306057_100011218213 [0,2,0,0,0,0|2,0,0]=4 12373 B12R1.385 CSCNc1ccc(c(c1)Br)C 2230a_100000736455_100011218213 [0,2,0,0,0,0|2,0,0]=4 12374 B12R1.385 CSCNc1ccc(c(c1)Br)C 34a_100000736455_100011218213 [0,2,0,0,0,0|2,0,0]=4 12375 B12R1.385 CSCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100011218213 [0,2,0,0,0,0|2,0,0]=4 12376 B12R1.385 CSCNc1ccc(c(c1)Br)Cl 34a_100000686031_100011218213 [0,2,0,0,0,0|2,0,0]=4 12377 B12R1.385 CSCNc1ccc(c(c1)Br)F 2230a_100000760356_100011218213 [0,2,0,0,0,0|2,0,0]=4 12378 B12R1.385 CSCNc1ccc(c(c1)Br)F 34a_100000760356_100011218213 [0,2,0,0,0,0|2,0,0]=4 12379 B12R1.385 CSCNc1ccc(c(c1)Br)I 34a_100000750458_100011218213 [0,2,0,0,0,0|2,0,0]=4 12380 B12R1.385 CSCNc1ccc(c(c1)Br)O 34a_100011534360_100011218213 [0,2,0,0,0,0|1,0,0]=3 12381 B12R1.385 CSCNc1ccc(c(c1)C)Br 2230a_100000210723_100011218213 [0,2,0,0,0,0|2,0,0]=4 12382 B12R1.385 CSCNc1ccc(c(c1)C)Br 34a_100000210723_100011218213 [0,2,0,0,0,0|2,0,0]=4 12383 B12R1.385 CSCNc1ccc(c(c1)C)C 2230a_100000724040_100011218213 [0,2,0,0,0,0|2,0,0]=4 12384 B12R1.385 CSCNc1ccc(c(c1)C)C 34a_100000724040_100011218213 [0,2,0,0,0,0|2,0,0]=4 12385 B12R1.385 CSCNc1ccc(c(c1)C)Cl 2230a_100000187808_100011218213 [0,2,0,0,0,0|2,0,0]=4 12386 B12R1.385 CSCNc1ccc(c(c1)C)Cl 34a_100000187808_100011218213 [0,2,0,0,0,0|2,0,0]=4 12387 B12R1.385 CSCNc1ccc(c(c1)C)F 2230a_100000750164_100011218213 [0,2,0,0,0,0|2,0,0]=4 12388 B12R1.385 CSCNc1ccc(c(c1)C)F 34a_100000750164_100011218213 [0,2,0,0,0,0|2,0,0]=4 12389 B12R1.385 CSCNc1ccc(c(c1)C)I 34a_100000198070_100011218213 [0,2,0,0,0,0|2,0,0]=4 12390 B12R1.385 CSCNc1ccc(c(c1)C)O 34a_100011218179_100011218213 [0,2,0,0,0,0|1,0,0]=3 12391 B12R1.385 CSCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100011218213 [0,2,0,0,0,0|2,0,0]=4 12392 B12R1.385 CSCNc1ccc(c(c1)Cl)Br 34a_100000687081_100011218213 [0,2,0,0,0,0|2,0,0]=4 12393 B12R1.385 CSCNc1ccc(c(c1)Cl)C 2230a_100000188892_100011218213 [0,2,0,0,0,0|2,0,0]=4 12394 B12R1.385 CSCNc1ccc(c(c1)Cl)C 34a_100000188892_100011218213 [0,2,0,0,0,0|2,0,0]=4 12395 B12R1.385 CSCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100011218213 [0,2,0,0,0,0|2,0,0]=4 12396 B12R1.385 CSCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100011218213 [0,2,0,0,0,0|2,0,0]=4 12397 B12R1.385 CSCNc1ccc(c(c1)Cl)F 2230a_100000211060_100011218213 [0,2,0,0,0,0|2,0,0]=4 12398 B12R1.385 CSCNc1ccc(c(c1)Cl)F 34a_100000211060_100011218213 [0,2,0,0,0,0|2,0,0]=4 12399 B12R1.385 CSCNc1ccc(c(c1)Cl)I 34a_100000761885_100011218213 [0,2,0,0,0,0|2,0,0]=4 12400 B12R1.385 CSCNc1ccc(c(c1)Cl)O 34a_100000744943_100011218213 [0,2,0,0,0,0|1,0,0]=3 12401 B12R1.385 CSCNc1ccc(c(c1)F)Br 2230a_100000759894_100011218213 [0,2,0,0,0,0|2,0,0]=4 12402 B12R1.385 CSCNc1ccc(c(c1)F)Br 34a_100000759894_100011218213 [0,2,0,0,0,0|2,0,0]=4 12403 B12R1.385 CSCNc1ccc(c(c1)F)C 2230a_100000210958_100011218213 [0,2,0,0,0,0|2,0,0]=4 12404 B12R1.385 CSCNc1ccc(c(c1)F)C 34a_100000210958_100011218213 [0,2,0,0,0,0|2,0,0]=4 12405 B12R1.385 CSCNc1ccc(c(c1)F)Cl 2230a_100000739366_100011218213 [0,2,0,0,0,0|2,0,0]=4 12406 B12R1.385 CSCNc1ccc(c(c1)F)Cl 34a_100000739366_100011218213 [0,2,0,0,0,0|2,0,0]=4 12407 B12R1.385 CSCNc1ccc(c(c1)F)F 2230a_100000210724_100011218213 [0,2,0,0,0,0|2,0,0]=4 12408 B12R1.385 CSCNc1ccc(c(c1)F)F 34a_100000210724_100011218213 [0,2,0,0,0,0|2,0,0]=4 12409 B12R1.385 CSCNc1ccc(c(c1)F)I 34a_100011356925_100011218213 [0,2,0,0,0,0|2,0,0]=4 12410 B12R1.385 CSCNc1ccc(c(c1)F)O 34a_100011220035_100011218213 [0,2,0,0,0,0|1,0,0]=3 12411 B12R1.385 CSCNc1ccc(c(c1)I)Br 34a_100000750459_100011218213 [0,2,0,0,0,0|2,0,0]=4 12412 B12R1.385 CSCNc1ccc(c(c1)I)C 34a_100000184131_100011218213 [0,2,0,0,0,0|2,0,0]=4 12413 B12R1.385 CSCNc1ccc(c(c1)I)Cl 34a_100012360549_100011218213 [0,2,0,0,0,0|2,0,0]=4 12414 B12R1.385 CSCNc1ccc(c(c1)I)F 34a_114828291077_100011218213 [0,2,0,0,0,0|2,0,0]=4 12415 B12R1.385 CSCNc1ccc(c(c1)O)C 34a_100000759471_100011218213 [0,2,0,0,0,0|2,0,0]=4 12416 B12R1.385 CSCNc1ccc(c(c1)O)Cl 34a_100011934209_100011218213 [0,2,0,0,0,0|2,0,0]=4 12417 B12R1.385 CSCNc1ccc(c(c1)O)F 34a_100012017398_100011218213 [0,2,0,0,0,0|2,0,0]=4 12418 B12R1.385 CSCNc1ccc(c(c1)O)O 34a_100102946323_100011218213 [0,2,0,0,0,0|1,0,0]=3 12419 B12R1.385 CSCOc1cc(c(cn1)Br)C 34a_100000766222_100011218213 [0,2,0,0,0,0|2,0,0]=4 12420 B12R1.385 CSCOc1cc(c(cn1)Br)Cl 34a_100010369989_100011218213 [0,2,0,0,0,0|2,0,0]=4 12421 B12R1.385 CSCOc1cc(c(cn1)C)Br 34a_100009831917_100011218213 [0,2,0,0,0,0|2,0,0]=4 12422 B12R1.385 CSCOc1cc(c(cn1)Cl)C 34a_200000085746_100011218213 [0,2,0,0,0,0|2,0,0]=4 12423 B12R1.385 CSCOc1cc(c(cn1)Cl)Cl 34a_200000099200_100011218213 [0,2,0,0,0,0|2,0,0]=4 12424 B12R1.385 CSCOc1ccc(c(c1)Br)C 34a_100011380479_100011218213 [0,2,0,0,0,0|1,0,0]=3 12425 B12R1.385 CSCOc1ccc(c(c1)Br)Cl 34a_100011933957_100011218213 [0,2,0,0,0,0|1,0,0]=3 12426 B12R1.385 CSCOc1ccc(c(c1)Br)F 34a_100000693481_100011218213 [0,2,0,0,0,0|1,0,0]=3 12427 B12R1.385 CSCOc1ccc(c(c1)Br)I 34a_100000701344_100011218213 [0,2,0,0,0,0|1,0,0]=3 12428 B12R1.385 CSCOc1ccc(c(c1)Br)N 34a_100012001276_100011218213 [0,2,0,0,0,0|1,0,0]=3 12429 B12R1.385 CSCOc1ccc(c(c1)C)Br 34a_100000690111_100011218213 [0,2,0,0,0,0|1,0,0]=3 12430 B12R1.385 CSCOc1ccc(c(c1)C)C 34a_100000210932_100011218213 [0,2,0,0,0,0|1,0,0]=3 12431 B12R1.385 CSCOc1ccc(c(c1)C)Cl 34a_100000211092_100011218213 [0,2,0,0,0,0|1,0,0]=3 12432 B12R1.385 CSCOc1ccc(c(c1)C)F 34a_100000751312_100011218213 [0,2,0,0,0,0|1,0,0]=3 12433 B12R1.385 CSCOc1ccc(c(c1)C)I 34a_100000729255_100011218213 [0,2,0,0,0,0|1,0,0]=3 12434 B12R1.385 CSCOc1ccc(c(c1)C)N 34a_100000756630_100011218213 [0,2,0,0,0,0|1,0,0]=3 12435 B12R1.385 CSCOc1ccc(c(c1)Cl)Br 34a_100011215161_100011218213 [0,2,0,0,0,0|1,0,0]=3 12436 B12R1.385 CSCOc1ccc(c(c1)Cl)C 34a_100011265682_100011218213 [0,2,0,0,0,0|1,0,0]=3 12437 B12R1.385 CSCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100011218213 [0,2,0,0,0,0|1,0,0]=3 12438 B12R1.385 CSCOc1ccc(c(c1)Cl)F 34a_100000211030_100011218213 [0,2,0,0,0,0|1,0,0]=3 12439 B12R1.385 CSCOc1ccc(c(c1)Cl)I 34a_100000047559_100011218213 [0,2,0,0,0,0|1,0,0]=3 12440 B12R1.385 CSCOc1ccc(c(c1)Cl)N 34a_100011215599_100011218213 [0,2,0,0,0,0|1,0,0]=3 12441 B12R1.385 CSCOc1ccc(c(c1)F)Br 34a_100000755031_100011218213 [0,2,0,0,0,0|1,0,0]=3 12442 B12R1.385 CSCOc1ccc(c(c1)F)C 34a_100000722560_100011218213 [0,2,0,0,0,0|1,0,0]=3 12443 B12R1.385 CSCOc1ccc(c(c1)F)Cl 34a_100000691581_100011218213 [0,2,0,0,0,0|1,0,0]=3 12444 B12R1.385 CSCOc1ccc(c(c1)F)F 34a_100000181275_100011218213 [0,2,0,0,0,0|1,0,0]=3 12445 B12R1.385 CSCOc1ccc(c(c1)F)I 34a_100009990212_100011218213 [0,2,0,0,0,0|1,0,0]=3 12446 B12R1.385 CSCOc1ccc(c(c1)F)N 34a_100000759473_100011218213 [0,2,0,0,0,0|1,0,0]=3 12447 B12R1.385 CSCOc1ccc(c(c1)I)Br 34a_100012339312_100011218213 [0,2,0,0,0,0|1,0,0]=3 12448 B12R1.385 CSCOc1ccc(c(c1)I)Cl 34a_100000049588_100011218213 [0,2,0,0,0,0|1,0,0]=3 12449 B12R1.385 CSCOc1ccc(c(c1)I)N 34a_100010084370_100011218213 [0,2,0,0,0,0|1,0,0]=3 12450 B12R1.385 CSCOc1ccc(c(c1)N)Br 34a_100011999798_100011218213 [0,2,0,0,0,0|1,0,0]=3 12451 B12R1.385 CSCOc1ccc(c(c1)N)C 34a_100011216113_100011218213 [0,2,0,0,0,0|1,0,0]=3 12452 B12R1.385 CSCOc1ccc(c(c1)N)Cl 34a_100011934297_100011218213 [0,2,0,0,0,0|1,0,0]=3 12453 B12R1.385 CSCOc1ccc(c(c1)N)F 34a_100012017239_100011218213 [0,2,0,0,0,0|1,0,0]=3 12454 B12R1.385 CSCOc1ccc(c(c1)N)N 34a_100025771000_100011218213 [0,2,0,0,0,0|1,0,0]=3 12455 B12R1.385 CSCOc1ccc(c(n1)C)Br 34a_100000691680_100011218213 [0,2,0,0,0,0|2,0,0]=4 12456 B12R1.385 CSCOc1ccc(c(n1)C)Cl 34a_200009863735_100011218213 [0,2,0,0,0,0|2,0,0]=4 12457 B12R1.385 CSCOc1ccc(c(n1)F)Br 34a_100009879308_100011218213 [0,2,0,0,0,0|2,0,0]=4 12458 B12R1.385 CSCOc1cnc(c(c1)Br)C 34a_100009819603_100011218213 [0,2,0,0,0,0|2,0,0]=4 12459 B12R1.385 CSCOc1cnc(c(c1)Br)Cl 34a_100012356455_100011218213 [0,2,0,0,0,0|2,0,0]=4 12460 B12R1.385 CSCOc1cnc(c(c1)Br)F 34a_100009817267_100011218213 [0,2,0,0,0,0|2,0,0]=4 12461 B12R1.385 CSCOc1cnc(c(c1)C)Br 34a_100012000486_100011218213 [0,2,0,0,0,0|2,0,0]=4 12462 B12R1.385 CSCOc1cnc(c(c1)C)C 34a_100009854398_100011218213 [0,2,0,0,0,0|2,0,0]=4 12463 B12R1.385 CSCOc1cnc(c(c1)C)Cl 34a_100012002680_100011218213 [0,2,0,0,0,0|2,0,0]=4 12464 B12R1.385 CSCOc1cnc(c(c1)C)F 34a_100000094615_100011218213 [0,2,0,0,0,0|2,0,0]=4 12465 B12R1.385 CSCOc1cnc(c(c1)Cl)Br 34a_100010209684_100011218213 [0,2,0,0,0,0|2,0,0]=4 12466 B12R1.385 CSCOc1cnc(c(c1)Cl)Cl 34a_100000094354_100011218213 [0,2,0,0,0,0|2,0,0]=4 12467 B12R1.385 CSCOc1cnc(c(c1)Cl)F 34a_100000087088_100011218213 [0,2,0,0,0,0|2,0,0]=4 12468 B12R1.385 CSCOc1cnc(c(c1)F)Cl 34a_100000063512_100011218213 [0,2,0,0,0,0|2,0,0]=4 12469 B12R1.385 CSCSc1cc(c(cn1)O)C 62a_100011218213_100000692680 [0,2,0,0,0,0|1,1,0]=4 12470 B12R1.385 CSCSc1cc(c(cn1)O)N 62a_100009819941_100011218213 [0,2,0,0,0,0|1,1,0]=4 12471 B12R1.385 CSCSc1cc(c(cn1)O)N 62a_100011218213_100009819941 [0,2,0,0,0,0|1,1,0]=4 12472 B12R1.385 CSCSc1ccc(c(c1)Br)Br 62a_100011218213_100012356285 [0,2,0,0,0,0|1,1,0]=4 12473 B12R1.385 CSCSc1ccc(c(c1)Br)Br 62a_100012356285_100011218213 [0,2,0,0,0,0|1,1,0]=4 12474 B12R1.385 CSCSc1ccc(c(c1)Br)C 62a_100011218213_100011847877 [0,2,0,0,0,0|1,1,0]=4 12475 B12R1.385 CSCSc1ccc(c(c1)Br)C 62a_100011847877_100011218213 [0,2,0,0,0,0|1,1,0]=4 12476 B12R1.385 CSCSc1ccc(c(c1)Br)Cl 62a_100011218213_100012353702 [0,2,0,0,0,0|1,1,0]=4 12477 B12R1.385 CSCSc1ccc(c(c1)Br)Cl 62a_100012353702_100011218213 [0,2,0,0,0,0|1,1,0]=4 12478 B12R1.385 CSCSc1ccc(c(c1)Br)F 62a_100011218213_100012047266 [0,2,0,0,0,0|1,1,0]=4 12479 B12R1.385 CSCSc1ccc(c(c1)Br)F 62a_100012047266_100011218213 [0,2,0,0,0,0|1,1,0]=4 12480 B12R1.385 CSCSc1ccc(c(c1)Br)N 62a_100000750455_100011218213 [0,2,0,0,0,0|1,1,0]=4 12481 B12R1.385 CSCSc1ccc(c(c1)Br)N 62a_100011218213_100000750455 [0,2,0,0,0,0|1,1,0]=4 12482 B12R1.385 CSCSc1ccc(c(c1)Br)O 62a_100011218213_100012361655 [0,2,0,0,0,0|0,1,0]=3 12483 B12R1.385 CSCSc1ccc(c(c1)Br)O 62a_100012361655_100011218213 [0,2,0,0,0,0|0,1,0]=3 12484 B12R1.385 CSCSc1ccc(c(c1)C)Br 62a_100009813585_100011218213 [0,2,0,0,0,0|1,1,0]=4 12485 B12R1.385 CSCSc1ccc(c(c1)C)Br 62a_100011218213_100009813585 [0,2,0,0,0,0|1,1,0]=4 12486 B12R1.385 CSCSc1ccc(c(c1)C)C 62a_100011215607_100011218213 [0,2,0,0,0,0|1,1,0]=4 12487 B12R1.385 CSCSc1ccc(c(c1)C)C 62a_100011218213_100011215607 [0,2,0,0,0,0|1,1,0]=4 12488 B12R1.385 CSCSc1ccc(c(c1)C)Cl 62a_100000049509_100011218213 [0,2,0,0,0,0|1,1,0]=4 12489 B12R1.385 CSCSc1ccc(c(c1)C)Cl 62a_100011218213_100000049509 [0,2,0,0,0,0|1,1,0]=4 12490 B12R1.385 CSCSc1ccc(c(c1)C)F 62a_100011218213_100011218330 [0,2,0,0,0,0|1,1,0]=4 12491 B12R1.385 CSCSc1ccc(c(c1)C)F 62a_100011218330_100011218213 [0,2,0,0,0,0|1,1,0]=4 12492 B12R1.385 CSCSc1ccc(c(c1)C)N 62a_100000211769_100011218213 [0,2,0,0,0,0|1,1,0]=4 12493 B12R1.385 CSCSc1ccc(c(c1)C)N 62a_100011218213_100000211769 [0,2,0,0,0,0|1,1,0]=4 12494 B12R1.385 CSCSc1ccc(c(c1)C)O 62a_100011218213_100000186361 [0,2,0,0,0,0|0,1,0]=3 12495 B12R1.385 CSCSc1ccc(c(c1)Cl)Br 62a_100011218213_100012047281 [0,2,0,0,0,0|1,1,0]=4 12496 B12R1.385 CSCSc1ccc(c(c1)Cl)Br 62a_100012047281_100011218213 [0,2,0,0,0,0|1,1,0]=4 12497 B12R1.385 CSCSc1ccc(c(c1)Cl)C 62a_100011216363_100011218213 [0,2,0,0,0,0|1,1,0]=4 12498 B12R1.385 CSCSc1ccc(c(c1)Cl)C 62a_100011218213_100011216363 [0,2,0,0,0,0|1,1,0]=4 12499 B12R1.385 CSCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100011218213 [0,2,0,0,0,0|1,1,0]=4 12500 B12R1.385 CSCSc1ccc(c(c1)Cl)Cl 62a_100011218213_100011214914 [0,2,0,0,0,0|1,1,0]=4 12501 B12R1.385 CSCSc1ccc(c(c1)Cl)F 62a_100011215976_100011218213 [0,2,0,0,0,0|1,1,0]=4 12502 B12R1.385 CSCSc1ccc(c(c1)Cl)F 62a_100011218213_100011215976 [0,2,0,0,0,0|1,1,0]=4 12503 B12R1.385 CSCSc1ccc(c(c1)Cl)N 62a_100011218065_100011218213 [0,2,0,0,0,0|1,1,0]=4 12504 B12R1.385 CSCSc1ccc(c(c1)Cl)N 62a_100011218213_100011218065 [0,2,0,0,0,0|1,1,0]=4 12505 B12R1.385 CSCSc1ccc(c(c1)Cl)O 62a_100011218213_100012360047 [0,2,0,0,0,0|0,1,0]=3 12506 B12R1.385 CSCSc1ccc(c(c1)Cl)O 62a_100012360047_100011218213 [0,2,0,0,0,0|0,1,0]=3 12507 B12R1.385 CSCSc1ccc(c(c1)F)Br 62a_100000685389_100011218213 [0,2,0,0,0,0|1,1,0]=4 12508 B12R1.385 CSCSc1ccc(c(c1)F)Br 62a_100011218213_100000685389 [0,2,0,0,0,0|1,1,0]=4 12509 B12R1.385 CSCSc1ccc(c(c1)F)C 62a_100000720648_100011218213 [0,2,0,0,0,0|1,1,0]=4 12510 B12R1.385 CSCSc1ccc(c(c1)F)C 62a_100011218213_100000720648 [0,2,0,0,0,0|1,1,0]=4 12511 B12R1.385 CSCSc1ccc(c(c1)F)Cl 62a_100011216805_100011218213 [0,2,0,0,0,0|1,1,0]=4 12512 B12R1.385 CSCSc1ccc(c(c1)F)Cl 62a_100011218213_100011216805 [0,2,0,0,0,0|1,1,0]=4 12513 B12R1.385 CSCSc1ccc(c(c1)F)F 62a_100000703953_100011218213 [0,2,0,0,0,0|1,1,0]=4 12514 B12R1.385 CSCSc1ccc(c(c1)F)F 62a_100011218213_100000703953 [0,2,0,0,0,0|1,1,0]=4 12515 B12R1.385 CSCSc1ccc(c(c1)F)N 62a_100011215594_100011218213 [0,2,0,0,0,0|1,1,0]=4 12516 B12R1.385 CSCSc1ccc(c(c1)F)N 62a_100011218213_100011215594 [0,2,0,0,0,0|1,1,0]=4 12517 B12R1.385 CSCSc1ccc(c(c1)F)O 62a_100000185481_100011218213 [0,2,0,0,0,0|0,1,0]=3 12518 B12R1.385 CSCSc1ccc(c(c1)F)O 62a_100011218213_100000185481 [0,2,0,0,0,0|0,1,0]=3 12519 B12R1.385 CSCSc1ccc(c(c1)N)Br 62a_100000750456_100011218213 [0,2,0,0,0,0|1,1,0]=4 12520 B12R1.385 CSCSc1ccc(c(c1)N)Br 62a_100011218213_100000750456 [0,2,0,0,0,0|1,1,0]=4 12521 B12R1.385 CSCSc1ccc(c(c1)N)C 62a_100000761890_100011218213 [0,2,0,0,0,0|1,1,0]=4 12522 B12R1.385 CSCSc1ccc(c(c1)N)C 62a_100011218213_100000761890 [0,2,0,0,0,0|1,1,0]=4 12523 B12R1.385 CSCSc1ccc(c(c1)N)Cl 62a_100011218213_200000761891 [0,2,0,0,0,0|1,1,0]=4 12524 B12R1.385 CSCSc1ccc(c(c1)N)Cl 62a_200000761891_100011218213 [0,2,0,0,0,0|1,1,0]=4 12525 B12R1.385 CSCSc1ccc(c(c1)N)F 62a_100000740924_100011218213 [0,2,0,0,0,0|1,1,0]=4 12526 B12R1.385 CSCSc1ccc(c(c1)N)F 62a_100011218213_100000740924 [0,2,0,0,0,0|1,1,0]=4 12527 B12R1.385 CSCSc1ccc(c(c1)N)N 62a_100000741789_100011218213 [0,2,0,0,0,0|1,1,0]=4 12528 B12R1.385 CSCSc1ccc(c(c1)N)N 62a_100011218213_100011534411 [0,2,0,0,0,0|1,1,0]=4 12529 B12R1.385 CSCSc1ccc(c(c1)N)O 62a_100000752626_100011218213 [0,2,0,0,0,0|0,1,0]=3 12530 B12R1.385 CSCSc1ccc(c(c1)N)O 62a_100011218213_100000752626 [0,2,0,0,0,0|0,1,0]=3 12531 B12R1.385 CSCSc1ccc(c(c1)O)Br 62a_100011218213_100012356990 [0,2,0,0,0,0|1,1,0]=4 12532 B12R1.385 CSCSc1ccc(c(c1)O)Br 62a_100012356990_100011218213 [0,2,0,0,0,0|1,1,0]=4 12533 B12R1.385 CSCSc1ccc(c(c1)O)C 62a_100000685420_100011218213 [0,2,0,0,0,0|1,1,0]=4 12534 B12R1.385 CSCSc1ccc(c(c1)O)C 62a_100011218213_100000685420 [0,2,0,0,0,0|1,1,0]=4 12535 B12R1.385 CSCSc1ccc(c(c1)O)Cl 62a_100011218213_100011356854 [0,2,0,0,0,0|1,1,0]=4 12536 B12R1.385 CSCSc1ccc(c(c1)O)Cl 62a_100011356854_100011218213 [0,2,0,0,0,0|1,1,0]=4 12537 B12R1.385 CSCSc1ccc(c(c1)O)F 62a_100000686035_100011218213 [0,2,0,0,0,0|1,1,0]=4 12538 B12R1.385 CSCSc1ccc(c(c1)O)F 62a_100011218213_100000686035 [0,2,0,0,0,0|1,1,0]=4 12539 B12R1.385 CSCSc1ccc(c(c1)O)N 62a_100000739049_100011218213 [0,2,0,0,0,0|1,1,0]=4 12540 B12R1.385 CSCSc1ccc(c(c1)O)N 62a_100011218213_100000739049 [0,2,0,0,0,0|1,1,0]=4 12541 B12R1.385 CSCSc1ccc(c(c1)O)O 62a_100011218213_100009813601 [0,2,0,0,0,0|0,1,0]=3 12542 B12R1.385 CSCSc1ccc(c(n1)Br)O 62a_100000725334_100011218213 [0,2,0,0,0,0|1,1,0]=4 12543 B12R1.385 CSCSc1ccc(c(n1)Br)O 62a_100011218213_100000725334 [0,2,0,0,0,0|1,1,0]=4 12544 B12R1.385 CSCSc1ccc(c(n1)C)O 62a_100010233687_100011218213 [0,2,0,0,0,0|1,1,0]=4 12545 B12R1.385 CSCSc1ccc(c(n1)C)O 62a_100011218213_100010233687 [0,2,0,0,0,0|1,1,0]=4 12546 B12R1.385 CSCSc1ccc(c(n1)Cl)O 62a_100011218213_100000721234 [0,2,0,0,0,0|1,1,0]=4 12547 B12R1.385 CSCSc1ccc(c(n1)F)O 62a_100009819667_100011218213 [0,2,0,0,0,0|1,1,0]=4 12548 B12R1.385 CSCSc1ccc(c(n1)F)O 62a_100011218213_100009819667 [0,2,0,0,0,0|1,1,0]=4 12549 B12R1.385 CSCSc1ccc(c(n1)N)O 62a_100000685527_100011218213 [0,2,0,0,0,0|1,1,0]=4 12550 B12R1.385 CSCSc1ccc(c(n1)N)O 62a_100011218213_100000685527 [0,2,0,0,0,0|1,1,0]=4 12551 B12R1.385 CSCSc1cnc(c(c1)C)O 62a_100000685391_100011218213 [0,2,0,0,0,0|1,1,0]=4 12552 B12R1.385 CSCSc1cnc(c(c1)C)O 62a_100011218213_100000685391 [0,2,0,0,0,0|1,1,0]=4 12553 B12R1.385 CSCSc1cnc(c(c1)Cl)O 62a_100010238531_100011218213 [0,2,0,0,0,0|1,1,0]=4 12554 B12R1.385 CSCSc1cnc(c(c1)Cl)O 62a_100011218213_100010238531 [0,2,0,0,0,0|1,1,0]=4 12555 B12R1.385 CSCSc1cnc(c(c1)N)O 62a_100000743729_100011218213 [0,2,0,0,0,0|1,1,0]=4 12556 B12R1.385 CSCSc1cnc(c(c1)N)O 62a_100011218213_100000743729 [0,2,0,0,0,0|1,1,0]=4 12557 B12R1.385 Cc1cc(ccc1Br)COCF 34a_100000718852_100015361967 [0,2,0,0,0,0|2,0,0]=4 12558 B12R1.385 Cc1cc(ccc1Br)COCF 7a_100000718852_100015361967 [0,2,0,0,0,0|2,0,0]=4 12559 B12R1.385 Cc1cc(ccc1Br)NCCF 2230a_100000210723_100011217306 [0,2,0,0,0,0|2,0,0]=4 12560 B12R1.385 Cc1cc(ccc1Br)NCCF 34a_100000210723_100011217306 [0,2,0,0,0,0|2,0,0]=4 12561 B12R1.385 Cc1cc(ccc1Br)NCCF 7a_100000210723_100011217306 [0,2,0,0,0,0|2,0,0]=4 12562 B12R1.385 Cc1cc(ccc1Br)NCCO 2230a_100000210723_100000211926 [0,2,0,0,0,0|2,0,0]=4 12563 B12R1.385 Cc1cc(ccc1Br)NCCO 34a_100000210723_100000211926 [0,2,0,0,0,0|2,0,0]=4 12564 B12R1.385 Cc1cc(ccc1Br)NCCO 7a_100000210723_100000211926 [0,2,0,0,0,0|2,0,0]=4 12565 B12R1.385 Cc1cc(ccc1Br)OCC#N 7a_100000690111_100011215382 [0,2,0,0,0,0|1,0,1]=4 12566 B12R1.385 Cc1cc(ccc1Br)OCC=O 34a_100000690111_200009817547 [0,2,0,0,0,0|1,0,1]=4 12567 B12R1.385 Cc1cc(ccc1Br)OCC=O 7a_100000690111_200015260668 [0,2,0,0,0,0|1,0,1]=4 12568 B12R1.385 Cc1cc(ccc1Br)OCCF 34a_100000690111_100011217306 [0,2,0,0,0,0|1,0,0]=3 12569 B12R1.385 Cc1cc(ccc1Br)OCCF 7a_100000690111_100011217306 [0,2,0,0,0,0|1,0,0]=3 12570 B12R1.385 Cc1cc(ccc1Br)OCCO 34a_100000690111_100000211926 [0,2,0,0,0,0|1,0,0]=3 12571 B12R1.385 Cc1cc(ccc1Br)OCCO 7a_100000690111_100000211926 [0,2,0,0,0,0|1,0,0]=3 12572 B12R1.385 Cc1cc(ccc1Br)SCCF 62a_100009813585_100011217306 [0,2,0,0,0,0|1,1,0]=4 12573 B12R1.385 Cc1cc(ccc1Br)SCCF 62a_100011217306_100009813585 [0,2,0,0,0,0|1,1,0]=4 12574 B12R1.385 Cc1cc(ccc1Br)SCCO 62a_100000211926_100009813585 [0,2,0,0,0,0|1,1,0]=4 12575 B12R1.385 Cc1cc(ccc1Br)SCCO 62a_100009813585_100000211926 [0,2,0,0,0,0|1,1,0]=4 12576 B12R1.385 Cc1cc(ccc1Cl)NCCF 2230a_100000187808_100011217306 [0,2,0,0,0,0|2,0,0]=4 12577 B12R1.385 Cc1cc(ccc1Cl)NCCF 34a_100000187808_100011217306 [0,2,0,0,0,0|2,0,0]=4 12578 B12R1.385 Cc1cc(ccc1Cl)NCCF 7a_100000187808_100011217306 [0,2,0,0,0,0|2,0,0]=4 12579 B12R1.385 Cc1cc(ccc1Cl)NCCO 2230a_100000187808_100000211926 [0,2,0,0,0,0|2,0,0]=4 12580 B12R1.385 Cc1cc(ccc1Cl)NCCO 34a_100000187808_100000211926 [0,2,0,0,0,0|2,0,0]=4 12581 B12R1.385 Cc1cc(ccc1Cl)NCCO 7a_100000187808_100000211926 [0,2,0,0,0,0|2,0,0]=4 12582 B12R1.385 Cc1cc(ccc1Cl)OCC#N 7a_100000211092_100011215382 [0,2,0,0,0,0|1,0,1]=4 12583 B12R1.385 Cc1cc(ccc1Cl)OCC=O 34a_100000211092_200009817547 [0,2,0,0,0,0|1,0,1]=4 12584 B12R1.385 Cc1cc(ccc1Cl)OCC=O 7a_100000211092_200015260668 [0,2,0,0,0,0|1,0,1]=4 12585 B12R1.385 Cc1cc(ccc1Cl)OCCF 34a_100000211092_100011217306 [0,2,0,0,0,0|1,0,0]=3 12586 B12R1.385 Cc1cc(ccc1Cl)OCCF 7a_100000211092_100011217306 [0,2,0,0,0,0|1,0,0]=3 12587 B12R1.385 Cc1cc(ccc1Cl)OCCO 34a_100000211092_100000211926 [0,2,0,0,0,0|1,0,0]=3 12588 B12R1.385 Cc1cc(ccc1Cl)OCCO 7a_100000211092_100000211926 [0,2,0,0,0,0|1,0,0]=3 12589 B12R1.385 Cc1cc(ccc1Cl)SCCF 62a_100000049509_100011217306 [0,2,0,0,0,0|1,1,0]=4 12590 B12R1.385 Cc1cc(ccc1Cl)SCCF 62a_100011217306_100000049509 [0,2,0,0,0,0|1,1,0]=4 12591 B12R1.385 Cc1cc(ccc1Cl)SCCO 62a_100000049509_100000211926 [0,2,0,0,0,0|1,1,0]=4 12592 B12R1.385 Cc1cc(ccc1Cl)SCCO 62a_100000211926_100000049509 [0,2,0,0,0,0|1,1,0]=4 12593 B12R1.385 Cc1cc(ccc1F)COCF 34a_100011219793_100015361967 [0,2,0,0,0,0|2,0,0]=4 12594 B12R1.385 Cc1cc(ccc1F)COCF 7a_100011219793_100015361967 [0,2,0,0,0,0|2,0,0]=4 12595 B12R1.385 Cc1cc(ccc1F)NCCF 2230a_100000750164_100011217306 [0,2,0,0,0,0|2,0,0]=4 12596 B12R1.385 Cc1cc(ccc1F)NCCF 34a_100000750164_100011217306 [0,2,0,0,0,0|2,0,0]=4 12597 B12R1.385 Cc1cc(ccc1F)NCCF 7a_100000750164_100011217306 [0,2,0,0,0,0|2,0,0]=4 12598 B12R1.385 Cc1cc(ccc1F)NCCO 2230a_100000750164_100000211926 [0,2,0,0,0,0|2,0,0]=4 12599 B12R1.385 Cc1cc(ccc1F)NCCO 34a_100000750164_100000211926 [0,2,0,0,0,0|2,0,0]=4 12600 B12R1.385 Cc1cc(ccc1F)NCCO 7a_100000750164_100000211926 [0,2,0,0,0,0|2,0,0]=4 12601 B12R1.385 Cc1cc(ccc1F)OCC#N 7a_100000751312_100011215382 [0,2,0,0,0,0|1,0,1]=4 12602 B12R1.385 Cc1cc(ccc1F)OCC=O 34a_100000751312_200009817547 [0,2,0,0,0,0|1,0,1]=4 12603 B12R1.385 Cc1cc(ccc1F)OCC=O 7a_100000751312_200015260668 [0,2,0,0,0,0|1,0,1]=4 12604 B12R1.385 Cc1cc(ccc1F)OCCF 34a_100000751312_100011217306 [0,2,0,0,0,0|1,0,0]=3 12605 B12R1.385 Cc1cc(ccc1F)OCCF 7a_100000751312_100011217306 [0,2,0,0,0,0|1,0,0]=3 12606 B12R1.385 Cc1cc(ccc1F)OCCO 34a_100000751312_100000211926 [0,2,0,0,0,0|1,0,0]=3 12607 B12R1.385 Cc1cc(ccc1F)OCCO 7a_100000751312_100000211926 [0,2,0,0,0,0|1,0,0]=3 12608 B12R1.385 Cc1cc(ccc1F)SCCF 62a_100011217306_100011218330 [0,2,0,0,0,0|1,1,0]=4 12609 B12R1.385 Cc1cc(ccc1F)SCCF 62a_100011218330_100011217306 [0,2,0,0,0,0|1,1,0]=4 12610 B12R1.385 Cc1cc(ccc1F)SCCO 62a_100000211926_100011218330 [0,2,0,0,0,0|1,1,0]=4 12611 B12R1.385 Cc1cc(ccc1F)SCCO 62a_100011218330_100000211926 [0,2,0,0,0,0|1,1,0]=4 12612 B12R1.385 Cc1cc(ccc1I)NCCF 34a_100000198070_100011217306 [0,2,0,0,0,0|2,0,0]=4 12613 B12R1.385 Cc1cc(ccc1I)NCCF 7a_100000198070_100011217306 [0,2,0,0,0,0|2,0,0]=4 12614 B12R1.385 Cc1cc(ccc1I)NCCO 34a_100000198070_100000211926 [0,2,0,0,0,0|2,0,0]=4 12615 B12R1.385 Cc1cc(ccc1I)NCCO 7a_100000198070_100000211926 [0,2,0,0,0,0|2,0,0]=4 12616 B12R1.385 Cc1cc(ccc1I)OCC#N 7a_100000729255_100011215382 [0,2,0,0,0,0|1,0,1]=4 12617 B12R1.385 Cc1cc(ccc1I)OCC=O 34a_100000729255_200009817547 [0,2,0,0,0,0|1,0,1]=4 12618 B12R1.385 Cc1cc(ccc1I)OCC=O 7a_100000729255_200015260668 [0,2,0,0,0,0|1,0,1]=4 12619 B12R1.385 Cc1cc(ccc1I)OCCF 34a_100000729255_100011217306 [0,2,0,0,0,0|1,0,0]=3 12620 B12R1.385 Cc1cc(ccc1I)OCCF 7a_100000729255_100011217306 [0,2,0,0,0,0|1,0,0]=3 12621 B12R1.385 Cc1cc(ccc1I)OCCO 34a_100000729255_100000211926 [0,2,0,0,0,0|1,0,0]=3 12622 B12R1.385 Cc1cc(ccc1I)OCCO 7a_100000729255_100000211926 [0,2,0,0,0,0|1,0,0]=3 12623 B12R1.385 Cc1cc(ccc1N)COCF 34a_200011997030_100015361967 [0,2,0,0,0,0|2,0,0]=4 12624 B12R1.385 Cc1cc(ccc1N)OCC#N 7a_100000756630_100011215382 [0,2,0,0,0,0|1,0,1]=4 12625 B12R1.385 Cc1cc(ccc1N)OCC=O 34a_100000756630_200009817547 [0,2,0,0,0,0|1,0,1]=4 12626 B12R1.385 Cc1cc(ccc1N)OCC=O 7a_100000756630_200015260668 [0,2,0,0,0,0|1,0,1]=4 12627 B12R1.385 Cc1cc(ccc1N)OCCF 34a_100000756630_100011217306 [0,2,0,0,0,0|1,0,0]=3 12628 B12R1.385 Cc1cc(ccc1N)OCCF 7a_100000756630_100011217306 [0,2,0,0,0,0|1,0,0]=3 12629 B12R1.385 Cc1cc(ccc1N)OCCO 34a_100000756630_100000211926 [0,2,0,0,0,0|1,0,0]=3 12630 B12R1.385 Cc1cc(ccc1N)OCCO 7a_100000756630_100000211926 [0,2,0,0,0,0|1,0,0]=3 12631 B12R1.385 Cc1cc(ccc1N)SCCF 62a_100000211769_100011217306 [0,2,0,0,0,0|1,1,0]=4 12632 B12R1.385 Cc1cc(ccc1N)SCCF 62a_100011217306_100000211769 [0,2,0,0,0,0|1,1,0]=4 12633 B12R1.385 Cc1cc(ccc1N)SCCO 62a_100000211769_100000211926 [0,2,0,0,0,0|1,1,0]=4 12634 B12R1.385 Cc1cc(ccc1N)SCCO 62a_100000211926_100000211769 [0,2,0,0,0,0|1,1,0]=4 12635 B12R1.385 Cc1cc(ccc1O)NCC#N 7a_100011218179_100011215382 [0,2,0,0,0,0|1,0,1]=4 12636 B12R1.385 Cc1cc(ccc1O)NCC=O 34a_100011218179_200009817547 [0,2,0,0,0,0|1,0,1]=4 12637 B12R1.385 Cc1cc(ccc1O)NCC=O 7a_100011218179_200015260668 [0,2,0,0,0,0|1,0,1]=4 12638 B12R1.385 Cc1cc(ccc1O)NCCF 34a_100011218179_100011217306 [0,2,0,0,0,0|1,0,0]=3 12639 B12R1.385 Cc1cc(ccc1O)NCCF 7a_100011218179_100011217306 [0,2,0,0,0,0|1,0,0]=3 12640 B12R1.385 Cc1cc(ccc1O)NCCO 34a_100011218179_100000211926 [0,2,0,0,0,0|1,0,0]=3 12641 B12R1.385 Cc1cc(ccc1O)NCCO 7a_100011218179_100000211926 [0,2,0,0,0,0|1,0,0]=3 12642 B12R1.385 Cc1cc(ccc1O)SCC#N 62a_100011215382_100000186361 [0,2,0,0,0,0|0,1,1]=4 12643 B12R1.385 Cc1cc(ccc1O)SCC=O 62a_200015260668_100000186361 [0,2,0,0,0,0|0,1,1]=4 12644 B12R1.385 Cc1cc(ccc1O)SCCF 62a_100011217306_100000186361 [0,2,0,0,0,0|0,1,0]=3 12645 B12R1.385 Cc1cc(ccc1O)SCCO 62a_100000211926_100000186361 [0,2,0,0,0,0|0,1,0]=3 12646 B12R1.385 Cc1cc(cnc1Br)OCCF 34a_100012000486_100011217306 [0,2,0,0,0,0|2,0,0]=4 12647 B12R1.385 Cc1cc(cnc1Br)OCCF 7a_100012000486_100011217306 [0,2,0,0,0,0|2,0,0]=4 12648 B12R1.385 Cc1cc(cnc1Br)OCCO 34a_100012000486_100000211926 [0,2,0,0,0,0|2,0,0]=4 12649 B12R1.385 Cc1cc(cnc1Br)OCCO 7a_100012000486_100000211926 [0,2,0,0,0,0|2,0,0]=4 12650 B12R1.385 Cc1cc(cnc1C)OCCF 34a_100009854398_100011217306 [0,2,0,0,0,0|2,0,0]=4 12651 B12R1.385 Cc1cc(cnc1C)OCCF 7a_100009854398_100011217306 [0,2,0,0,0,0|2,0,0]=4 12652 B12R1.385 Cc1cc(cnc1C)OCCO 34a_100009854398_100000211926 [0,2,0,0,0,0|2,0,0]=4 12653 B12R1.385 Cc1cc(cnc1C)OCCO 7a_100009854398_100000211926 [0,2,0,0,0,0|2,0,0]=4 12654 B12R1.385 Cc1cc(cnc1Cl)OCCF 34a_100012002680_100011217306 [0,2,0,0,0,0|2,0,0]=4 12655 B12R1.385 Cc1cc(cnc1Cl)OCCF 7a_100012002680_100011217306 [0,2,0,0,0,0|2,0,0]=4 12656 B12R1.385 Cc1cc(cnc1Cl)OCCO 34a_100012002680_100000211926 [0,2,0,0,0,0|2,0,0]=4 12657 B12R1.385 Cc1cc(cnc1Cl)OCCO 7a_100012002680_100000211926 [0,2,0,0,0,0|2,0,0]=4 12658 B12R1.385 Cc1cc(cnc1F)OCCF 34a_100000094615_100011217306 [0,2,0,0,0,0|2,0,0]=4 12659 B12R1.385 Cc1cc(cnc1F)OCCF 7a_100000094615_100011217306 [0,2,0,0,0,0|2,0,0]=4 12660 B12R1.385 Cc1cc(cnc1F)OCCO 34a_100000094615_100000211926 [0,2,0,0,0,0|2,0,0]=4 12661 B12R1.385 Cc1cc(cnc1F)OCCO 7a_100000094615_100000211926 [0,2,0,0,0,0|2,0,0]=4 12662 B12R1.385 Cc1cc(cnc1O)SCCF 62a_100000685391_100011217306 [0,2,0,0,0,0|1,1,0]=4 12663 B12R1.385 Cc1cc(cnc1O)SCCF 62a_100011217306_100000685391 [0,2,0,0,0,0|1,1,0]=4 12664 B12R1.385 Cc1cc(cnc1O)SCCO 62a_100000211926_100000685391 [0,2,0,0,0,0|1,1,0]=4 12665 B12R1.385 Cc1cc(cnc1O)SCCO 62a_100000685391_100000211926 [0,2,0,0,0,0|1,1,0]=4 12666 B12R1.385 Cc1cc(ncc1Br)OCCF 34a_100000766222_100011217306 [0,2,0,0,0,0|2,0,0]=4 12667 B12R1.385 Cc1cc(ncc1Br)OCCO 34a_100000766222_100000211926 [0,2,0,0,0,0|2,0,0]=4 12668 B12R1.385 Cc1cc(ncc1Cl)OCCF 34a_200000085746_100011217306 [0,2,0,0,0,0|2,0,0]=4 12669 B12R1.385 Cc1cc(ncc1Cl)OCCO 34a_200000085746_100000211926 [0,2,0,0,0,0|2,0,0]=4 12670 B12R1.385 Cc1cc(ncc1O)NCCO 271570a_203496583355_100012352624 [0,2,0,0,0,0|2,0,0]=4 12671 B12R1.385 Cc1cc(ncc1O)SCCF 62a_100011217306_100000692680 [0,2,0,0,0,0|1,1,0]=4 12672 B12R1.385 Cc1cc(ncc1O)SCCO 62a_100000211926_100000692680 [0,2,0,0,0,0|1,1,0]=4 12673 B12R1.385 Cc1ccc(cc1Br)COCF 34a_100000708995_100015361967 [0,2,0,0,0,0|2,0,0]=4 12674 B12R1.385 Cc1ccc(cc1Br)COCF 7a_100000708995_100015361967 [0,2,0,0,0,0|2,0,0]=4 12675 B12R1.385 Cc1ccc(cc1Br)NCCF 2230a_100000736455_100011217306 [0,2,0,0,0,0|2,0,0]=4 12676 B12R1.385 Cc1ccc(cc1Br)NCCF 34a_100000736455_100011217306 [0,2,0,0,0,0|2,0,0]=4 12677 B12R1.385 Cc1ccc(cc1Br)NCCF 7a_100000736455_100011217306 [0,2,0,0,0,0|2,0,0]=4 12678 B12R1.385 Cc1ccc(cc1Br)NCCO 2230a_100000736455_100000211926 [0,2,0,0,0,0|2,0,0]=4 12679 B12R1.385 Cc1ccc(cc1Br)NCCO 34a_100000736455_100000211926 [0,2,0,0,0,0|2,0,0]=4 12680 B12R1.385 Cc1ccc(cc1Br)NCCO 7a_100000736455_100000211926 [0,2,0,0,0,0|2,0,0]=4 12681 B12R1.385 Cc1ccc(cc1Br)OCC#N 7a_100011380479_100011215382 [0,2,0,0,0,0|1,0,1]=4 12682 B12R1.385 Cc1ccc(cc1Br)OCC=O 34a_100011380479_200009817547 [0,2,0,0,0,0|1,0,1]=4 12683 B12R1.385 Cc1ccc(cc1Br)OCC=O 7a_100011380479_200015260668 [0,2,0,0,0,0|1,0,1]=4 12684 B12R1.385 Cc1ccc(cc1Br)OCCF 34a_100011380479_100011217306 [0,2,0,0,0,0|1,0,0]=3 12685 B12R1.385 Cc1ccc(cc1Br)OCCF 7a_100011380479_100011217306 [0,2,0,0,0,0|1,0,0]=3 12686 B12R1.385 Cc1ccc(cc1Br)OCCO 34a_100011380479_100000211926 [0,2,0,0,0,0|1,0,0]=3 12687 B12R1.385 Cc1ccc(cc1Br)OCCO 7a_100011380479_100000211926 [0,2,0,0,0,0|1,0,0]=3 12688 B12R1.385 Cc1ccc(cc1Br)SCCF 62a_100011217306_100011847877 [0,2,0,0,0,0|1,1,0]=4 12689 B12R1.385 Cc1ccc(cc1Br)SCCF 62a_100011847877_100011217306 [0,2,0,0,0,0|1,1,0]=4 12690 B12R1.385 Cc1ccc(cc1Br)SCCO 62a_100000211926_100011847877 [0,2,0,0,0,0|1,1,0]=4 12691 B12R1.385 Cc1ccc(cc1Br)SCCO 62a_100011847877_100000211926 [0,2,0,0,0,0|1,1,0]=4 12692 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 2230a_100020591374_200025704644 [0,2,0,0,0,0|2,0,0]=4 12693 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 34a_100020591374_200025704644 [0,2,0,0,0,0|2,0,0]=4 12694 B12R1.385 Cc1ccc(cc1C)COCF 34a_100011215342_100015361967 [0,2,0,0,0,0|2,0,0]=4 12695 B12R1.385 Cc1ccc(cc1C)COCF 7a_100011215342_100015361967 [0,2,0,0,0,0|2,0,0]=4 12696 B12R1.385 Cc1ccc(cc1C)NCCF 2230a_100000724040_100011217306 [0,2,0,0,0,0|2,0,0]=4 12697 B12R1.385 Cc1ccc(cc1C)NCCF 34a_100000724040_100011217306 [0,2,0,0,0,0|2,0,0]=4 12698 B12R1.385 Cc1ccc(cc1C)NCCF 7a_100000724040_100011217306 [0,2,0,0,0,0|2,0,0]=4 12699 B12R1.385 Cc1ccc(cc1C)NCCO 2230a_100000724040_100000211926 [0,2,0,0,0,0|2,0,0]=4 12700 B12R1.385 Cc1ccc(cc1C)NCCO 34a_100000724040_100000211926 [0,2,0,0,0,0|2,0,0]=4 12701 B12R1.385 Cc1ccc(cc1C)NCCO 7a_100000724040_100000211926 [0,2,0,0,0,0|2,0,0]=4 12702 B12R1.385 Cc1ccc(cc1C)OCC#N 7a_100000210932_100011215382 [0,2,0,0,0,0|1,0,1]=4 12703 B12R1.385 Cc1ccc(cc1C)OCC=O 34a_100000210932_200009817547 [0,2,0,0,0,0|1,0,1]=4 12704 B12R1.385 Cc1ccc(cc1C)OCC=O 7a_100000210932_200015260668 [0,2,0,0,0,0|1,0,1]=4 12705 B12R1.385 Cc1ccc(cc1C)OCCF 34a_100000210932_100011217306 [0,2,0,0,0,0|1,0,0]=3 12706 B12R1.385 Cc1ccc(cc1C)OCCF 7a_100000210932_100011217306 [0,2,0,0,0,0|1,0,0]=3 12707 B12R1.385 Cc1ccc(cc1C)OCCO 34a_100000210932_100000211926 [0,2,0,0,0,0|1,0,0]=3 12708 B12R1.385 Cc1ccc(cc1C)OCCO 7a_100000210932_100000211926 [0,2,0,0,0,0|1,0,0]=3 12709 B12R1.385 Cc1ccc(cc1C)SCCF 62a_100011215607_100011217306 [0,2,0,0,0,0|1,1,0]=4 12710 B12R1.385 Cc1ccc(cc1C)SCCF 62a_100011217306_100011215607 [0,2,0,0,0,0|1,1,0]=4 12711 B12R1.385 Cc1ccc(cc1C)SCCO 62a_100000211926_100011215607 [0,2,0,0,0,0|1,1,0]=4 12712 B12R1.385 Cc1ccc(cc1C)SCCO 62a_100011215607_100000211926 [0,2,0,0,0,0|1,1,0]=4 12713 B12R1.385 Cc1ccc(cc1Cl)COCF 34a_100011290783_100015361967 [0,2,0,0,0,0|2,0,0]=4 12714 B12R1.385 Cc1ccc(cc1Cl)COCF 7a_100011290783_100015361967 [0,2,0,0,0,0|2,0,0]=4 12715 B12R1.385 Cc1ccc(cc1Cl)NCCF 2230a_100000188892_100011217306 [0,2,0,0,0,0|2,0,0]=4 12716 B12R1.385 Cc1ccc(cc1Cl)NCCF 34a_100000188892_100011217306 [0,2,0,0,0,0|2,0,0]=4 12717 B12R1.385 Cc1ccc(cc1Cl)NCCF 7a_100000188892_100011217306 [0,2,0,0,0,0|2,0,0]=4 12718 B12R1.385 Cc1ccc(cc1Cl)NCCO 2230a_100000188892_100000211926 [0,2,0,0,0,0|2,0,0]=4 12719 B12R1.385 Cc1ccc(cc1Cl)NCCO 34a_100000188892_100000211926 [0,2,0,0,0,0|2,0,0]=4 12720 B12R1.385 Cc1ccc(cc1Cl)NCCO 7a_100000188892_100000211926 [0,2,0,0,0,0|2,0,0]=4 12721 B12R1.385 Cc1ccc(cc1Cl)OCC#N 7a_100011265682_100011215382 [0,2,0,0,0,0|1,0,1]=4 12722 B12R1.385 Cc1ccc(cc1Cl)OCC=O 34a_100011265682_200009817547 [0,2,0,0,0,0|1,0,1]=4 12723 B12R1.385 Cc1ccc(cc1Cl)OCC=O 7a_100011265682_200015260668 [0,2,0,0,0,0|1,0,1]=4 12724 B12R1.385 Cc1ccc(cc1Cl)OCCF 34a_100011265682_100011217306 [0,2,0,0,0,0|1,0,0]=3 12725 B12R1.385 Cc1ccc(cc1Cl)OCCF 7a_100011265682_100011217306 [0,2,0,0,0,0|1,0,0]=3 12726 B12R1.385 Cc1ccc(cc1Cl)OCCO 34a_100011265682_100000211926 [0,2,0,0,0,0|1,0,0]=3 12727 B12R1.385 Cc1ccc(cc1Cl)OCCO 7a_100011265682_100000211926 [0,2,0,0,0,0|1,0,0]=3 12728 B12R1.385 Cc1ccc(cc1Cl)SCCF 62a_100011216363_100011217306 [0,2,0,0,0,0|1,1,0]=4 12729 B12R1.385 Cc1ccc(cc1Cl)SCCF 62a_100011217306_100011216363 [0,2,0,0,0,0|1,1,0]=4 12730 B12R1.385 Cc1ccc(cc1Cl)SCCO 62a_100000211926_100011216363 [0,2,0,0,0,0|1,1,0]=4 12731 B12R1.385 Cc1ccc(cc1Cl)SCCO 62a_100011216363_100000211926 [0,2,0,0,0,0|1,1,0]=4 12732 B12R1.385 Cc1ccc(cc1F)COCF 34a_100000702247_100015361967 [0,2,0,0,0,0|2,0,0]=4 12733 B12R1.385 Cc1ccc(cc1F)COCF 7a_100000702247_100015361967 [0,2,0,0,0,0|2,0,0]=4 12734 B12R1.385 Cc1ccc(cc1F)NCCF 2230a_100000210958_100011217306 [0,2,0,0,0,0|2,0,0]=4 12735 B12R1.385 Cc1ccc(cc1F)NCCF 34a_100000210958_100011217306 [0,2,0,0,0,0|2,0,0]=4 12736 B12R1.385 Cc1ccc(cc1F)NCCF 7a_100000210958_100011217306 [0,2,0,0,0,0|2,0,0]=4 12737 B12R1.385 Cc1ccc(cc1F)NCCO 2230a_100000210958_100000211926 [0,2,0,0,0,0|2,0,0]=4 12738 B12R1.385 Cc1ccc(cc1F)NCCO 34a_100000210958_100000211926 [0,2,0,0,0,0|2,0,0]=4 12739 B12R1.385 Cc1ccc(cc1F)NCCO 7a_100000210958_100000211926 [0,2,0,0,0,0|2,0,0]=4 12740 B12R1.385 Cc1ccc(cc1F)OCC#N 7a_100000722560_100011215382 [0,2,0,0,0,0|1,0,1]=4 12741 B12R1.385 Cc1ccc(cc1F)OCC=O 34a_100000722560_200009817547 [0,2,0,0,0,0|1,0,1]=4 12742 B12R1.385 Cc1ccc(cc1F)OCC=O 7a_100000722560_200015260668 [0,2,0,0,0,0|1,0,1]=4 12743 B12R1.385 Cc1ccc(cc1F)OCCF 34a_100000722560_100011217306 [0,2,0,0,0,0|1,0,0]=3 12744 B12R1.385 Cc1ccc(cc1F)OCCF 7a_100000722560_100011217306 [0,2,0,0,0,0|1,0,0]=3 12745 B12R1.385 Cc1ccc(cc1F)OCCO 34a_100000722560_100000211926 [0,2,0,0,0,0|1,0,0]=3 12746 B12R1.385 Cc1ccc(cc1F)OCCO 7a_100000722560_100000211926 [0,2,0,0,0,0|1,0,0]=3 12747 B12R1.385 Cc1ccc(cc1F)SCCF 62a_100000720648_100011217306 [0,2,0,0,0,0|1,1,0]=4 12748 B12R1.385 Cc1ccc(cc1F)SCCF 62a_100011217306_100000720648 [0,2,0,0,0,0|1,1,0]=4 12749 B12R1.385 Cc1ccc(cc1F)SCCO 62a_100000211926_100000720648 [0,2,0,0,0,0|1,1,0]=4 12750 B12R1.385 Cc1ccc(cc1F)SCCO 62a_100000720648_100000211926 [0,2,0,0,0,0|1,1,0]=4 12751 B12R1.385 Cc1ccc(cc1I)COCF 34a_100000050133_100015361967 [0,2,0,0,0,0|2,0,0]=4 12752 B12R1.385 Cc1ccc(cc1I)COCF 7a_100000050133_100015361967 [0,2,0,0,0,0|2,0,0]=4 12753 B12R1.385 Cc1ccc(cc1I)NCCF 34a_100000184131_100011217306 [0,2,0,0,0,0|2,0,0]=4 12754 B12R1.385 Cc1ccc(cc1I)NCCF 7a_100000184131_100011217306 [0,2,0,0,0,0|2,0,0]=4 12755 B12R1.385 Cc1ccc(cc1I)NCCO 34a_100000184131_100000211926 [0,2,0,0,0,0|2,0,0]=4 12756 B12R1.385 Cc1ccc(cc1I)NCCO 7a_100000184131_100000211926 [0,2,0,0,0,0|2,0,0]=4 12757 B12R1.385 Cc1ccc(cc1N)COCF 34a_100000758420_100015361967 [0,2,0,0,0,0|2,0,0]=4 12758 B12R1.385 Cc1ccc(cc1N)OCC#N 7a_100011216113_100011215382 [0,2,0,0,0,0|1,0,1]=4 12759 B12R1.385 Cc1ccc(cc1N)OCC=O 34a_100011216113_200009817547 [0,2,0,0,0,0|1,0,1]=4 12760 B12R1.385 Cc1ccc(cc1N)OCC=O 7a_100011216113_200015260668 [0,2,0,0,0,0|1,0,1]=4 12761 B12R1.385 Cc1ccc(cc1N)OCCF 34a_100011216113_100011217306 [0,2,0,0,0,0|1,0,0]=3 12762 B12R1.385 Cc1ccc(cc1N)OCCF 7a_100011216113_100011217306 [0,2,0,0,0,0|1,0,0]=3 12763 B12R1.385 Cc1ccc(cc1N)OCCO 34a_100011216113_100000211926 [0,2,0,0,0,0|1,0,0]=3 12764 B12R1.385 Cc1ccc(cc1N)OCCO 7a_100011216113_100000211926 [0,2,0,0,0,0|1,0,0]=3 12765 B12R1.385 Cc1ccc(cc1N)SCCF 62a_100000761890_100011217306 [0,2,0,0,0,0|1,1,0]=4 12766 B12R1.385 Cc1ccc(cc1N)SCCF 62a_100011217306_100000761890 [0,2,0,0,0,0|1,1,0]=4 12767 B12R1.385 Cc1ccc(cc1N)SCCO 62a_100000211926_100000761890 [0,2,0,0,0,0|1,1,0]=4 12768 B12R1.385 Cc1ccc(cc1N)SCCO 62a_100000761890_100000211926 [0,2,0,0,0,0|1,1,0]=4 12769 B12R1.385 Cc1ccc(cc1O)NCCF 34a_100000759471_100011217306 [0,2,0,0,0,0|2,0,0]=4 12770 B12R1.385 Cc1ccc(cc1O)NCCF 7a_100000759471_100011217306 [0,2,0,0,0,0|2,0,0]=4 12771 B12R1.385 Cc1ccc(cc1O)NCCO 34a_100000759471_100000211926 [0,2,0,0,0,0|2,0,0]=4 12772 B12R1.385 Cc1ccc(cc1O)NCCO 7a_100000759471_100000211926 [0,2,0,0,0,0|2,0,0]=4 12773 B12R1.385 Cc1ccc(cc1O)SCCF 62a_100000685420_100011217306 [0,2,0,0,0,0|1,1,0]=4 12774 B12R1.385 Cc1ccc(cc1O)SCCF 62a_100011217306_100000685420 [0,2,0,0,0,0|1,1,0]=4 12775 B12R1.385 Cc1ccc(cc1O)SCCO 271570a_203496583355_100010989109 [0,2,0,0,0,0|1,1,0]=4 12776 B12R1.385 Cc1ccc(cc1O)SCCO 62a_100000211926_100000685420 [0,2,0,0,0,0|1,1,0]=4 12777 B12R1.385 Cc1ccc(cc1O)SCCO 62a_100000685420_100000211926 [0,2,0,0,0,0|1,1,0]=4 12778 B12R1.385 Cc1cnc(cc1Br)OCCF 34a_100009831917_100011217306 [0,2,0,0,0,0|2,0,0]=4 12779 B12R1.385 Cc1cnc(cc1Br)OCCO 34a_100009831917_100000211926 [0,2,0,0,0,0|2,0,0]=4 12780 B12R1.385 Cc1nc(ccc1Br)OCCF 34a_100000691680_100011217306 [0,2,0,0,0,0|2,0,0]=4 12781 B12R1.385 Cc1nc(ccc1Br)OCCO 34a_100000691680_100000211926 [0,2,0,0,0,0|2,0,0]=4 12782 B12R1.385 Cc1nc(ccc1Cl)OCCF 34a_200009863735_100011217306 [0,2,0,0,0,0|2,0,0]=4 12783 B12R1.385 Cc1nc(ccc1Cl)OCCO 34a_200009863735_100000211926 [0,2,0,0,0,0|2,0,0]=4 12784 B12R1.385 Cc1nc(ccc1O)SCCF 62a_100010233687_100011217306 [0,2,0,0,0,0|1,1,0]=4 12785 B12R1.385 Cc1nc(ccc1O)SCCF 62a_100011217306_100010233687 [0,2,0,0,0,0|1,1,0]=4 12786 B12R1.385 Cc1nc(ccc1O)SCCO 62a_100000211926_100010233687 [0,2,0,0,0,0|1,1,0]=4 12787 B12R1.385 Cc1nc(ccc1O)SCCO 62a_100010233687_100000211926 [0,2,0,0,0,0|1,1,0]=4 12788 B12R1.385 Cc1ncc(cc1Br)OCCF 34a_100009819603_100011217306 [0,2,0,0,0,0|2,0,0]=4 12789 B12R1.385 Cc1ncc(cc1Br)OCCF 7a_100009819603_100011217306 [0,2,0,0,0,0|2,0,0]=4 12790 B12R1.385 Cc1ncc(cc1Br)OCCO 34a_100009819603_100000211926 [0,2,0,0,0,0|2,0,0]=4 12791 B12R1.385 Cc1ncc(cc1Br)OCCO 7a_100009819603_100000211926 [0,2,0,0,0,0|2,0,0]=4 12792 B12R1.385 FCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100011217306 [0,2,0,0,0,0|2,0,0]=4 12793 B12R1.385 FCCNc1ccc(c(c1)Br)Br 34a_100011306057_100011217306 [0,2,0,0,0,0|2,0,0]=4 12794 B12R1.385 FCCNc1ccc(c(c1)Br)Br 7a_100011306057_100011217306 [0,2,0,0,0,0|2,0,0]=4 12795 B12R1.385 FCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100011217306 [0,2,0,0,0,0|2,0,0]=4 12796 B12R1.385 FCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100011217306 [0,2,0,0,0,0|2,0,0]=4 12797 B12R1.385 FCCNc1ccc(c(c1)Br)F 2230a_100000760356_100011217306 [0,2,0,0,0,0|2,0,0]=4 12798 B12R1.385 FCCNc1ccc(c(c1)Br)F 34a_100000760356_100011217306 [0,2,0,0,0,0|2,0,0]=4 12799 B12R1.385 FCCNc1ccc(c(c1)Br)F 7a_100000760356_100011217306 [0,2,0,0,0,0|2,0,0]=4 12800 B12R1.385 FCCNc1ccc(c(c1)Br)I 34a_100000750458_100011217306 [0,2,0,0,0,0|2,0,0]=4 12801 B12R1.385 FCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100011217306 [0,2,0,0,0,0|2,0,0]=4 12802 B12R1.385 FCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100011217306 [0,2,0,0,0,0|2,0,0]=4 12803 B12R1.385 FCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100011217306 [0,2,0,0,0,0|2,0,0]=4 12804 B12R1.385 FCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100011217306 [0,2,0,0,0,0|2,0,0]=4 12805 B12R1.385 FCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100011217306 [0,2,0,0,0,0|2,0,0]=4 12806 B12R1.385 FCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100011217306 [0,2,0,0,0,0|2,0,0]=4 12807 B12R1.385 FCCNc1ccc(c(c1)Cl)F 34a_100000211060_100011217306 [0,2,0,0,0,0|2,0,0]=4 12808 B12R1.385 FCCNc1ccc(c(c1)Cl)F 7a_100000211060_100011217306 [0,2,0,0,0,0|2,0,0]=4 12809 B12R1.385 FCCNc1ccc(c(c1)Cl)I 34a_100000761885_100011217306 [0,2,0,0,0,0|2,0,0]=4 12810 B12R1.385 FCCNc1ccc(c(c1)F)Br 2230a_100000759894_100011217306 [0,2,0,0,0,0|2,0,0]=4 12811 B12R1.385 FCCNc1ccc(c(c1)F)Br 34a_100000759894_100011217306 [0,2,0,0,0,0|2,0,0]=4 12812 B12R1.385 FCCNc1ccc(c(c1)F)Br 7a_100000759894_100011217306 [0,2,0,0,0,0|2,0,0]=4 12813 B12R1.385 FCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100011217306 [0,2,0,0,0,0|2,0,0]=4 12814 B12R1.385 FCCNc1ccc(c(c1)F)Cl 34a_100000739366_100011217306 [0,2,0,0,0,0|2,0,0]=4 12815 B12R1.385 FCCNc1ccc(c(c1)F)Cl 7a_100000739366_100011217306 [0,2,0,0,0,0|2,0,0]=4 12816 B12R1.385 FCCNc1ccc(c(c1)F)F 2230a_100000210724_100011217306 [0,2,0,0,0,0|2,0,0]=4 12817 B12R1.385 FCCNc1ccc(c(c1)F)F 34a_100000210724_100011217306 [0,2,0,0,0,0|2,0,0]=4 12818 B12R1.385 FCCNc1ccc(c(c1)F)F 7a_100000210724_100011217306 [0,2,0,0,0,0|2,0,0]=4 12819 B12R1.385 FCCNc1ccc(c(c1)F)I 34a_100011356925_100011217306 [0,2,0,0,0,0|2,0,0]=4 12820 B12R1.385 FCCNc1ccc(c(c1)F)I 7a_100011356925_100011217306 [0,2,0,0,0,0|2,0,0]=4 12821 B12R1.385 FCCNc1ccc(c(c1)I)Br 34a_100000750459_100011217306 [0,2,0,0,0,0|2,0,0]=4 12822 B12R1.385 FCCNc1ccc(c(c1)I)Cl 34a_100012360549_100011217306 [0,2,0,0,0,0|2,0,0]=4 12823 B12R1.385 FCCNc1ccc(c(c1)I)F 34a_114828291077_100011217306 [0,2,0,0,0,0|2,0,0]=4 12824 B12R1.385 FCCNc1ccc(c(c1)I)F 7a_114828291077_100011217306 [0,2,0,0,0,0|2,0,0]=4 12825 B12R1.385 FCCOc1cc(c(cn1)Br)Cl 34a_100010369989_100011217306 [0,2,0,0,0,0|2,0,0]=4 12826 B12R1.385 FCCOc1cc(c(cn1)Cl)Cl 34a_200000099200_100011217306 [0,2,0,0,0,0|2,0,0]=4 12827 B12R1.385 FCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100011217306 [0,2,0,0,0,0|1,0,0]=3 12828 B12R1.385 FCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100011217306 [0,2,0,0,0,0|1,0,0]=3 12829 B12R1.385 FCCOc1ccc(c(c1)Br)F 34a_100000693481_100011217306 [0,2,0,0,0,0|1,0,0]=3 12830 B12R1.385 FCCOc1ccc(c(c1)Br)F 7a_100000693481_100011217306 [0,2,0,0,0,0|1,0,0]=3 12831 B12R1.385 FCCOc1ccc(c(c1)Br)I 34a_100000701344_100011217306 [0,2,0,0,0,0|1,0,0]=3 12832 B12R1.385 FCCOc1ccc(c(c1)Br)I 7a_100000701344_100011217306 [0,2,0,0,0,0|1,0,0]=3 12833 B12R1.385 FCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100011217306 [0,2,0,0,0,0|1,0,0]=3 12834 B12R1.385 FCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100011217306 [0,2,0,0,0,0|1,0,0]=3 12835 B12R1.385 FCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100011217306 [0,2,0,0,0,0|1,0,0]=3 12836 B12R1.385 FCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100011217306 [0,2,0,0,0,0|1,0,0]=3 12837 B12R1.385 FCCOc1ccc(c(c1)Cl)F 34a_100000211030_100011217306 [0,2,0,0,0,0|1,0,0]=3 12838 B12R1.385 FCCOc1ccc(c(c1)Cl)F 7a_100000211030_100011217306 [0,2,0,0,0,0|1,0,0]=3 12839 B12R1.385 FCCOc1ccc(c(c1)Cl)I 34a_100000047559_100011217306 [0,2,0,0,0,0|1,0,0]=3 12840 B12R1.385 FCCOc1ccc(c(c1)Cl)I 7a_100000047559_100011217306 [0,2,0,0,0,0|1,0,0]=3 12841 B12R1.385 FCCOc1ccc(c(c1)F)Br 34a_100000755031_100011217306 [0,2,0,0,0,0|1,0,0]=3 12842 B12R1.385 FCCOc1ccc(c(c1)F)Br 7a_100000755031_100011217306 [0,2,0,0,0,0|1,0,0]=3 12843 B12R1.385 FCCOc1ccc(c(c1)F)Cl 34a_100000691581_100011217306 [0,2,0,0,0,0|1,0,0]=3 12844 B12R1.385 FCCOc1ccc(c(c1)F)Cl 7a_100000691581_100011217306 [0,2,0,0,0,0|1,0,0]=3 12845 B12R1.385 FCCOc1ccc(c(c1)F)F 34a_100000181275_100011217306 [0,2,0,0,0,0|1,0,0]=3 12846 B12R1.385 FCCOc1ccc(c(c1)F)F 7a_100000181275_100011217306 [0,2,0,0,0,0|1,0,0]=3 12847 B12R1.385 FCCOc1ccc(c(c1)F)I 34a_100009990212_100011217306 [0,2,0,0,0,0|1,0,0]=3 12848 B12R1.385 FCCOc1ccc(c(c1)F)I 7a_100009990212_100011217306 [0,2,0,0,0,0|1,0,0]=3 12849 B12R1.385 FCCOc1ccc(c(c1)I)Br 34a_100012339312_100011217306 [0,2,0,0,0,0|1,0,0]=3 12850 B12R1.385 FCCOc1ccc(c(c1)I)Br 7a_100012339312_100011217306 [0,2,0,0,0,0|1,0,0]=3 12851 B12R1.385 FCCOc1ccc(c(c1)I)Cl 34a_100000049588_100011217306 [0,2,0,0,0,0|1,0,0]=3 12852 B12R1.385 FCCOc1ccc(c(c1)I)Cl 7a_100000049588_100011217306 [0,2,0,0,0,0|1,0,0]=3 12853 B12R1.385 FCCOc1ccc(c(n1)F)Br 34a_100009879308_100011217306 [0,2,0,0,0,0|2,0,0]=4 12854 B12R1.385 FCCOc1cnc(c(c1)Br)Cl 34a_100012356455_100011217306 [0,2,0,0,0,0|2,0,0]=4 12855 B12R1.385 FCCOc1cnc(c(c1)Br)Cl 7a_100012356455_100011217306 [0,2,0,0,0,0|2,0,0]=4 12856 B12R1.385 FCCOc1cnc(c(c1)Br)F 34a_100009817267_100011217306 [0,2,0,0,0,0|2,0,0]=4 12857 B12R1.385 FCCOc1cnc(c(c1)Br)F 7a_100009817267_100011217306 [0,2,0,0,0,0|2,0,0]=4 12858 B12R1.385 FCCOc1cnc(c(c1)Cl)Br 34a_100010209684_100011217306 [0,2,0,0,0,0|2,0,0]=4 12859 B12R1.385 FCCOc1cnc(c(c1)Cl)Br 7a_100010209684_100011217306 [0,2,0,0,0,0|2,0,0]=4 12860 B12R1.385 FCCOc1cnc(c(c1)Cl)Cl 34a_100000094354_100011217306 [0,2,0,0,0,0|2,0,0]=4 12861 B12R1.385 FCCOc1cnc(c(c1)Cl)Cl 7a_100000094354_100011217306 [0,2,0,0,0,0|2,0,0]=4 12862 B12R1.385 FCCOc1cnc(c(c1)Cl)F 34a_100000087088_100011217306 [0,2,0,0,0,0|2,0,0]=4 12863 B12R1.385 FCCOc1cnc(c(c1)Cl)F 7a_100000087088_100011217306 [0,2,0,0,0,0|2,0,0]=4 12864 B12R1.385 FCCOc1cnc(c(c1)F)Cl 34a_100000063512_100011217306 [0,2,0,0,0,0|2,0,0]=4 12865 B12R1.385 FCCOc1cnc(c(c1)F)Cl 7a_100000063512_100011217306 [0,2,0,0,0,0|2,0,0]=4 12866 B12R1.385 FCCSc1ccc(c(c1)Br)Br 62a_100011217306_100012356285 [0,2,0,0,0,0|1,1,0]=4 12867 B12R1.385 FCCSc1ccc(c(c1)Br)Br 62a_100012356285_100011217306 [0,2,0,0,0,0|1,1,0]=4 12868 B12R1.385 FCCSc1ccc(c(c1)Br)Cl 62a_100011217306_100012353702 [0,2,0,0,0,0|1,1,0]=4 12869 B12R1.385 FCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100011217306 [0,2,0,0,0,0|1,1,0]=4 12870 B12R1.385 FCCSc1ccc(c(c1)Br)F 62a_100011217306_100012047266 [0,2,0,0,0,0|1,1,0]=4 12871 B12R1.385 FCCSc1ccc(c(c1)Br)F 62a_100012047266_100011217306 [0,2,0,0,0,0|1,1,0]=4 12872 B12R1.385 FCCSc1ccc(c(c1)Cl)Br 62a_100011217306_100012047281 [0,2,0,0,0,0|1,1,0]=4 12873 B12R1.385 FCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100011217306 [0,2,0,0,0,0|1,1,0]=4 12874 B12R1.385 FCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100011217306 [0,2,0,0,0,0|1,1,0]=4 12875 B12R1.385 FCCSc1ccc(c(c1)Cl)Cl 62a_100011217306_100011214914 [0,2,0,0,0,0|1,1,0]=4 12876 B12R1.385 FCCSc1ccc(c(c1)Cl)F 62a_100011215976_100011217306 [0,2,0,0,0,0|1,1,0]=4 12877 B12R1.385 FCCSc1ccc(c(c1)Cl)F 62a_100011217306_100011215976 [0,2,0,0,0,0|1,1,0]=4 12878 B12R1.385 FCCSc1ccc(c(c1)F)Br 62a_100000685389_100011217306 [0,2,0,0,0,0|1,1,0]=4 12879 B12R1.385 FCCSc1ccc(c(c1)F)Br 62a_100011217306_100000685389 [0,2,0,0,0,0|1,1,0]=4 12880 B12R1.385 FCCSc1ccc(c(c1)F)Cl 62a_100011216805_100011217306 [0,2,0,0,0,0|1,1,0]=4 12881 B12R1.385 FCCSc1ccc(c(c1)F)Cl 62a_100011217306_100011216805 [0,2,0,0,0,0|1,1,0]=4 12882 B12R1.385 FCCSc1ccc(c(c1)F)F 62a_100000703953_100011217306 [0,2,0,0,0,0|1,1,0]=4 12883 B12R1.385 FCCSc1ccc(c(c1)F)F 62a_100011217306_100000703953 [0,2,0,0,0,0|1,1,0]=4 12884 B12R1.385 FCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100015361967 [0,2,0,0,0,0|2,0,0]=4 12885 B12R1.385 FCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100015361967 [0,2,0,0,0,0|2,0,0]=4 12886 B12R1.385 FCOCc1ccc(c(c1)Br)F 34a_100000246287_100015361967 [0,2,0,0,0,0|2,0,0]=4 12887 B12R1.385 FCOCc1ccc(c(c1)Br)F 7a_100000246287_100015361967 [0,2,0,0,0,0|2,0,0]=4 12888 B12R1.385 FCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100015361967 [0,2,0,0,0,0|2,0,0]=4 12889 B12R1.385 FCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100015361967 [0,2,0,0,0,0|2,0,0]=4 12890 B12R1.385 FCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100015361967 [0,2,0,0,0,0|2,0,0]=4 12891 B12R1.385 FCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100015361967 [0,2,0,0,0,0|2,0,0]=4 12892 B12R1.385 FCOCc1ccc(c(c1)Cl)F 34a_100011217911_100015361967 [0,2,0,0,0,0|2,0,0]=4 12893 B12R1.385 FCOCc1ccc(c(c1)Cl)F 7a_100011217911_100015361967 [0,2,0,0,0,0|2,0,0]=4 12894 B12R1.385 FCOCc1ccc(c(c1)Cl)I 34a_100000718186_100015361967 [0,2,0,0,0,0|2,0,0]=4 12895 B12R1.385 FCOCc1ccc(c(c1)Cl)I 7a_100000718186_100015361967 [0,2,0,0,0,0|2,0,0]=4 12896 B12R1.385 FCOCc1ccc(c(c1)F)Br 34a_100011533735_100015361967 [0,2,0,0,0,0|2,0,0]=4 12897 B12R1.385 FCOCc1ccc(c(c1)F)Br 7a_100011533735_100015361967 [0,2,0,0,0,0|2,0,0]=4 12898 B12R1.385 FCOCc1ccc(c(c1)F)Cl 34a_100011218299_100015361967 [0,2,0,0,0,0|2,0,0]=4 12899 B12R1.385 FCOCc1ccc(c(c1)F)Cl 7a_100011218299_100015361967 [0,2,0,0,0,0|2,0,0]=4 12900 B12R1.385 FCOCc1ccc(c(c1)F)F 34a_100011215442_100015361967 [0,2,0,0,0,0|2,0,0]=4 12901 B12R1.385 FCOCc1ccc(c(c1)F)F 7a_100011215442_100015361967 [0,2,0,0,0,0|2,0,0]=4 12902 B12R1.385 FCOCc1ccc(c(c1)F)I 34a_100010149597_100015361967 [0,2,0,0,0,0|2,0,0]=4 12903 B12R1.385 FCOCc1ccc(c(c1)F)I 7a_100010149597_100015361967 [0,2,0,0,0,0|2,0,0]=4 12904 B12R1.385 FCOCc1ccc(c(c1)I)F 34a_100000049585_100015361967 [0,2,0,0,0,0|2,0,0]=4 12905 B12R1.385 FCOCc1ccc(c(c1)I)F 7a_100000049585_100015361967 [0,2,0,0,0,0|2,0,0]=4 12906 B12R1.385 N#CCNc1ccc(c(c1)F)O 7a_100011220035_100011215382 [0,2,0,0,0,0|1,0,1]=4 12907 B12R1.385 N#CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100011215382 [0,2,0,0,0,0|1,0,1]=4 12908 B12R1.385 N#CCOc1ccc(c(c1)Br)F 7a_100000693481_100011215382 [0,2,0,0,0,0|1,0,1]=4 12909 B12R1.385 N#CCOc1ccc(c(c1)Br)I 7a_100000701344_100011215382 [0,2,0,0,0,0|1,0,1]=4 12910 B12R1.385 N#CCOc1ccc(c(c1)Br)N 7a_100012001276_100011215382 [0,2,0,0,0,0|1,0,1]=4 12911 B12R1.385 N#CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100011215382 [0,2,0,0,0,0|1,0,1]=4 12912 B12R1.385 N#CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100011215382 [0,2,0,0,0,0|1,0,1]=4 12913 B12R1.385 N#CCOc1ccc(c(c1)Cl)F 7a_100000211030_100011215382 [0,2,0,0,0,0|1,0,1]=4 12914 B12R1.385 N#CCOc1ccc(c(c1)Cl)I 7a_100000047559_100011215382 [0,2,0,0,0,0|1,0,1]=4 12915 B12R1.385 N#CCOc1ccc(c(c1)Cl)N 7a_100011215599_100011215382 [0,2,0,0,0,0|1,0,1]=4 12916 B12R1.385 N#CCOc1ccc(c(c1)F)Br 7a_100000755031_100011215382 [0,2,0,0,0,0|1,0,1]=4 12917 B12R1.385 N#CCOc1ccc(c(c1)F)Cl 7a_100000691581_100011215382 [0,2,0,0,0,0|1,0,1]=4 12918 B12R1.385 N#CCOc1ccc(c(c1)F)F 7a_100000181275_100011215382 [0,2,0,0,0,0|1,0,1]=4 12919 B12R1.385 N#CCOc1ccc(c(c1)F)I 7a_100009990212_100011215382 [0,2,0,0,0,0|1,0,1]=4 12920 B12R1.385 N#CCOc1ccc(c(c1)F)N 7a_100000759473_100011215382 [0,2,0,0,0,0|1,0,1]=4 12921 B12R1.385 N#CCOc1ccc(c(c1)I)Br 7a_100012339312_100011215382 [0,2,0,0,0,0|1,0,1]=4 12922 B12R1.385 N#CCOc1ccc(c(c1)I)Cl 7a_100000049588_100011215382 [0,2,0,0,0,0|1,0,1]=4 12923 B12R1.385 N#CCOc1ccc(c(c1)I)N 7a_100010084370_100011215382 [0,2,0,0,0,0|1,0,1]=4 12924 B12R1.385 N#CCOc1ccc(c(c1)N)Br 7a_100011999798_100011215382 [0,2,0,0,0,0|1,0,1]=4 12925 B12R1.385 N#CCOc1ccc(c(c1)N)F 7a_100012017239_100011215382 [0,2,0,0,0,0|1,0,1]=4 12926 B12R1.385 N#CCSc1ccc(c(c1)Br)O 62a_100011215382_100012361655 [0,2,0,0,0,0|0,1,1]=4 12927 B12R1.385 N#CCSc1ccc(c(c1)Br)O 62a_100012361655_100011215382 [0,2,0,0,0,0|0,1,1]=4 12928 B12R1.385 N#CCSc1ccc(c(c1)Cl)O 62a_100011215382_100012360047 [0,2,0,0,0,0|0,1,1]=4 12929 B12R1.385 N#CCSc1ccc(c(c1)Cl)O 62a_100012360047_100011215382 [0,2,0,0,0,0|0,1,1]=4 12930 B12R1.385 N#CCSc1ccc(c(c1)F)O 62a_100000185481_100011215382 [0,2,0,0,0,0|0,1,1]=4 12931 B12R1.385 N#CCSc1ccc(c(c1)F)O 62a_100011215382_100000185481 [0,2,0,0,0,0|0,1,1]=4 12932 B12R1.385 N#CCSc1ccc(c(c1)N)O 62a_100000752626_100011215382 [0,2,0,0,0,0|0,1,1]=4 12933 B12R1.385 N#CCSc1ccc(c(c1)N)O 62a_100011215382_100000752626 [0,2,0,0,0,0|0,1,1]=4 12934 B12R1.385 N#CCSc1ccc(c(c1)O)O 62a_100011215382_100009813601 [0,2,0,0,0,0|0,1,1]=4 12935 B12R1.385 Nc1cc(ccc1Br)COCF 34a_100012347568_100015361967 [0,2,0,0,0,0|2,0,0]=4 12936 B12R1.385 Nc1cc(ccc1Br)OCC=O 34a_100011999798_200009817547 [0,2,0,0,0,0|1,0,1]=4 12937 B12R1.385 Nc1cc(ccc1Br)OCC=O 7a_100011999798_200015260668 [0,2,0,0,0,0|1,0,1]=4 12938 B12R1.385 Nc1cc(ccc1Br)OCCF 34a_100011999798_100011217306 [0,2,0,0,0,0|1,0,0]=3 12939 B12R1.385 Nc1cc(ccc1Br)OCCF 7a_100011999798_100011217306 [0,2,0,0,0,0|1,0,0]=3 12940 B12R1.385 Nc1cc(ccc1Br)OCCO 34a_100011999798_100000211926 [0,2,0,0,0,0|1,0,0]=3 12941 B12R1.385 Nc1cc(ccc1Br)OCCO 7a_100011999798_100000211926 [0,2,0,0,0,0|1,0,0]=3 12942 B12R1.385 Nc1cc(ccc1Br)SCCF 62a_100000750456_100011217306 [0,2,0,0,0,0|1,1,0]=4 12943 B12R1.385 Nc1cc(ccc1Br)SCCF 62a_100011217306_100000750456 [0,2,0,0,0,0|1,1,0]=4 12944 B12R1.385 Nc1cc(ccc1Br)SCCO 62a_100000211926_100000750456 [0,2,0,0,0,0|1,1,0]=4 12945 B12R1.385 Nc1cc(ccc1Br)SCCO 62a_100000750456_100000211926 [0,2,0,0,0,0|1,1,0]=4 12946 B12R1.385 Nc1cc(ccc1Cl)COCF 34a_106256033963_100015361967 [0,2,0,0,0,0|2,0,0]=4 12947 B12R1.385 Nc1cc(ccc1Cl)OCC=O 34a_100011934297_200009817547 [0,2,0,0,0,0|1,0,1]=4 12948 B12R1.385 Nc1cc(ccc1Cl)OCCF 34a_100011934297_100011217306 [0,2,0,0,0,0|1,0,0]=3 12949 B12R1.385 Nc1cc(ccc1Cl)OCCO 34a_100011934297_100000211926 [0,2,0,0,0,0|1,0,0]=3 12950 B12R1.385 Nc1cc(ccc1Cl)SCCF 62a_100011217306_200000761891 [0,2,0,0,0,0|1,1,0]=4 12951 B12R1.385 Nc1cc(ccc1Cl)SCCF 62a_200000761891_100011217306 [0,2,0,0,0,0|1,1,0]=4 12952 B12R1.385 Nc1cc(ccc1Cl)SCCO 62a_100000211926_200000761891 [0,2,0,0,0,0|1,1,0]=4 12953 B12R1.385 Nc1cc(ccc1Cl)SCCO 62a_200000761891_100000211926 [0,2,0,0,0,0|1,1,0]=4 12954 B12R1.385 Nc1cc(ccc1F)COCF 34a_102125399562_100015361967 [0,2,0,0,0,0|2,0,0]=4 12955 B12R1.385 Nc1cc(ccc1F)OCC=O 34a_100012017239_200009817547 [0,2,0,0,0,0|1,0,1]=4 12956 B12R1.385 Nc1cc(ccc1F)OCC=O 7a_100012017239_200015260668 [0,2,0,0,0,0|1,0,1]=4 12957 B12R1.385 Nc1cc(ccc1F)OCCF 34a_100012017239_100011217306 [0,2,0,0,0,0|1,0,0]=3 12958 B12R1.385 Nc1cc(ccc1F)OCCF 7a_100012017239_100011217306 [0,2,0,0,0,0|1,0,0]=3 12959 B12R1.385 Nc1cc(ccc1F)OCCO 34a_100012017239_100000211926 [0,2,0,0,0,0|1,0,0]=3 12960 B12R1.385 Nc1cc(ccc1F)OCCO 7a_100012017239_100000211926 [0,2,0,0,0,0|1,0,0]=3 12961 B12R1.385 Nc1cc(ccc1F)SCCF 62a_100000740924_100011217306 [0,2,0,0,0,0|1,1,0]=4 12962 B12R1.385 Nc1cc(ccc1F)SCCF 62a_100011217306_100000740924 [0,2,0,0,0,0|1,1,0]=4 12963 B12R1.385 Nc1cc(ccc1F)SCCO 62a_100000211926_100000740924 [0,2,0,0,0,0|1,1,0]=4 12964 B12R1.385 Nc1cc(ccc1F)SCCO 62a_100000740924_100000211926 [0,2,0,0,0,0|1,1,0]=4 12965 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_100000752626_200015260668 [0,2,0,0,0,0|0,1,1]=4 12966 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_200015260668_100000752626 [0,2,0,0,0,0|0,1,1]=4 12967 B12R1.385 Nc1cc(ccc1O)SCCF 62a_100000752626_100011217306 [0,2,0,0,0,0|0,1,0]=3 12968 B12R1.385 Nc1cc(ccc1O)SCCF 62a_100011217306_100000752626 [0,2,0,0,0,0|0,1,0]=3 12969 B12R1.385 Nc1cc(ccc1O)SCCO 62a_100000211926_100000752626 [0,2,0,0,0,0|0,1,0]=3 12970 B12R1.385 Nc1cc(ccc1O)SCCO 62a_100000752626_100000211926 [0,2,0,0,0,0|0,1,0]=3 12971 B12R1.385 Nc1cc(cnc1O)SCCF 62a_100000743729_100011217306 [0,2,0,0,0,0|1,1,0]=4 12972 B12R1.385 Nc1cc(cnc1O)SCCF 62a_100011217306_100000743729 [0,2,0,0,0,0|1,1,0]=4 12973 B12R1.385 Nc1cc(cnc1O)SCCO 62a_100000211926_100000743729 [0,2,0,0,0,0|1,1,0]=4 12974 B12R1.385 Nc1cc(cnc1O)SCCO 62a_100000743729_100000211926 [0,2,0,0,0,0|1,1,0]=4 12975 B12R1.385 Nc1cc(ncc1O)SCCF 62a_100009819941_100011217306 [0,2,0,0,0,0|1,1,0]=4 12976 B12R1.385 Nc1cc(ncc1O)SCCF 62a_100011217306_100009819941 [0,2,0,0,0,0|1,1,0]=4 12977 B12R1.385 Nc1cc(ncc1O)SCCO 62a_100000211926_100009819941 [0,2,0,0,0,0|1,1,0]=4 12978 B12R1.385 Nc1cc(ncc1O)SCCO 62a_100009819941_100000211926 [0,2,0,0,0,0|1,1,0]=4 12979 B12R1.385 Nc1ccc(cc1Br)OCC=O 34a_100012001276_200009817547 [0,2,0,0,0,0|1,0,1]=4 12980 B12R1.385 Nc1ccc(cc1Br)OCC=O 7a_100012001276_200015260668 [0,2,0,0,0,0|1,0,1]=4 12981 B12R1.385 Nc1ccc(cc1Br)OCCF 34a_100012001276_100011217306 [0,2,0,0,0,0|1,0,0]=3 12982 B12R1.385 Nc1ccc(cc1Br)OCCF 7a_100012001276_100011217306 [0,2,0,0,0,0|1,0,0]=3 12983 B12R1.385 Nc1ccc(cc1Br)OCCO 34a_100012001276_100000211926 [0,2,0,0,0,0|1,0,0]=3 12984 B12R1.385 Nc1ccc(cc1Br)OCCO 7a_100012001276_100000211926 [0,2,0,0,0,0|1,0,0]=3 12985 B12R1.385 Nc1ccc(cc1Br)SCCF 62a_100000750455_100011217306 [0,2,0,0,0,0|1,1,0]=4 12986 B12R1.385 Nc1ccc(cc1Br)SCCF 62a_100011217306_100000750455 [0,2,0,0,0,0|1,1,0]=4 12987 B12R1.385 Nc1ccc(cc1Br)SCCO 62a_100000211926_100000750455 [0,2,0,0,0,0|1,1,0]=4 12988 B12R1.385 Nc1ccc(cc1Br)SCCO 62a_100000750455_100000211926 [0,2,0,0,0,0|1,1,0]=4 12989 B12R1.385 Nc1ccc(cc1Cl)OCC=O 34a_100011215599_200009817547 [0,2,0,0,0,0|1,0,1]=4 12990 B12R1.385 Nc1ccc(cc1Cl)OCC=O 7a_100011215599_200015260668 [0,2,0,0,0,0|1,0,1]=4 12991 B12R1.385 Nc1ccc(cc1Cl)OCCF 34a_100011215599_100011217306 [0,2,0,0,0,0|1,0,0]=3 12992 B12R1.385 Nc1ccc(cc1Cl)OCCF 7a_100011215599_100011217306 [0,2,0,0,0,0|1,0,0]=3 12993 B12R1.385 Nc1ccc(cc1Cl)OCCO 34a_100011215599_100000211926 [0,2,0,0,0,0|1,0,0]=3 12994 B12R1.385 Nc1ccc(cc1Cl)OCCO 7a_100011215599_100000211926 [0,2,0,0,0,0|1,0,0]=3 12995 B12R1.385 Nc1ccc(cc1Cl)SCCF 62a_100011217306_100011218065 [0,2,0,0,0,0|1,1,0]=4 12996 B12R1.385 Nc1ccc(cc1Cl)SCCF 62a_100011218065_100011217306 [0,2,0,0,0,0|1,1,0]=4 12997 B12R1.385 Nc1ccc(cc1Cl)SCCO 62a_100000211926_100011218065 [0,2,0,0,0,0|1,1,0]=4 12998 B12R1.385 Nc1ccc(cc1Cl)SCCO 62a_100011218065_100000211926 [0,2,0,0,0,0|1,1,0]=4 12999 B12R1.385 Nc1ccc(cc1F)COCF 34a_100011217239_100015361967 [0,2,0,0,0,0|2,0,0]=4 13000 B12R1.385 Nc1ccc(cc1F)OCC=O 34a_100000759473_200009817547 [0,2,0,0,0,0|1,0,1]=4 13001 B12R1.385 Nc1ccc(cc1F)OCC=O 7a_100000759473_200015260668 [0,2,0,0,0,0|1,0,1]=4 13002 B12R1.385 Nc1ccc(cc1F)OCCF 34a_100000759473_100011217306 [0,2,0,0,0,0|1,0,0]=3 13003 B12R1.385 Nc1ccc(cc1F)OCCF 7a_100000759473_100011217306 [0,2,0,0,0,0|1,0,0]=3 13004 B12R1.385 Nc1ccc(cc1F)OCCO 34a_100000759473_100000211926 [0,2,0,0,0,0|1,0,0]=3 13005 B12R1.385 Nc1ccc(cc1F)OCCO 7a_100000759473_100000211926 [0,2,0,0,0,0|1,0,0]=3 13006 B12R1.385 Nc1ccc(cc1F)SCCF 62a_100011215594_100011217306 [0,2,0,0,0,0|1,1,0]=4 13007 B12R1.385 Nc1ccc(cc1F)SCCF 62a_100011217306_100011215594 [0,2,0,0,0,0|1,1,0]=4 13008 B12R1.385 Nc1ccc(cc1F)SCCO 62a_100000211926_100011215594 [0,2,0,0,0,0|1,1,0]=4 13009 B12R1.385 Nc1ccc(cc1F)SCCO 62a_100011215594_100000211926 [0,2,0,0,0,0|1,1,0]=4 13010 B12R1.385 Nc1ccc(cc1I)OCC=O 34a_100010084370_200009817547 [0,2,0,0,0,0|1,0,1]=4 13011 B12R1.385 Nc1ccc(cc1I)OCC=O 7a_100010084370_200015260668 [0,2,0,0,0,0|1,0,1]=4 13012 B12R1.385 Nc1ccc(cc1I)OCCF 34a_100010084370_100011217306 [0,2,0,0,0,0|1,0,0]=3 13013 B12R1.385 Nc1ccc(cc1I)OCCF 7a_100010084370_100011217306 [0,2,0,0,0,0|1,0,0]=3 13014 B12R1.385 Nc1ccc(cc1I)OCCO 34a_100010084370_100000211926 [0,2,0,0,0,0|1,0,0]=3 13015 B12R1.385 Nc1ccc(cc1I)OCCO 7a_100010084370_100000211926 [0,2,0,0,0,0|1,0,0]=3 13016 B12R1.385 Nc1ccc(cc1N)OCC=O 34a_100025771000_200009817547 [0,2,0,0,0,0|1,0,1]=4 13017 B12R1.385 Nc1ccc(cc1N)OCCF 34a_100025771000_100011217306 [0,2,0,0,0,0|1,0,0]=3 13018 B12R1.385 Nc1ccc(cc1N)OCCO 34a_100025771000_100000211926 [0,2,0,0,0,0|1,0,0]=3 13019 B12R1.385 Nc1ccc(cc1N)SCCF 62a_100000741789_100011217306 [0,2,0,0,0,0|1,1,0]=4 13020 B12R1.385 Nc1ccc(cc1N)SCCF 62a_100011217306_100011534411 [0,2,0,0,0,0|1,1,0]=4 13021 B12R1.385 Nc1ccc(cc1N)SCCO 62a_100000211926_100011534411 [0,2,0,0,0,0|1,1,0]=4 13022 B12R1.385 Nc1ccc(cc1N)SCCO 62a_100000741789_100000211926 [0,2,0,0,0,0|1,1,0]=4 13023 B12R1.385 Nc1ccc(cc1O)SCCF 62a_100000739049_100011217306 [0,2,0,0,0,0|1,1,0]=4 13024 B12R1.385 Nc1ccc(cc1O)SCCF 62a_100011217306_100000739049 [0,2,0,0,0,0|1,1,0]=4 13025 B12R1.385 Nc1ccc(cc1O)SCCO 62a_100000211926_100000739049 [0,2,0,0,0,0|1,1,0]=4 13026 B12R1.385 Nc1ccc(cc1O)SCCO 62a_100000739049_100000211926 [0,2,0,0,0,0|1,1,0]=4 13027 B12R1.385 Nc1nc(ccc1O)SCCF 62a_100000685527_100011217306 [0,2,0,0,0,0|1,1,0]=4 13028 B12R1.385 Nc1nc(ccc1O)SCCF 62a_100011217306_100000685527 [0,2,0,0,0,0|1,1,0]=4 13029 B12R1.385 Nc1nc(ccc1O)SCCO 62a_100000211926_100000685527 [0,2,0,0,0,0|1,1,0]=4 13030 B12R1.385 Nc1nc(ccc1O)SCCO 62a_100000685527_100000211926 [0,2,0,0,0,0|1,1,0]=4 13031 B12R1.385 O=CCNc1ccc(c(c1)Br)O 34a_100011534360_200009817547 [0,2,0,0,0,0|1,0,1]=4 13032 B12R1.385 O=CCNc1ccc(c(c1)Cl)O 34a_100000744943_200009817547 [0,2,0,0,0,0|1,0,1]=4 13033 B12R1.385 O=CCNc1ccc(c(c1)F)O 34a_100011220035_200009817547 [0,2,0,0,0,0|1,0,1]=4 13034 B12R1.385 O=CCNc1ccc(c(c1)F)O 7a_100011220035_200015260668 [0,2,0,0,0,0|1,0,1]=4 13035 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [0,2,0,0,0,0|1,0,1]=4 13036 B12R1.385 O=CCOc1ccc(c(c1)Br)Cl 34a_100011933957_200009817547 [0,2,0,0,0,0|1,0,1]=4 13037 B12R1.385 O=CCOc1ccc(c(c1)Br)Cl 7a_100011933957_200015260668 [0,2,0,0,0,0|1,0,1]=4 13038 B12R1.385 O=CCOc1ccc(c(c1)Br)F 34a_100000693481_200009817547 [0,2,0,0,0,0|1,0,1]=4 13039 B12R1.385 O=CCOc1ccc(c(c1)Br)F 7a_100000693481_200015260668 [0,2,0,0,0,0|1,0,1]=4 13040 B12R1.385 O=CCOc1ccc(c(c1)Br)I 34a_100000701344_200009817547 [0,2,0,0,0,0|1,0,1]=4 13041 B12R1.385 O=CCOc1ccc(c(c1)Br)I 7a_100000701344_200015260668 [0,2,0,0,0,0|1,0,1]=4 13042 B12R1.385 O=CCOc1ccc(c(c1)Cl)Br 34a_100011215161_200009817547 [0,2,0,0,0,0|1,0,1]=4 13043 B12R1.385 O=CCOc1ccc(c(c1)Cl)Br 7a_100011215161_200015260668 [0,2,0,0,0,0|1,0,1]=4 13044 B12R1.385 O=CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_200009817547 [0,2,0,0,0,0|1,0,1]=4 13045 B12R1.385 O=CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_200015260668 [0,2,0,0,0,0|1,0,1]=4 13046 B12R1.385 O=CCOc1ccc(c(c1)Cl)F 34a_100000211030_200009817547 [0,2,0,0,0,0|1,0,1]=4 13047 B12R1.385 O=CCOc1ccc(c(c1)Cl)F 7a_100000211030_200015260668 [0,2,0,0,0,0|1,0,1]=4 13048 B12R1.385 O=CCOc1ccc(c(c1)Cl)I 34a_100000047559_200009817547 [0,2,0,0,0,0|1,0,1]=4 13049 B12R1.385 O=CCOc1ccc(c(c1)Cl)I 7a_100000047559_200015260668 [0,2,0,0,0,0|1,0,1]=4 13050 B12R1.385 O=CCOc1ccc(c(c1)F)Br 34a_100000755031_200009817547 [0,2,0,0,0,0|1,0,1]=4 13051 B12R1.385 O=CCOc1ccc(c(c1)F)Br 7a_100000755031_200015260668 [0,2,0,0,0,0|1,0,1]=4 13052 B12R1.385 O=CCOc1ccc(c(c1)F)Cl 34a_100000691581_200009817547 [0,2,0,0,0,0|1,0,1]=4 13053 B12R1.385 O=CCOc1ccc(c(c1)F)Cl 7a_100000691581_200015260668 [0,2,0,0,0,0|1,0,1]=4 13054 B12R1.385 O=CCOc1ccc(c(c1)F)F 34a_100000181275_200009817547 [0,2,0,0,0,0|1,0,1]=4 13055 B12R1.385 O=CCOc1ccc(c(c1)F)F 7a_100000181275_200015260668 [0,2,0,0,0,0|1,0,1]=4 13056 B12R1.385 O=CCOc1ccc(c(c1)F)I 34a_100009990212_200009817547 [0,2,0,0,0,0|1,0,1]=4 13057 B12R1.385 O=CCOc1ccc(c(c1)F)I 7a_100009990212_200015260668 [0,2,0,0,0,0|1,0,1]=4 13058 B12R1.385 O=CCOc1ccc(c(c1)I)Br 34a_100012339312_200009817547 [0,2,0,0,0,0|1,0,1]=4 13059 B12R1.385 O=CCOc1ccc(c(c1)I)Br 7a_100012339312_200015260668 [0,2,0,0,0,0|1,0,1]=4 13060 B12R1.385 O=CCOc1ccc(c(c1)I)Cl 34a_100000049588_200009817547 [0,2,0,0,0,0|1,0,1]=4 13061 B12R1.385 O=CCOc1ccc(c(c1)I)Cl 7a_100000049588_200015260668 [0,2,0,0,0,0|1,0,1]=4 13062 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_100012361655_200015260668 [0,2,0,0,0,0|0,1,1]=4 13063 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_200015260668_100012361655 [0,2,0,0,0,0|0,1,1]=4 13064 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_100012360047_200015260668 [0,2,0,0,0,0|0,1,1]=4 13065 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_200015260668_100012360047 [0,2,0,0,0,0|0,1,1]=4 13066 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_100000185481_200015260668 [0,2,0,0,0,0|0,1,1]=4 13067 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_200015260668_100000185481 [0,2,0,0,0,0|0,1,1]=4 13068 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [0,2,0,0,0,0|0,1,1]=4 13069 B12R1.385 OCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000211926 [0,2,0,0,0,0|2,0,0]=4 13070 B12R1.385 OCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000211926 [0,2,0,0,0,0|2,0,0]=4 13071 B12R1.385 OCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000211926 [0,2,0,0,0,0|2,0,0]=4 13072 B12R1.385 OCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000211926 [0,2,0,0,0,0|2,0,0]=4 13073 B12R1.385 OCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000211926 [0,2,0,0,0,0|2,0,0]=4 13074 B12R1.385 OCCNc1ccc(c(c1)Br)F 2230a_100000760356_100000211926 [0,2,0,0,0,0|2,0,0]=4 13075 B12R1.385 OCCNc1ccc(c(c1)Br)F 34a_100000760356_100000211926 [0,2,0,0,0,0|2,0,0]=4 13076 B12R1.385 OCCNc1ccc(c(c1)Br)F 7a_100000760356_100000211926 [0,2,0,0,0,0|2,0,0]=4 13077 B12R1.385 OCCNc1ccc(c(c1)Br)I 34a_100000750458_100000211926 [0,2,0,0,0,0|2,0,0]=4 13078 B12R1.385 OCCNc1ccc(c(c1)Br)O 34a_100011534360_100000211926 [0,2,0,0,0,0|1,0,0]=3 13079 B12R1.385 OCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000211926 [0,2,0,0,0,0|2,0,0]=4 13080 B12R1.385 OCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000211926 [0,2,0,0,0,0|2,0,0]=4 13081 B12R1.385 OCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000211926 [0,2,0,0,0,0|2,0,0]=4 13082 B12R1.385 OCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000211926 [0,2,0,0,0,0|2,0,0]=4 13083 B12R1.385 OCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000211926 [0,2,0,0,0,0|2,0,0]=4 13084 B12R1.385 OCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000211926 [0,2,0,0,0,0|2,0,0]=4 13085 B12R1.385 OCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000211926 [0,2,0,0,0,0|2,0,0]=4 13086 B12R1.385 OCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000211926 [0,2,0,0,0,0|2,0,0]=4 13087 B12R1.385 OCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000211926 [0,2,0,0,0,0|2,0,0]=4 13088 B12R1.385 OCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000211926 [0,2,0,0,0,0|1,0,0]=3 13089 B12R1.385 OCCNc1ccc(c(c1)F)Br 2230a_100000759894_100000211926 [0,2,0,0,0,0|2,0,0]=4 13090 B12R1.385 OCCNc1ccc(c(c1)F)Br 34a_100000759894_100000211926 [0,2,0,0,0,0|2,0,0]=4 13091 B12R1.385 OCCNc1ccc(c(c1)F)Br 7a_100000759894_100000211926 [0,2,0,0,0,0|2,0,0]=4 13092 B12R1.385 OCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000211926 [0,2,0,0,0,0|2,0,0]=4 13093 B12R1.385 OCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000211926 [0,2,0,0,0,0|2,0,0]=4 13094 B12R1.385 OCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000211926 [0,2,0,0,0,0|2,0,0]=4 13095 B12R1.385 OCCNc1ccc(c(c1)F)F 2230a_100000210724_100000211926 [0,2,0,0,0,0|2,0,0]=4 13096 B12R1.385 OCCNc1ccc(c(c1)F)F 34a_100000210724_100000211926 [0,2,0,0,0,0|2,0,0]=4 13097 B12R1.385 OCCNc1ccc(c(c1)F)F 7a_100000210724_100000211926 [0,2,0,0,0,0|2,0,0]=4 13098 B12R1.385 OCCNc1ccc(c(c1)F)I 34a_100011356925_100000211926 [0,2,0,0,0,0|2,0,0]=4 13099 B12R1.385 OCCNc1ccc(c(c1)F)I 7a_100011356925_100000211926 [0,2,0,0,0,0|2,0,0]=4 13100 B12R1.385 OCCNc1ccc(c(c1)F)O 34a_100011220035_100000211926 [0,2,0,0,0,0|1,0,0]=3 13101 B12R1.385 OCCNc1ccc(c(c1)F)O 7a_100011220035_100000211926 [0,2,0,0,0,0|1,0,0]=3 13102 B12R1.385 OCCNc1ccc(c(c1)I)Br 34a_100000750459_100000211926 [0,2,0,0,0,0|2,0,0]=4 13103 B12R1.385 OCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000211926 [0,2,0,0,0,0|2,0,0]=4 13104 B12R1.385 OCCNc1ccc(c(c1)I)F 34a_114828291077_100000211926 [0,2,0,0,0,0|2,0,0]=4 13105 B12R1.385 OCCNc1ccc(c(c1)I)F 7a_114828291077_100000211926 [0,2,0,0,0,0|2,0,0]=4 13106 B12R1.385 OCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000211926 [0,2,0,0,0,0|2,0,0]=4 13107 B12R1.385 OCCNc1ccc(c(c1)O)F 34a_100012017398_100000211926 [0,2,0,0,0,0|2,0,0]=4 13108 B12R1.385 OCCNc1ccc(c(c1)O)F 7a_100012017398_100000211926 [0,2,0,0,0,0|2,0,0]=4 13109 B12R1.385 OCCNc1ccc(c(c1)O)O 34a_100102946323_100000211926 [0,2,0,0,0,0|1,0,0]=3 13110 B12R1.385 OCCOc1cc(c(cn1)Br)Cl 34a_100010369989_100000211926 [0,2,0,0,0,0|2,0,0]=4 13111 B12R1.385 OCCOc1cc(c(cn1)Cl)Cl 34a_200000099200_100000211926 [0,2,0,0,0,0|2,0,0]=4 13112 B12R1.385 OCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000211926 [0,2,0,0,0,0|1,0,0]=3 13113 B12R1.385 OCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000211926 [0,2,0,0,0,0|1,0,0]=3 13114 B12R1.385 OCCOc1ccc(c(c1)Br)F 34a_100000693481_100000211926 [0,2,0,0,0,0|1,0,0]=3 13115 B12R1.385 OCCOc1ccc(c(c1)Br)F 7a_100000693481_100000211926 [0,2,0,0,0,0|1,0,0]=3 13116 B12R1.385 OCCOc1ccc(c(c1)Br)I 34a_100000701344_100000211926 [0,2,0,0,0,0|1,0,0]=3 13117 B12R1.385 OCCOc1ccc(c(c1)Br)I 7a_100000701344_100000211926 [0,2,0,0,0,0|1,0,0]=3 13118 B12R1.385 OCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000211926 [0,2,0,0,0,0|1,0,0]=3 13119 B12R1.385 OCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000211926 [0,2,0,0,0,0|1,0,0]=3 13120 B12R1.385 OCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000211926 [0,2,0,0,0,0|1,0,0]=3 13121 B12R1.385 OCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000211926 [0,2,0,0,0,0|1,0,0]=3 13122 B12R1.385 OCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000211926 [0,2,0,0,0,0|1,0,0]=3 13123 B12R1.385 OCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000211926 [0,2,0,0,0,0|1,0,0]=3 13124 B12R1.385 OCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000211926 [0,2,0,0,0,0|1,0,0]=3 13125 B12R1.385 OCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000211926 [0,2,0,0,0,0|1,0,0]=3 13126 B12R1.385 OCCOc1ccc(c(c1)F)Br 34a_100000755031_100000211926 [0,2,0,0,0,0|1,0,0]=3 13127 B12R1.385 OCCOc1ccc(c(c1)F)Br 7a_100000755031_100000211926 [0,2,0,0,0,0|1,0,0]=3 13128 B12R1.385 OCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000211926 [0,2,0,0,0,0|1,0,0]=3 13129 B12R1.385 OCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000211926 [0,2,0,0,0,0|1,0,0]=3 13130 B12R1.385 OCCOc1ccc(c(c1)F)F 34a_100000181275_100000211926 [0,2,0,0,0,0|1,0,0]=3 13131 B12R1.385 OCCOc1ccc(c(c1)F)F 7a_100000181275_100000211926 [0,2,0,0,0,0|1,0,0]=3 13132 B12R1.385 OCCOc1ccc(c(c1)F)I 34a_100009990212_100000211926 [0,2,0,0,0,0|1,0,0]=3 13133 B12R1.385 OCCOc1ccc(c(c1)F)I 7a_100009990212_100000211926 [0,2,0,0,0,0|1,0,0]=3 13134 B12R1.385 OCCOc1ccc(c(c1)I)Br 34a_100012339312_100000211926 [0,2,0,0,0,0|1,0,0]=3 13135 B12R1.385 OCCOc1ccc(c(c1)I)Br 7a_100012339312_100000211926 [0,2,0,0,0,0|1,0,0]=3 13136 B12R1.385 OCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000211926 [0,2,0,0,0,0|1,0,0]=3 13137 B12R1.385 OCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000211926 [0,2,0,0,0,0|1,0,0]=3 13138 B12R1.385 OCCOc1ccc(c(n1)F)Br 34a_100009879308_100000211926 [0,2,0,0,0,0|2,0,0]=4 13139 B12R1.385 OCCOc1cnc(c(c1)Br)Cl 34a_100012356455_100000211926 [0,2,0,0,0,0|2,0,0]=4 13140 B12R1.385 OCCOc1cnc(c(c1)Br)Cl 7a_100012356455_100000211926 [0,2,0,0,0,0|2,0,0]=4 13141 B12R1.385 OCCOc1cnc(c(c1)Br)F 34a_100009817267_100000211926 [0,2,0,0,0,0|2,0,0]=4 13142 B12R1.385 OCCOc1cnc(c(c1)Br)F 7a_100009817267_100000211926 [0,2,0,0,0,0|2,0,0]=4 13143 B12R1.385 OCCOc1cnc(c(c1)Cl)Br 34a_100010209684_100000211926 [0,2,0,0,0,0|2,0,0]=4 13144 B12R1.385 OCCOc1cnc(c(c1)Cl)Br 7a_100010209684_100000211926 [0,2,0,0,0,0|2,0,0]=4 13145 B12R1.385 OCCOc1cnc(c(c1)Cl)Cl 34a_100000094354_100000211926 [0,2,0,0,0,0|2,0,0]=4 13146 B12R1.385 OCCOc1cnc(c(c1)Cl)Cl 7a_100000094354_100000211926 [0,2,0,0,0,0|2,0,0]=4 13147 B12R1.385 OCCOc1cnc(c(c1)Cl)F 34a_100000087088_100000211926 [0,2,0,0,0,0|2,0,0]=4 13148 B12R1.385 OCCOc1cnc(c(c1)Cl)F 7a_100000087088_100000211926 [0,2,0,0,0,0|2,0,0]=4 13149 B12R1.385 OCCOc1cnc(c(c1)F)Cl 34a_100000063512_100000211926 [0,2,0,0,0,0|2,0,0]=4 13150 B12R1.385 OCCOc1cnc(c(c1)F)Cl 7a_100000063512_100000211926 [0,2,0,0,0,0|2,0,0]=4 13151 B12R1.385 OCCSc1ccc(c(c1)Br)Br 62a_100000211926_100012356285 [0,2,0,0,0,0|1,1,0]=4 13152 B12R1.385 OCCSc1ccc(c(c1)Br)Br 62a_100012356285_100000211926 [0,2,0,0,0,0|1,1,0]=4 13153 B12R1.385 OCCSc1ccc(c(c1)Br)Cl 62a_100000211926_100012353702 [0,2,0,0,0,0|1,1,0]=4 13154 B12R1.385 OCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000211926 [0,2,0,0,0,0|1,1,0]=4 13155 B12R1.385 OCCSc1ccc(c(c1)Br)F 62a_100000211926_100012047266 [0,2,0,0,0,0|1,1,0]=4 13156 B12R1.385 OCCSc1ccc(c(c1)Br)F 62a_100012047266_100000211926 [0,2,0,0,0,0|1,1,0]=4 13157 B12R1.385 OCCSc1ccc(c(c1)Br)O 62a_100000211926_100012361655 [0,2,0,0,0,0|0,1,0]=3 13158 B12R1.385 OCCSc1ccc(c(c1)Br)O 62a_100012361655_100000211926 [0,2,0,0,0,0|0,1,0]=3 13159 B12R1.385 OCCSc1ccc(c(c1)Cl)Br 62a_100000211926_100012047281 [0,2,0,0,0,0|1,1,0]=4 13160 B12R1.385 OCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000211926 [0,2,0,0,0,0|1,1,0]=4 13161 B12R1.385 OCCSc1ccc(c(c1)Cl)Cl 62a_100000211926_100011214914 [0,2,0,0,0,0|1,1,0]=4 13162 B12R1.385 OCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000211926 [0,2,0,0,0,0|1,1,0]=4 13163 B12R1.385 OCCSc1ccc(c(c1)Cl)F 62a_100000211926_100011215976 [0,2,0,0,0,0|1,1,0]=4 13164 B12R1.385 OCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000211926 [0,2,0,0,0,0|1,1,0]=4 13165 B12R1.385 OCCSc1ccc(c(c1)Cl)O 62a_100000211926_100012360047 [0,2,0,0,0,0|0,1,0]=3 13166 B12R1.385 OCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000211926 [0,2,0,0,0,0|0,1,0]=3 13167 B12R1.385 OCCSc1ccc(c(c1)F)Br 62a_100000211926_100000685389 [0,2,0,0,0,0|1,1,0]=4 13168 B12R1.385 OCCSc1ccc(c(c1)F)Br 62a_100000685389_100000211926 [0,2,0,0,0,0|1,1,0]=4 13169 B12R1.385 OCCSc1ccc(c(c1)F)Cl 62a_100000211926_100011216805 [0,2,0,0,0,0|1,1,0]=4 13170 B12R1.385 OCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000211926 [0,2,0,0,0,0|1,1,0]=4 13171 B12R1.385 OCCSc1ccc(c(c1)F)F 62a_100000211926_100000703953 [0,2,0,0,0,0|1,1,0]=4 13172 B12R1.385 OCCSc1ccc(c(c1)F)F 62a_100000703953_100000211926 [0,2,0,0,0,0|1,1,0]=4 13173 B12R1.385 OCCSc1ccc(c(c1)F)O 62a_100000185481_100000211926 [0,2,0,0,0,0|0,1,0]=3 13174 B12R1.385 OCCSc1ccc(c(c1)F)O 62a_100000211926_100000185481 [0,2,0,0,0,0|0,1,0]=3 13175 B12R1.385 OCCSc1ccc(c(c1)O)Br 62a_100000211926_100012356990 [0,2,0,0,0,0|1,1,0]=4 13176 B12R1.385 OCCSc1ccc(c(c1)O)Br 62a_100012356990_100000211926 [0,2,0,0,0,0|1,1,0]=4 13177 B12R1.385 OCCSc1ccc(c(c1)O)Cl 62a_100000211926_100011356854 [0,2,0,0,0,0|1,1,0]=4 13178 B12R1.385 OCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000211926 [0,2,0,0,0,0|1,1,0]=4 13179 B12R1.385 OCCSc1ccc(c(c1)O)F 62a_100000211926_100000686035 [0,2,0,0,0,0|1,1,0]=4 13180 B12R1.385 OCCSc1ccc(c(c1)O)F 62a_100000686035_100000211926 [0,2,0,0,0,0|1,1,0]=4 13181 B12R1.385 OCCSc1ccc(c(c1)O)O 62a_100000211926_100009813601 [0,2,0,0,0,0|0,1,0]=3 13182 B12R1.385 OCCSc1ccc(c(n1)Br)O 62a_100000211926_100000725334 [0,2,0,0,0,0|1,1,0]=4 13183 B12R1.385 OCCSc1ccc(c(n1)Br)O 62a_100000725334_100000211926 [0,2,0,0,0,0|1,1,0]=4 13184 B12R1.385 OCCSc1ccc(c(n1)Cl)O 62a_100000211926_100000721234 [0,2,0,0,0,0|1,1,0]=4 13185 B12R1.385 OCCSc1ccc(c(n1)F)O 62a_100000211926_100009819667 [0,2,0,0,0,0|1,1,0]=4 13186 B12R1.385 OCCSc1ccc(c(n1)F)O 62a_100009819667_100000211926 [0,2,0,0,0,0|1,1,0]=4 13187 B12R1.385 OCCSc1cnc(c(c1)Cl)O 62a_100000211926_100010238531 [0,2,0,0,0,0|1,1,0]=4 13188 B12R1.385 OCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000211926 [0,2,0,0,0,0|1,1,0]=4 13189 B12R1.385 Oc1cc(ccc1Br)SCCF 62a_100011217306_100012356990 [0,2,0,0,0,0|1,1,0]=4 13190 B12R1.385 Oc1cc(ccc1Br)SCCF 62a_100012356990_100011217306 [0,2,0,0,0,0|1,1,0]=4 13191 B12R1.385 Oc1cc(ccc1Cl)NCCF 34a_100011934209_100011217306 [0,2,0,0,0,0|2,0,0]=4 13192 B12R1.385 Oc1cc(ccc1Cl)SCCF 62a_100011217306_100011356854 [0,2,0,0,0,0|1,1,0]=4 13193 B12R1.385 Oc1cc(ccc1Cl)SCCF 62a_100011356854_100011217306 [0,2,0,0,0,0|1,1,0]=4 13194 B12R1.385 Oc1cc(ccc1F)NCCF 34a_100012017398_100011217306 [0,2,0,0,0,0|2,0,0]=4 13195 B12R1.385 Oc1cc(ccc1F)NCCF 7a_100012017398_100011217306 [0,2,0,0,0,0|2,0,0]=4 13196 B12R1.385 Oc1cc(ccc1F)SCCF 62a_100000686035_100011217306 [0,2,0,0,0,0|1,1,0]=4 13197 B12R1.385 Oc1cc(ccc1F)SCCF 62a_100011217306_100000686035 [0,2,0,0,0,0|1,1,0]=4 13198 B12R1.385 Oc1ccc(cc1Br)NCCF 34a_100011534360_100011217306 [0,2,0,0,0,0|1,0,0]=3 13199 B12R1.385 Oc1ccc(cc1Br)SCCF 62a_100011217306_100012361655 [0,2,0,0,0,0|0,1,0]=3 13200 B12R1.385 Oc1ccc(cc1Br)SCCF 62a_100012361655_100011217306 [0,2,0,0,0,0|0,1,0]=3 13201 B12R1.385 Oc1ccc(cc1Cl)NCCF 34a_100000744943_100011217306 [0,2,0,0,0,0|1,0,0]=3 13202 B12R1.385 Oc1ccc(cc1Cl)SCCF 62a_100011217306_100012360047 [0,2,0,0,0,0|0,1,0]=3 13203 B12R1.385 Oc1ccc(cc1Cl)SCCF 62a_100012360047_100011217306 [0,2,0,0,0,0|0,1,0]=3 13204 B12R1.385 Oc1ccc(cc1F)CNCF 34a_100000758358_100015361967 [0,2,0,0,0,0|2,0,0]=4 13205 B12R1.385 Oc1ccc(cc1F)NCCF 34a_100011220035_100011217306 [0,2,0,0,0,0|1,0,0]=3 13206 B12R1.385 Oc1ccc(cc1F)NCCF 7a_100011220035_100011217306 [0,2,0,0,0,0|1,0,0]=3 13207 B12R1.385 Oc1ccc(cc1F)SCCF 62a_100000185481_100011217306 [0,2,0,0,0,0|0,1,0]=3 13208 B12R1.385 Oc1ccc(cc1F)SCCF 62a_100011217306_100000185481 [0,2,0,0,0,0|0,1,0]=3 13209 B12R1.385 Oc1ccc(cc1O)CNCF 34a_100000010075_100015361967 [0,2,0,0,0,0|2,0,0]=4 13210 B12R1.385 Oc1ccc(cc1O)NCCF 34a_100102946323_100011217306 [0,2,0,0,0,0|1,0,0]=3 13211 B12R1.385 Oc1ccc(cc1O)SCCF 62a_100011217306_100009813601 [0,2,0,0,0,0|0,1,0]=3 13212 B12R1.385 Oc1ccc(nc1Br)SCCF 62a_100000725334_100011217306 [0,2,0,0,0,0|1,1,0]=4 13213 B12R1.385 Oc1ccc(nc1Br)SCCF 62a_100011217306_100000725334 [0,2,0,0,0,0|1,1,0]=4 13214 B12R1.385 Oc1ccc(nc1Cl)SCCF 62a_100011217306_100000721234 [0,2,0,0,0,0|1,1,0]=4 13215 B12R1.385 Oc1ccc(nc1F)SCCF 62a_100009819667_100011217306 [0,2,0,0,0,0|1,1,0]=4 13216 B12R1.385 Oc1ccc(nc1F)SCCF 62a_100011217306_100009819667 [0,2,0,0,0,0|1,1,0]=4 13217 B12R1.385 Oc1ncc(cc1Cl)SCCF 62a_100010238531_100011217306 [0,2,0,0,0,0|1,1,0]=4 13218 B12R1.385 Oc1ncc(cc1Cl)SCCF 62a_100011217306_100010238531 [0,2,0,0,0,0|1,1,0]=4 13219 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200025704644 [0,2,0,0,0,0|2,0,0]=4 13220 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200025704644 [0,2,0,0,0,0|2,0,0]=4 13221 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)F 2230a_200011997520_200025704644 [0,2,0,0,0,0|2,0,0]=4 13222 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)F 34a_200011997520_200025704644 [0,2,0,0,0,0|2,0,0]=4 13223 B12R1.385 [13CH3]NCCc1ccc(c(c1)F)F 2230a_200000706328_200025704644 [0,2,0,0,0,0|2,0,0]=4 13224 B12R1.385 [13CH3]NCCc1ccc(c(c1)F)F 34a_200000706328_200025704644 [0,2,0,0,0,0|2,0,0]=4 13225 B12R1.385 [13CH3]NCCc1ccc(c(c1)O)O 34a_100000210387_200025704644 [0,2,0,0,0,0|1,0,0]=3 13226 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)Cl 34a_100011709245_200025704644 [0,2,0,0,0,0|2,0,0]=4 13227 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)Cl 7a_100011709245_200025704644 [0,2,0,0,0,0|2,0,0]=4 13228 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)F 34a_100011830478_200025704644 [0,2,0,0,0,0|2,0,0]=4 13229 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)F 7a_100011830478_200025704644 [0,2,0,0,0,0|2,0,0]=4 13230 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Br 34a_100012921202_200025704644 [0,2,0,0,0,0|2,0,0]=4 13231 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Br 7a_100012921202_200025704644 [0,2,0,0,0,0|2,0,0]=4 13232 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Cl 34a_100011934464_200025704644 [0,2,0,0,0,0|2,0,0]=4 13233 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Cl 7a_100011934464_200025704644 [0,2,0,0,0,0|2,0,0]=4 13234 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)F 34a_100000690376_200025704644 [0,2,0,0,0,0|2,0,0]=4 13235 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)F 7a_100000690376_200025704644 [0,2,0,0,0,0|2,0,0]=4 13236 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)Cl 62a_100011713676_200025704644 [0,2,0,0,0,0|2,0,0]=4 13237 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)Cl 62a_200025704644_100011713676 [0,2,0,0,0,0|2,0,0]=4 13238 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)F 62a_100012361305_200025704644 [0,2,0,0,0,0|2,0,0]=4 13239 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)F 62a_200025704644_100012361305 [0,2,0,0,0,0|2,0,0]=4 13240 B12R1.385 [13CH3]SCCc1ccc(c(c1)F)F 62a_100000690553_200025704644 [0,2,0,0,0,0|2,0,0]=4 13241 B12R1.385 [13CH3]SCCc1ccc(c(c1)F)F 62a_200025704644_100000690553 [0,2,0,0,0,0|2,0,0]=4 13242 B12R1.385 [13CH3]SCCc1ccc(c(c1)O)O 62a_200025704644_200010393615 [0,2,0,0,0,0|1,0,0]=3 13243 B12R1.4 C#Cc1ccc(cc1)NC(C)C 34a_100011215031_100000210206 [0,2,0,0,0,0|2,0,0]=4 13244 B12R1.4 C#Cc1ccc(nc1)OC(C)C 34a_200009884252_100000210206 [0,2,0,0,0,0|2,0,0]=4 13245 B12R1.4 C=Cc1ccc(cc1)CC(C)C 271570a_100011290941_100011221366 [0,2,0,0,0,0|2,0,0]=4 13246 B12R1.4 C=Cc1ccc(cc1)NC(C)C 271570a_100011290941_100000219625 [0,2,0,0,0,0|2,0,0]=4 13247 B12R1.4 C=Cc1ccc(cc1)NC(C)C 34a_100011218248_100000210206 [0,2,0,0,0,0|2,0,0]=4 13248 B12R1.4 C=Cc1ccc(cc1)OC(=O)C 271570a_100011290941_100000002173 [0,2,0,0,0,0|1,0,1]=4 13249 B12R1.4 C=Cc1ccc(cc1)OC(=S)C 271570a_100011290941_200009816735 [0,2,0,0,0,0|1,0,1]=4 13250 B12R1.4 C=Cc1ccc(cc1)OC(C)C 271570a_100011290941_100000169947 [0,2,0,0,0,0|1,0,0]=3 13251 B12R1.4 C=Cc1ccc(cc1)OC(C)C 34a_100000189437_100000210206 [0,2,0,0,0,0|1,0,0]=3 13252 B12R1.4 C=Cc1ccc(cc1)OC(C)C 7a_100000189437_100000210206 [0,2,0,0,0,0|1,0,0]=3 13253 B12R1.4 C=Cc1ccc(cc1)OC(F)F 271570a_100011290941_100000179047 [0,2,0,0,0,0|2,0,0]=4 13254 B12R1.4 C=Cc1ccc(cc1)SC(C)C 271570a_100011290941_100009811894 [0,2,0,0,0,0|1,1,0]=4 13255 B12R1.4 C=Cc1ccc(cc1)SC(C)C 62a_100000210206_100000748128 [0,2,0,0,0,0|1,1,0]=4 13256 B12R1.4 C=Cc1ccc(cc1)SC(C)C 62a_100000748128_100000210206 [0,2,0,0,0,0|1,1,0]=4 13257 B12R1.4 C=Cc1ccc(cn1)OC(C)C 271570a_100011290941_100012354243 [0,2,0,0,0,0|2,0,0]=4 13258 B12R1.4 C=Cc1ccc(nc1)OC(C)C 271570a_100011290941_100000688564 [0,2,0,0,0,0|2,0,0]=4 13259 B12R1.4 CC(=Cc1ccc(cc1)CO)C 271570a_100102525489_100000690907 [0,2,0,0,0,0|1,0,1]=4 13260 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [0,2,0,0,0,0|1,0,1]=4 13261 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [0,2,0,0,0,0|1,0,1]=4 13262 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [0,2,0,0,0,0|1,0,1]=4 13263 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [0,2,0,0,0,0|1,0,1]=4 13264 B12R1.4 CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000070787 [0,2,0,0,0,0|1,0,1]=4 13265 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [0,2,0,0,0,0|1,0,1]=4 13266 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [0,2,0,0,0,0|1,0,1]=4 13267 B12R1.4 CC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000002173 [0,2,0,0,0,0|0,1,1]=4 13268 B12R1.4 CC(=S)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009816735 [0,2,0,0,0,0|0,1,1]=4 13269 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [0,2,0,0,0,0|2,0,0]=4 13270 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [0,2,0,0,0,0|2,0,0]=4 13271 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [0,2,0,0,0,0|1,1,0]=4 13272 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [0,2,0,0,0,0|1,1,0]=4 13273 B12R1.4 CC(C)Nc1ccc(cc1)C#N 34a_100000185469_100000210206 [0,2,0,0,0,0|2,0,0]=4 13274 B12R1.4 CC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000210206 [0,2,0,0,0,0|1,0,0]=3 13275 B12R1.4 CC(C)Nc1ccc(cc1)CO 34a_100011215238_100000210206 [0,2,0,0,0,0|1,0,0]=3 13276 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_100000219625_200025704644 [0,2,0,0,0,0|1,1,0]=4 13277 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000219625 [0,2,0,0,0,0|1,1,0]=4 13278 B12R1.4 CC(C)Oc1ccc(cc1)C#N 34a_100000210344_100000210206 [0,2,0,0,0,0|1,0,0]=3 13279 B12R1.4 CC(C)Oc1ccc(cc1)C#N 7a_100000210344_100000210206 [0,2,0,0,0,0|1,0,0]=3 13280 B12R1.4 CC(C)Oc1ccc(cc1)CN 34a_100000185549_100000210206 [0,2,0,0,0,0|1,0,0]=3 13281 B12R1.4 CC(C)Oc1ccc(cc1)CO 34a_100000211755_100000210206 [0,2,0,0,0,0|0,0,0]=2 13282 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 2230a_100011194259_200025704644 [0,2,0,0,0,0|1,0,0]=3 13283 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 34a_100011194259_200025704644 [0,2,0,0,0,0|1,0,0]=3 13284 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 34a_100000757185_200025704644 [0,2,0,0,0,0|0,0,0]=2 13285 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 7a_100000757185_200025704644 [0,2,0,0,0,0|0,0,0]=2 13286 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_100000169947_200025704644 [0,2,0,0,0,0|0,1,0]=3 13287 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000169947 [0,2,0,0,0,0|0,1,0]=3 13288 B12R1.4 CC(C)Oc1ccc(cn1)CN 34a_100000757128_100000210206 [0,2,0,0,0,0|2,0,0]=4 13289 B12R1.4 CC(C)Oc1ccc(cn1)O[13CH3] 34a_100009858630_200025704644 [0,2,0,0,0,0|1,0,0]=3 13290 B12R1.4 CC(C)Oc1ccc(cn1)S[13CH3] 62a_100000688564_200025704644 [0,2,0,0,0,0|1,1,0]=4 13291 B12R1.4 CC(C)Oc1ccc(cn1)S[13CH3] 62a_200025704644_100000688564 [0,2,0,0,0,0|1,1,0]=4 13292 B12R1.4 CC(C)Oc1ccc(nc1)C#N 34a_100011934750_100000210206 [0,2,0,0,0,0|2,0,0]=4 13293 B12R1.4 CC(C)Oc1ccc(nc1)C#N 7a_100011934750_100000210206 [0,2,0,0,0,0|2,0,0]=4 13294 B12R1.4 CC(C)Oc1ccc(nc1)CN 34a_100020605196_100000210206 [0,2,0,0,0,0|2,0,0]=4 13295 B12R1.4 CC(C)Oc1ccc(nc1)CO 34a_103436540053_100000210206 [0,2,0,0,0,0|1,0,0]=3 13296 B12R1.4 CC(C)Oc1ccc(nc1)S[13CH3] 62a_100012354243_200025704644 [0,2,0,0,0,0|1,1,0]=4 13297 B12R1.4 CC(C)Oc1ccc(nc1)S[13CH3] 62a_200025704644_100012354243 [0,2,0,0,0,0|1,1,0]=4 13298 B12R1.4 CC(C)Sc1ccc(cc1)C#N 62a_100000210206_100000184291 [0,2,0,0,0,0|1,1,0]=4 13299 B12R1.4 CC(C)Sc1ccc(cc1)C=O 62a_100000188517_100000210206 [0,2,0,0,0,0|0,1,1]=4 13300 B12R1.4 CC(C)Sc1ccc(cc1)C=O 62a_100000210206_100000188517 [0,2,0,0,0,0|0,1,1]=4 13301 B12R1.4 CC(C)Sc1ccc(cc1)CF 62a_100000210206_100010268989 [0,2,0,0,0,0|1,1,0]=4 13302 B12R1.4 CC(C)Sc1ccc(cc1)CF 62a_100010268989_100000210206 [0,2,0,0,0,0|1,1,0]=4 13303 B12R1.4 CC(C)Sc1ccc(cc1)CN 62a_100000210206_100016989417 [0,2,0,0,0,0|1,1,0]=4 13304 B12R1.4 CC(C)Sc1ccc(cc1)CN 62a_100016989417_100000210206 [0,2,0,0,0,0|1,1,0]=4 13305 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000210206_100000690907 [0,2,0,0,0,0|0,1,0]=3 13306 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000690907_100000210206 [0,2,0,0,0,0|0,1,0]=3 13307 B12R1.4 CC(C)Sc1ccc(cc1)NN 62a_100000210206_100016988836 [0,2,0,0,0,0|1,1,0]=4 13308 B12R1.4 CC(C)Sc1ccc(cc1)NN 62a_100016988836_100000210206 [0,2,0,0,0,0|1,1,0]=4 13309 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_100009811894_200025704644 [0,2,0,0,0,0|0,2,0]=4 13310 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_200025704644_100009811894 [0,2,0,0,0,0|0,2,0]=4 13311 B12R1.4 CC(C)Sc1ccc(cn1)CO 62a_100000210206_100009816760 [0,2,0,0,0,0|1,1,0]=4 13312 B12R1.4 CC(C)Sc1ccc(cn1)CO 62a_100009816760_100000210206 [0,2,0,0,0,0|1,1,0]=4 13313 B12R1.4 CC(C)Sc1ccc(nc1)CO 62a_100000210206_100000754261 [0,2,0,0,0,0|1,1,0]=4 13314 B12R1.4 CC(C)Sc1ccc(nc1)CO 62a_100000754261_100000210206 [0,2,0,0,0,0|1,1,0]=4 13315 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [0,2,0,0,0,0|1,0,0]=3 13316 B12R1.4 CCc1ccc(cc1)NC(C)C 2230a_100000211069_100000210206 [0,2,0,0,0,0|2,0,0]=4 13317 B12R1.4 CCc1ccc(cc1)NC(C)C 34a_100000211069_100000210206 [0,2,0,0,0,0|2,0,0]=4 13318 B12R1.4 CCc1ccc(cc1)OC(C)C 34a_100000211359_100000210206 [0,2,0,0,0,0|1,0,0]=3 13319 B12R1.4 CCc1ccc(cc1)OC(C)C 7a_100000211359_100000210206 [0,2,0,0,0,0|1,0,0]=3 13320 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100000210206_100011215824 [0,2,0,0,0,0|1,1,0]=4 13321 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100011215824_100000210206 [0,2,0,0,0,0|1,1,0]=4 13322 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [0,2,0,0,0,0|2,0,0]=4 13323 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [0,2,0,0,0,0|2,0,0]=4 13324 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [0,2,0,0,0,0|2,0,0]=4 13325 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [0,2,0,0,0,0|2,0,0]=4 13326 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [0,2,0,0,0,0|2,0,0]=4 13327 B12R1.4 CNc1ccc(cc1)OC(C)C 2230a_100011194259_200000210301 [0,2,0,0,0,0|1,0,0]=3 13328 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100000182112_100000210206 [0,2,0,0,0,0|1,0,0]=3 13329 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100011194259_200000210301 [0,2,0,0,0,0|1,0,0]=3 13330 B12R1.4 CNc1ccc(cc1)OC(F)F 2230a_100000183591_200000210301 [0,2,0,0,0,0|2,0,0]=4 13331 B12R1.4 CNc1ccc(cc1)OC(F)F 34a_100000183591_200000210301 [0,2,0,0,0,0|2,0,0]=4 13332 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000210206_100000743151 [0,2,0,0,0,0|1,1,0]=4 13333 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000743151_100000210206 [0,2,0,0,0,0|1,1,0]=4 13334 B12R1.4 COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000171711 [0,2,0,0,0,0|1,0,1]=4 13335 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [0,2,0,0,0,0|1,0,1]=4 13336 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [0,2,0,0,0,0|1,0,1]=4 13337 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [0,2,0,0,0,0|1,0,1]=4 13338 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [0,2,0,0,0,0|1,0,1]=4 13339 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [0,2,0,0,0,0|1,0,0]=3 13340 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [0,2,0,0,0,0|2,0,0]=4 13341 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [0,2,0,0,0,0|2,0,0]=4 13342 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [0,2,0,0,0,0|2,0,0]=4 13343 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [0,2,0,0,0,0|2,0,0]=4 13344 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [0,2,0,0,0,0|2,0,0]=4 13345 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [0,2,0,0,0,0|2,0,0]=4 13346 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [0,2,0,0,0,0|2,0,0]=4 13347 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [0,2,0,0,0,0|1,0,1]=4 13348 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [0,2,0,0,0,0|1,0,1]=4 13349 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [0,2,0,0,0,0|1,0,1]=4 13350 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [0,2,0,0,0,0|1,0,1]=4 13351 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [0,2,0,0,0,0|1,0,1]=4 13352 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [0,2,0,0,0,0|1,0,1]=4 13353 B12R1.4 COc1ccc(cc1)NC(C)C 34a_100000184247_100000210206 [0,2,0,0,0,0|1,0,0]=3 13354 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000210503_100000210206 [0,2,0,0,0,0|0,0,0]=2 13355 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000757185_200000210301 [0,2,0,0,0,0|0,0,0]=2 13356 B12R1.4 COc1ccc(cc1)OC(C)C 7a_100000757185_200000210301 [0,2,0,0,0,0|0,0,0]=2 13357 B12R1.4 COc1ccc(cc1)OC(F)F 34a_100011217645_200000210301 [0,2,0,0,0,0|1,0,0]=3 13358 B12R1.4 COc1ccc(cc1)OC(F)F 7a_100011217645_200000210301 [0,2,0,0,0,0|1,0,0]=3 13359 B12R1.4 COc1ccc(cc1)SC(C)C 62a_100000210206_100000171711 [0,2,0,0,0,0|0,1,0]=3 13360 B12R1.4 COc1ccc(cn1)OC(C)C 34a_100011934560_100000210206 [0,2,0,0,0,0|1,0,0]=3 13361 B12R1.4 COc1ccc(cn1)SC(C)C 62a_100000047065_100000210206 [0,2,0,0,0,0|1,1,0]=4 13362 B12R1.4 COc1ccc(cn1)SC(C)C 62a_100000210206_100000047065 [0,2,0,0,0,0|1,1,0]=4 13363 B12R1.4 COc1ccc(nc1)OC(C)C 34a_100009858630_200000210301 [0,2,0,0,0,0|1,0,0]=3 13364 B12R1.4 COc1ccc(nc1)OC(C)C 34a_100012002028_100000210206 [0,2,0,0,0,0|1,0,0]=3 13365 B12R1.4 COc1ccc(nc1)OC(F)F 34a_100009876428_200000210301 [0,2,0,0,0,0|2,0,0]=4 13366 B12R1.4 COc1ccc(nc1)SC(C)C 62a_100000210206_100000744180 [0,2,0,0,0,0|1,1,0]=4 13367 B12R1.4 COc1ccc(nc1)SC(C)C 62a_100000755202_100000210206 [0,2,0,0,0,0|1,1,0]=4 13368 B12R1.4 COc1ncc(cn1)OC(C)C 34a_100000099601_100000210206 [0,2,0,0,0,0|2,0,0]=4 13369 B12R1.4 COc1ncc(cn1)OC(C)C 7a_100000099601_100000210206 [0,2,0,0,0,0|2,0,0]=4 13370 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [0,2,0,0,0,0|1,1,0]=4 13371 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [0,2,0,0,0,0|1,1,0]=4 13372 B12R1.4 CSc1ccc(cc1)NC(C)C 34a_100000212337_100000210206 [0,2,0,0,0,0|1,1,0]=4 13373 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_100000219625_200000210301 [0,2,0,0,0,0|1,1,0]=4 13374 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_200000210301_100000219625 [0,2,0,0,0,0|1,1,0]=4 13375 B12R1.4 CSc1ccc(cc1)OC(=O)C 62a_200000210301_100000002173 [0,2,0,0,0,0|0,1,1]=4 13376 B12R1.4 CSc1ccc(cc1)OC(=S)C 62a_200000210301_200009816735 [0,2,0,0,0,0|0,1,1]=4 13377 B12R1.4 CSc1ccc(cc1)OC(C)C 34a_100000211864_100000210206 [0,2,0,0,0,0|0,1,0]=3 13378 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_100000169947_200000210301 [0,2,0,0,0,0|0,1,0]=3 13379 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_200000210301_100000169947 [0,2,0,0,0,0|0,1,0]=3 13380 B12R1.4 CSc1ccc(cc1)OC(F)F 62a_100000179047_200000210301 [0,2,0,0,0,0|1,1,0]=4 13381 B12R1.4 CSc1ccc(cc1)OC(F)F 62a_200000210301_100000179047 [0,2,0,0,0,0|1,1,0]=4 13382 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100000210206_100011263217 [0,2,0,0,0,0|0,2,0]=4 13383 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100009811894_200000210301 [0,2,0,0,0,0|0,2,0]=4 13384 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100011263217_100000210206 [0,2,0,0,0,0|0,2,0]=4 13385 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_200000210301_100009811894 [0,2,0,0,0,0|0,2,0]=4 13386 B12R1.4 CSc1ccc(cn1)OC(C)C 62a_100012354243_200000210301 [0,2,0,0,0,0|1,1,0]=4 13387 B12R1.4 CSc1ccc(cn1)OC(C)C 62a_200000210301_100012354243 [0,2,0,0,0,0|1,1,0]=4 13388 B12R1.4 CSc1ccc(nc1)OC(C)C 62a_100000688564_200000210301 [0,2,0,0,0,0|1,1,0]=4 13389 B12R1.4 CSc1ccc(nc1)OC(C)C 62a_200000210301_100000688564 [0,2,0,0,0,0|1,1,0]=4 13390 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [0,2,0,0,0,0|1,0,1]=4 13391 B12R1.4 [13CH3]Nc1ccc(cc1)OC(F)F 2230a_100000183591_200025704644 [0,2,0,0,0,0|2,0,0]=4 13392 B12R1.4 [13CH3]Nc1ccc(cc1)OC(F)F 34a_100000183591_200025704644 [0,2,0,0,0,0|2,0,0]=4 13393 B12R1.4 [13CH3]Oc1ccc(cc1)OC(F)F 34a_100011217645_200025704644 [0,2,0,0,0,0|1,0,0]=3 13394 B12R1.4 [13CH3]Oc1ccc(cc1)OC(F)F 7a_100011217645_200025704644 [0,2,0,0,0,0|1,0,0]=3 13395 B12R1.4 [13CH3]Oc1ccc(nc1)OC(F)F 34a_100009876428_200025704644 [0,2,0,0,0,0|2,0,0]=4 13396 B12R1.4 [13CH3]Sc1ccc(cc1)OC(F)F 62a_100000179047_200025704644 [0,2,0,0,0,0|1,1,0]=4 13397 B12R1.4 [13CH3]Sc1ccc(cc1)OC(F)F 62a_200025704644_100000179047 [0,2,0,0,0,0|1,1,0]=4 13398 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [0,2,0,0,0,0|1,0,1]=4 13399 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [0,2,0,0,0,0|1,0,1]=4 13400 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [0,2,0,0,0,0|1,0,1]=4 13401 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [0,2,0,0,0,0|1,0,1]=4 13402 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [0,2,0,0,0,0|1,0,1]=4 13403 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [0,2,0,0,0,0|1,0,1]=4 13404 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [0,2,0,0,0,0|1,0,1]=4 13405 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [0,2,0,0,0,0|1,0,1]=4 13406 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [0,2,0,0,0,0|1,0,1]=4 13407 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [0,2,0,0,0,0|1,0,1]=4 13408 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [0,2,0,0,0,0|1,0,1]=4 13409 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [0,2,0,0,0,0|1,0,1]=4 13410 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [0,2,0,0,0,0|1,0,1]=4 13411 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [0,2,0,0,0,0|1,0,1]=4 13412 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [0,2,0,0,0,0|1,0,1]=4 13413 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [0,2,0,0,0,0|1,0,1]=4 13414 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [0,2,0,0,0,0|1,0,1]=4 13415 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [0,2,0,0,0,0|1,0,1]=4 13416 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [0,2,0,0,0,0|1,0,1]=4 13417 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [0,2,0,0,0,0|1,0,1]=4 13418 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [0,2,0,0,0,0|1,0,1]=4 13419 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [0,2,0,0,0,0|1,0,1]=4 13420 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [0,2,0,0,0,0|1,0,1]=4 13421 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [0,2,0,0,0,0|1,0,1]=4 13422 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [0,2,0,0,0,0|1,0,1]=4 13423 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Br 2230a_100011306057_100000210206 [0,2,0,0,0,0|2,0,0]=4 13424 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Br 34a_100011306057_100000210206 [0,2,0,0,0,0|2,0,0]=4 13425 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Br 7a_100011306057_100000210206 [0,2,0,0,0,0|2,0,0]=4 13426 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210206 [0,2,0,0,0,0|2,0,0]=4 13427 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Cl 34a_100000686031_100000210206 [0,2,0,0,0,0|2,0,0]=4 13428 B12R1.19 CC(C)Nc1ccc(c(c1)Br)F 2230a_100000760356_100000210206 [0,2,0,0,0,0|2,0,0]=4 13429 B12R1.19 CC(C)Nc1ccc(c(c1)Br)F 34a_100000760356_100000210206 [0,2,0,0,0,0|2,0,0]=4 13430 B12R1.19 CC(C)Nc1ccc(c(c1)Br)F 7a_100000760356_100000210206 [0,2,0,0,0,0|2,0,0]=4 13431 B12R1.19 CC(C)Nc1ccc(c(c1)Br)I 34a_100000750458_100000210206 [0,2,0,0,0,0|2,0,0]=4 13432 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [0,2,0,0,0,0|1,0,0]=3 13433 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210206 [0,2,0,0,0,0|2,0,0]=4 13434 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br 34a_100000687081_100000210206 [0,2,0,0,0,0|2,0,0]=4 13435 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br 7a_100000687081_100000210206 [0,2,0,0,0,0|2,0,0]=4 13436 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210206 [0,2,0,0,0,0|2,0,0]=4 13437 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210206 [0,2,0,0,0,0|2,0,0]=4 13438 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F 2230a_100000211060_100000210206 [0,2,0,0,0,0|2,0,0]=4 13439 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F 34a_100000211060_100000210206 [0,2,0,0,0,0|2,0,0]=4 13440 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F 7a_100000211060_100000210206 [0,2,0,0,0,0|2,0,0]=4 13441 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)I 34a_100000761885_100000210206 [0,2,0,0,0,0|2,0,0]=4 13442 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [0,2,0,0,0,0|1,0,0]=3 13443 B12R1.19 CC(C)Nc1ccc(c(c1)F)Br 2230a_100000759894_100000210206 [0,2,0,0,0,0|2,0,0]=4 13444 B12R1.19 CC(C)Nc1ccc(c(c1)F)Br 34a_100000759894_100000210206 [0,2,0,0,0,0|2,0,0]=4 13445 B12R1.19 CC(C)Nc1ccc(c(c1)F)Br 7a_100000759894_100000210206 [0,2,0,0,0,0|2,0,0]=4 13446 B12R1.19 CC(C)Nc1ccc(c(c1)F)Cl 2230a_100000739366_100000210206 [0,2,0,0,0,0|2,0,0]=4 13447 B12R1.19 CC(C)Nc1ccc(c(c1)F)Cl 34a_100000739366_100000210206 [0,2,0,0,0,0|2,0,0]=4 13448 B12R1.19 CC(C)Nc1ccc(c(c1)F)Cl 7a_100000739366_100000210206 [0,2,0,0,0,0|2,0,0]=4 13449 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 2230a_100000210724_100000210206 [0,2,0,0,0,0|2,0,0]=4 13450 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 34a_100000210724_100000210206 [0,2,0,0,0,0|2,0,0]=4 13451 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 7a_100000210724_100000210206 [0,2,0,0,0,0|2,0,0]=4 13452 B12R1.19 CC(C)Nc1ccc(c(c1)F)I 34a_100011356925_100000210206 [0,2,0,0,0,0|2,0,0]=4 13453 B12R1.19 CC(C)Nc1ccc(c(c1)F)I 7a_100011356925_100000210206 [0,2,0,0,0,0|2,0,0]=4 13454 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [0,2,0,0,0,0|1,0,0]=3 13455 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [0,2,0,0,0,0|1,0,0]=3 13456 B12R1.19 CC(C)Nc1ccc(c(c1)I)Br 34a_100000750459_100000210206 [0,2,0,0,0,0|2,0,0]=4 13457 B12R1.19 CC(C)Nc1ccc(c(c1)I)Cl 34a_100012360549_100000210206 [0,2,0,0,0,0|2,0,0]=4 13458 B12R1.19 CC(C)Nc1ccc(c(c1)I)F 34a_114828291077_100000210206 [0,2,0,0,0,0|2,0,0]=4 13459 B12R1.19 CC(C)Nc1ccc(c(c1)I)F 7a_114828291077_100000210206 [0,2,0,0,0,0|2,0,0]=4 13460 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [0,2,0,0,0,0|2,0,0]=4 13461 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [0,2,0,0,0,0|2,0,0]=4 13462 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [0,2,0,0,0,0|2,0,0]=4 13463 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [0,2,0,0,0,0|1,0,0]=3 13464 B12R1.19 CC(C)Oc1cc(c(cn1)Br)Cl 34a_100010369989_100000210206 [0,2,0,0,0,0|2,0,0]=4 13465 B12R1.19 CC(C)Oc1cc(c(cn1)Cl)Cl 34a_200000099200_100000210206 [0,2,0,0,0,0|2,0,0]=4 13466 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl 34a_100011933957_100000210206 [0,2,0,0,0,0|1,0,0]=3 13467 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl 7a_100011933957_100000210206 [0,2,0,0,0,0|1,0,0]=3 13468 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 34a_100000693481_100000210206 [0,2,0,0,0,0|1,0,0]=3 13469 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 7a_100000693481_100000210206 [0,2,0,0,0,0|1,0,0]=3 13470 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I 34a_100000701344_100000210206 [0,2,0,0,0,0|1,0,0]=3 13471 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I 7a_100000701344_100000210206 [0,2,0,0,0,0|1,0,0]=3 13472 B12R1.19 CC(C)Oc1ccc(c(c1)Br)N 34a_100012001276_100000210206 [0,2,0,0,0,0|1,0,0]=3 13473 B12R1.19 CC(C)Oc1ccc(c(c1)Br)N 7a_100012001276_100000210206 [0,2,0,0,0,0|1,0,0]=3 13474 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 34a_100011215161_100000210206 [0,2,0,0,0,0|1,0,0]=3 13475 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 7a_100011215161_100000210206 [0,2,0,0,0,0|1,0,0]=3 13476 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210206 [0,2,0,0,0,0|1,0,0]=3 13477 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210206 [0,2,0,0,0,0|1,0,0]=3 13478 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 34a_100000211030_100000210206 [0,2,0,0,0,0|1,0,0]=3 13479 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 7a_100000211030_100000210206 [0,2,0,0,0,0|1,0,0]=3 13480 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 34a_100000047559_100000210206 [0,2,0,0,0,0|1,0,0]=3 13481 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 7a_100000047559_100000210206 [0,2,0,0,0,0|1,0,0]=3 13482 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)N 34a_100011215599_100000210206 [0,2,0,0,0,0|1,0,0]=3 13483 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)N 7a_100011215599_100000210206 [0,2,0,0,0,0|1,0,0]=3 13484 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br 34a_100000755031_100000210206 [0,2,0,0,0,0|1,0,0]=3 13485 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br 7a_100000755031_100000210206 [0,2,0,0,0,0|1,0,0]=3 13486 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl 34a_100000691581_100000210206 [0,2,0,0,0,0|1,0,0]=3 13487 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl 7a_100000691581_100000210206 [0,2,0,0,0,0|1,0,0]=3 13488 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 34a_100000181275_100000210206 [0,2,0,0,0,0|1,0,0]=3 13489 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 7a_100000181275_100000210206 [0,2,0,0,0,0|1,0,0]=3 13490 B12R1.19 CC(C)Oc1ccc(c(c1)F)I 34a_100009990212_100000210206 [0,2,0,0,0,0|1,0,0]=3 13491 B12R1.19 CC(C)Oc1ccc(c(c1)F)I 7a_100009990212_100000210206 [0,2,0,0,0,0|1,0,0]=3 13492 B12R1.19 CC(C)Oc1ccc(c(c1)F)N 34a_100000759473_100000210206 [0,2,0,0,0,0|1,0,0]=3 13493 B12R1.19 CC(C)Oc1ccc(c(c1)F)N 7a_100000759473_100000210206 [0,2,0,0,0,0|1,0,0]=3 13494 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [0,2,0,0,0,0|0,0,0]=2 13495 B12R1.19 CC(C)Oc1ccc(c(c1)I)Br 34a_100012339312_100000210206 [0,2,0,0,0,0|1,0,0]=3 13496 B12R1.19 CC(C)Oc1ccc(c(c1)I)Br 7a_100012339312_100000210206 [0,2,0,0,0,0|1,0,0]=3 13497 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl 34a_100000049588_100000210206 [0,2,0,0,0,0|1,0,0]=3 13498 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl 7a_100000049588_100000210206 [0,2,0,0,0,0|1,0,0]=3 13499 B12R1.19 CC(C)Oc1ccc(c(c1)I)N 34a_100010084370_100000210206 [0,2,0,0,0,0|1,0,0]=3 13500 B12R1.19 CC(C)Oc1ccc(c(c1)I)N 7a_100010084370_100000210206 [0,2,0,0,0,0|1,0,0]=3 13501 B12R1.19 CC(C)Oc1ccc(c(c1)N)Br 34a_100011999798_100000210206 [0,2,0,0,0,0|1,0,0]=3 13502 B12R1.19 CC(C)Oc1ccc(c(c1)N)Br 7a_100011999798_100000210206 [0,2,0,0,0,0|1,0,0]=3 13503 B12R1.19 CC(C)Oc1ccc(c(c1)N)Cl 34a_100011934297_100000210206 [0,2,0,0,0,0|1,0,0]=3 13504 B12R1.19 CC(C)Oc1ccc(c(c1)N)F 34a_100012017239_100000210206 [0,2,0,0,0,0|1,0,0]=3 13505 B12R1.19 CC(C)Oc1ccc(c(c1)N)F 7a_100012017239_100000210206 [0,2,0,0,0,0|1,0,0]=3 13506 B12R1.19 CC(C)Oc1ccc(c(c1)N)N 34a_100025771000_100000210206 [0,2,0,0,0,0|1,0,0]=3 13507 B12R1.19 CC(C)Oc1ccc(c(n1)F)Br 34a_100009879308_100000210206 [0,2,0,0,0,0|2,0,0]=4 13508 B12R1.19 CC(C)Oc1cnc(c(c1)Br)Cl 34a_100012356455_100000210206 [0,2,0,0,0,0|2,0,0]=4 13509 B12R1.19 CC(C)Oc1cnc(c(c1)Br)Cl 7a_100012356455_100000210206 [0,2,0,0,0,0|2,0,0]=4 13510 B12R1.19 CC(C)Oc1cnc(c(c1)Br)F 34a_100009817267_100000210206 [0,2,0,0,0,0|2,0,0]=4 13511 B12R1.19 CC(C)Oc1cnc(c(c1)Br)F 7a_100009817267_100000210206 [0,2,0,0,0,0|2,0,0]=4 13512 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)Br 34a_100010209684_100000210206 [0,2,0,0,0,0|2,0,0]=4 13513 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)Br 7a_100010209684_100000210206 [0,2,0,0,0,0|2,0,0]=4 13514 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)Cl 34a_100000094354_100000210206 [0,2,0,0,0,0|2,0,0]=4 13515 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)Cl 7a_100000094354_100000210206 [0,2,0,0,0,0|2,0,0]=4 13516 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)F 34a_100000087088_100000210206 [0,2,0,0,0,0|2,0,0]=4 13517 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)F 7a_100000087088_100000210206 [0,2,0,0,0,0|2,0,0]=4 13518 B12R1.19 CC(C)Oc1cnc(c(c1)F)Cl 34a_100000063512_100000210206 [0,2,0,0,0,0|2,0,0]=4 13519 B12R1.19 CC(C)Oc1cnc(c(c1)F)Cl 7a_100000063512_100000210206 [0,2,0,0,0,0|2,0,0]=4 13520 B12R1.19 CC(C)Sc1cc(c(cn1)O)N 62a_100000210206_100009819941 [0,2,0,0,0,0|1,1,0]=4 13521 B12R1.19 CC(C)Sc1cc(c(cn1)O)N 62a_100009819941_100000210206 [0,2,0,0,0,0|1,1,0]=4 13522 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Br 62a_100000210206_100012356285 [0,2,0,0,0,0|1,1,0]=4 13523 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Br 62a_100012356285_100000210206 [0,2,0,0,0,0|1,1,0]=4 13524 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Cl 62a_100000210206_100012353702 [0,2,0,0,0,0|1,1,0]=4 13525 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Cl 62a_100012353702_100000210206 [0,2,0,0,0,0|1,1,0]=4 13526 B12R1.19 CC(C)Sc1ccc(c(c1)Br)F 62a_100000210206_100012047266 [0,2,0,0,0,0|1,1,0]=4 13527 B12R1.19 CC(C)Sc1ccc(c(c1)Br)F 62a_100012047266_100000210206 [0,2,0,0,0,0|1,1,0]=4 13528 B12R1.19 CC(C)Sc1ccc(c(c1)Br)N 62a_100000210206_100000750455 [0,2,0,0,0,0|1,1,0]=4 13529 B12R1.19 CC(C)Sc1ccc(c(c1)Br)N 62a_100000750455_100000210206 [0,2,0,0,0,0|1,1,0]=4 13530 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [0,2,0,0,0,0|0,1,0]=3 13531 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [0,2,0,0,0,0|0,1,0]=3 13532 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Br 62a_100000210206_100012047281 [0,2,0,0,0,0|1,1,0]=4 13533 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Br 62a_100012047281_100000210206 [0,2,0,0,0,0|1,1,0]=4 13534 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Cl 62a_100000210206_100011214914 [0,2,0,0,0,0|1,1,0]=4 13535 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210206 [0,2,0,0,0,0|1,1,0]=4 13536 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)F 62a_100000210206_100011215976 [0,2,0,0,0,0|1,1,0]=4 13537 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)F 62a_100011215976_100000210206 [0,2,0,0,0,0|1,1,0]=4 13538 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)N 62a_100000210206_100011218065 [0,2,0,0,0,0|1,1,0]=4 13539 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)N 62a_100011218065_100000210206 [0,2,0,0,0,0|1,1,0]=4 13540 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [0,2,0,0,0,0|0,1,0]=3 13541 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [0,2,0,0,0,0|0,1,0]=3 13542 B12R1.19 CC(C)Sc1ccc(c(c1)F)Br 62a_100000210206_100000685389 [0,2,0,0,0,0|1,1,0]=4 13543 B12R1.19 CC(C)Sc1ccc(c(c1)F)Br 62a_100000685389_100000210206 [0,2,0,0,0,0|1,1,0]=4 13544 B12R1.19 CC(C)Sc1ccc(c(c1)F)Cl 62a_100000210206_100011216805 [0,2,0,0,0,0|1,1,0]=4 13545 B12R1.19 CC(C)Sc1ccc(c(c1)F)Cl 62a_100011216805_100000210206 [0,2,0,0,0,0|1,1,0]=4 13546 B12R1.19 CC(C)Sc1ccc(c(c1)F)F 62a_100000210206_100000703953 [0,2,0,0,0,0|1,1,0]=4 13547 B12R1.19 CC(C)Sc1ccc(c(c1)F)F 62a_100000703953_100000210206 [0,2,0,0,0,0|1,1,0]=4 13548 B12R1.19 CC(C)Sc1ccc(c(c1)F)N 62a_100000210206_100011215594 [0,2,0,0,0,0|1,1,0]=4 13549 B12R1.19 CC(C)Sc1ccc(c(c1)F)N 62a_100011215594_100000210206 [0,2,0,0,0,0|1,1,0]=4 13550 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [0,2,0,0,0,0|0,1,0]=3 13551 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [0,2,0,0,0,0|0,1,0]=3 13552 B12R1.19 CC(C)Sc1ccc(c(c1)N)Br 62a_100000210206_100000750456 [0,2,0,0,0,0|1,1,0]=4 13553 B12R1.19 CC(C)Sc1ccc(c(c1)N)Br 62a_100000750456_100000210206 [0,2,0,0,0,0|1,1,0]=4 13554 B12R1.19 CC(C)Sc1ccc(c(c1)N)Cl 62a_100000210206_200000761891 [0,2,0,0,0,0|1,1,0]=4 13555 B12R1.19 CC(C)Sc1ccc(c(c1)N)Cl 62a_200000761891_100000210206 [0,2,0,0,0,0|1,1,0]=4 13556 B12R1.19 CC(C)Sc1ccc(c(c1)N)F 62a_100000210206_100000740924 [0,2,0,0,0,0|1,1,0]=4 13557 B12R1.19 CC(C)Sc1ccc(c(c1)N)F 62a_100000740924_100000210206 [0,2,0,0,0,0|1,1,0]=4 13558 B12R1.19 CC(C)Sc1ccc(c(c1)N)N 62a_100000210206_100011534411 [0,2,0,0,0,0|1,1,0]=4 13559 B12R1.19 CC(C)Sc1ccc(c(c1)N)N 62a_100000741789_100000210206 [0,2,0,0,0,0|1,1,0]=4 13560 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [0,2,0,0,0,0|0,1,0]=3 13561 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [0,2,0,0,0,0|0,1,0]=3 13562 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [0,2,0,0,0,0|1,1,0]=4 13563 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [0,2,0,0,0,0|1,1,0]=4 13564 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [0,2,0,0,0,0|1,1,0]=4 13565 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [0,2,0,0,0,0|1,1,0]=4 13566 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [0,2,0,0,0,0|1,1,0]=4 13567 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [0,2,0,0,0,0|1,1,0]=4 13568 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [0,2,0,0,0,0|1,1,0]=4 13569 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [0,2,0,0,0,0|1,1,0]=4 13570 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [0,2,0,0,0,0|0,1,0]=3 13571 B12R1.19 CC(C)Sc1ccc(c(n1)Br)O 62a_100000210206_100000725334 [0,2,0,0,0,0|1,1,0]=4 13572 B12R1.19 CC(C)Sc1ccc(c(n1)Br)O 62a_100000725334_100000210206 [0,2,0,0,0,0|1,1,0]=4 13573 B12R1.19 CC(C)Sc1ccc(c(n1)Cl)O 62a_100000210206_100000721234 [0,2,0,0,0,0|1,1,0]=4 13574 B12R1.19 CC(C)Sc1ccc(c(n1)F)O 62a_100000210206_100009819667 [0,2,0,0,0,0|1,1,0]=4 13575 B12R1.19 CC(C)Sc1ccc(c(n1)F)O 62a_100009819667_100000210206 [0,2,0,0,0,0|1,1,0]=4 13576 B12R1.19 CC(C)Sc1ccc(c(n1)N)O 62a_100000210206_100000685527 [0,2,0,0,0,0|1,1,0]=4 13577 B12R1.19 CC(C)Sc1ccc(c(n1)N)O 62a_100000685527_100000210206 [0,2,0,0,0,0|1,1,0]=4 13578 B12R1.19 CC(C)Sc1cnc(c(c1)Cl)O 62a_100000210206_100010238531 [0,2,0,0,0,0|1,1,0]=4 13579 B12R1.19 CC(C)Sc1cnc(c(c1)Cl)O 62a_100010238531_100000210206 [0,2,0,0,0,0|1,1,0]=4 13580 B12R1.19 CC(C)Sc1cnc(c(c1)N)O 62a_100000210206_100000743729 [0,2,0,0,0,0|1,1,0]=4 13581 B12R1.19 CC(C)Sc1cnc(c(c1)N)O 62a_100000743729_100000210206 [0,2,0,0,0,0|1,1,0]=4 13582 B12R1.19 Cc1cc(ccc1Br)NC(C)C 2230a_100000210723_100000210206 [0,2,0,0,0,0|2,0,0]=4 13583 B12R1.19 Cc1cc(ccc1Br)NC(C)C 34a_100000210723_100000210206 [0,2,0,0,0,0|2,0,0]=4 13584 B12R1.19 Cc1cc(ccc1Br)NC(C)C 7a_100000210723_100000210206 [0,2,0,0,0,0|2,0,0]=4 13585 B12R1.19 Cc1cc(ccc1Br)OC(C)C 34a_100000690111_100000210206 [0,2,0,0,0,0|1,0,0]=3 13586 B12R1.19 Cc1cc(ccc1Br)OC(C)C 7a_100000690111_100000210206 [0,2,0,0,0,0|1,0,0]=3 13587 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100000210206_100009813585 [0,2,0,0,0,0|1,1,0]=4 13588 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100009813585_100000210206 [0,2,0,0,0,0|1,1,0]=4 13589 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 2230a_100000187808_100000210206 [0,2,0,0,0,0|2,0,0]=4 13590 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 34a_100000187808_100000210206 [0,2,0,0,0,0|2,0,0]=4 13591 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 7a_100000187808_100000210206 [0,2,0,0,0,0|2,0,0]=4 13592 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 34a_100000211092_100000210206 [0,2,0,0,0,0|1,0,0]=3 13593 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 7a_100000211092_100000210206 [0,2,0,0,0,0|1,0,0]=3 13594 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000049509_100000210206 [0,2,0,0,0,0|1,1,0]=4 13595 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000210206_100000049509 [0,2,0,0,0,0|1,1,0]=4 13596 B12R1.19 Cc1cc(ccc1F)NC(C)C 2230a_100000750164_100000210206 [0,2,0,0,0,0|2,0,0]=4 13597 B12R1.19 Cc1cc(ccc1F)NC(C)C 34a_100000750164_100000210206 [0,2,0,0,0,0|2,0,0]=4 13598 B12R1.19 Cc1cc(ccc1F)NC(C)C 7a_100000750164_100000210206 [0,2,0,0,0,0|2,0,0]=4 13599 B12R1.19 Cc1cc(ccc1F)OC(C)C 34a_100000751312_100000210206 [0,2,0,0,0,0|1,0,0]=3 13600 B12R1.19 Cc1cc(ccc1F)OC(C)C 7a_100000751312_100000210206 [0,2,0,0,0,0|1,0,0]=3 13601 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100000210206_100011218330 [0,2,0,0,0,0|1,1,0]=4 13602 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100011218330_100000210206 [0,2,0,0,0,0|1,1,0]=4 13603 B12R1.19 Cc1cc(ccc1I)NC(C)C 34a_100000198070_100000210206 [0,2,0,0,0,0|2,0,0]=4 13604 B12R1.19 Cc1cc(ccc1I)NC(C)C 7a_100000198070_100000210206 [0,2,0,0,0,0|2,0,0]=4 13605 B12R1.19 Cc1cc(ccc1I)OC(C)C 34a_100000729255_100000210206 [0,2,0,0,0,0|1,0,0]=3 13606 B12R1.19 Cc1cc(ccc1I)OC(C)C 7a_100000729255_100000210206 [0,2,0,0,0,0|1,0,0]=3 13607 B12R1.19 Cc1cc(ccc1N)OC(C)C 34a_100000756630_100000210206 [0,2,0,0,0,0|1,0,0]=3 13608 B12R1.19 Cc1cc(ccc1N)OC(C)C 7a_100000756630_100000210206 [0,2,0,0,0,0|1,0,0]=3 13609 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000210206_100000211769 [0,2,0,0,0,0|1,1,0]=4 13610 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000211769_100000210206 [0,2,0,0,0,0|1,1,0]=4 13611 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [0,2,0,0,0,0|1,0,1]=4 13612 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [0,2,0,0,0,0|1,0,0]=3 13613 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [0,2,0,0,0,0|1,0,0]=3 13614 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [0,2,0,0,0,0|0,1,0]=3 13615 B12R1.19 Cc1cc(cnc1Br)OC(C)C 34a_100012000486_100000210206 [0,2,0,0,0,0|2,0,0]=4 13616 B12R1.19 Cc1cc(cnc1Br)OC(C)C 7a_100012000486_100000210206 [0,2,0,0,0,0|2,0,0]=4 13617 B12R1.19 Cc1cc(cnc1C)OC(C)C 34a_100009854398_100000210206 [0,2,0,0,0,0|2,0,0]=4 13618 B12R1.19 Cc1cc(cnc1C)OC(C)C 7a_100009854398_100000210206 [0,2,0,0,0,0|2,0,0]=4 13619 B12R1.19 Cc1cc(cnc1Cl)OC(C)C 34a_100012002680_100000210206 [0,2,0,0,0,0|2,0,0]=4 13620 B12R1.19 Cc1cc(cnc1Cl)OC(C)C 7a_100012002680_100000210206 [0,2,0,0,0,0|2,0,0]=4 13621 B12R1.19 Cc1cc(cnc1F)OC(C)C 34a_100000094615_100000210206 [0,2,0,0,0,0|2,0,0]=4 13622 B12R1.19 Cc1cc(cnc1F)OC(C)C 7a_100000094615_100000210206 [0,2,0,0,0,0|2,0,0]=4 13623 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000210206_100000685391 [0,2,0,0,0,0|1,1,0]=4 13624 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000685391_100000210206 [0,2,0,0,0,0|1,1,0]=4 13625 B12R1.19 Cc1cc(ncc1Br)OC(C)C 34a_100000766222_100000210206 [0,2,0,0,0,0|2,0,0]=4 13626 B12R1.19 Cc1cc(ncc1Cl)OC(C)C 34a_200000085746_100000210206 [0,2,0,0,0,0|2,0,0]=4 13627 B12R1.19 Cc1cc(ncc1O)OC(F)F 271570a_203496583355_100010189806 [0,2,0,0,0,0|2,0,0]=4 13628 B12R1.19 Cc1cc(ncc1O)SC(C)C 62a_100000210206_100000692680 [0,2,0,0,0,0|1,1,0]=4 13629 B12R1.19 Cc1ccc(cc1Br)NC(C)C 2230a_100000736455_100000210206 [0,2,0,0,0,0|2,0,0]=4 13630 B12R1.19 Cc1ccc(cc1Br)NC(C)C 34a_100000736455_100000210206 [0,2,0,0,0,0|2,0,0]=4 13631 B12R1.19 Cc1ccc(cc1Br)NC(C)C 7a_100000736455_100000210206 [0,2,0,0,0,0|2,0,0]=4 13632 B12R1.19 Cc1ccc(cc1Br)OC(C)C 34a_100011380479_100000210206 [0,2,0,0,0,0|1,0,0]=3 13633 B12R1.19 Cc1ccc(cc1Br)OC(C)C 7a_100011380479_100000210206 [0,2,0,0,0,0|1,0,0]=3 13634 B12R1.19 Cc1ccc(cc1Br)SC(C)C 62a_100000210206_100011847877 [0,2,0,0,0,0|1,1,0]=4 13635 B12R1.19 Cc1ccc(cc1Br)SC(C)C 62a_100011847877_100000210206 [0,2,0,0,0,0|1,1,0]=4 13636 B12R1.19 Cc1ccc(cc1C)NC(C)C 2230a_100000724040_100000210206 [0,2,0,0,0,0|2,0,0]=4 13637 B12R1.19 Cc1ccc(cc1C)NC(C)C 34a_100000724040_100000210206 [0,2,0,0,0,0|2,0,0]=4 13638 B12R1.19 Cc1ccc(cc1C)NC(C)C 7a_100000724040_100000210206 [0,2,0,0,0,0|2,0,0]=4 13639 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [0,2,0,0,0,0|1,0,0]=3 13640 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [0,2,0,0,0,0|1,0,0]=3 13641 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100000210206_100011215607 [0,2,0,0,0,0|1,1,0]=4 13642 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100011215607_100000210206 [0,2,0,0,0,0|1,1,0]=4 13643 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 2230a_100000188892_100000210206 [0,2,0,0,0,0|2,0,0]=4 13644 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 34a_100000188892_100000210206 [0,2,0,0,0,0|2,0,0]=4 13645 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 7a_100000188892_100000210206 [0,2,0,0,0,0|2,0,0]=4 13646 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 34a_100011265682_100000210206 [0,2,0,0,0,0|1,0,0]=3 13647 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 7a_100011265682_100000210206 [0,2,0,0,0,0|1,0,0]=3 13648 B12R1.19 Cc1ccc(cc1Cl)SC(C)C 62a_100000210206_100011216363 [0,2,0,0,0,0|1,1,0]=4 13649 B12R1.19 Cc1ccc(cc1Cl)SC(C)C 62a_100011216363_100000210206 [0,2,0,0,0,0|1,1,0]=4 13650 B12R1.19 Cc1ccc(cc1F)NC(C)C 2230a_100000210958_100000210206 [0,2,0,0,0,0|2,0,0]=4 13651 B12R1.19 Cc1ccc(cc1F)NC(C)C 34a_100000210958_100000210206 [0,2,0,0,0,0|2,0,0]=4 13652 B12R1.19 Cc1ccc(cc1F)NC(C)C 7a_100000210958_100000210206 [0,2,0,0,0,0|2,0,0]=4 13653 B12R1.19 Cc1ccc(cc1F)OC(C)C 34a_100000722560_100000210206 [0,2,0,0,0,0|1,0,0]=3 13654 B12R1.19 Cc1ccc(cc1F)OC(C)C 7a_100000722560_100000210206 [0,2,0,0,0,0|1,0,0]=3 13655 B12R1.19 Cc1ccc(cc1F)SC(C)C 62a_100000210206_100000720648 [0,2,0,0,0,0|1,1,0]=4 13656 B12R1.19 Cc1ccc(cc1F)SC(C)C 62a_100000720648_100000210206 [0,2,0,0,0,0|1,1,0]=4 13657 B12R1.19 Cc1ccc(cc1I)NC(C)C 34a_100000184131_100000210206 [0,2,0,0,0,0|2,0,0]=4 13658 B12R1.19 Cc1ccc(cc1I)NC(C)C 7a_100000184131_100000210206 [0,2,0,0,0,0|2,0,0]=4 13659 B12R1.19 Cc1ccc(cc1N)OC(C)C 34a_100011216113_100000210206 [0,2,0,0,0,0|1,0,0]=3 13660 B12R1.19 Cc1ccc(cc1N)OC(C)C 7a_100011216113_100000210206 [0,2,0,0,0,0|1,0,0]=3 13661 B12R1.19 Cc1ccc(cc1N)SC(C)C 62a_100000210206_100000761890 [0,2,0,0,0,0|1,1,0]=4 13662 B12R1.19 Cc1ccc(cc1N)SC(C)C 62a_100000761890_100000210206 [0,2,0,0,0,0|1,1,0]=4 13663 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [0,2,0,0,0,0|2,0,0]=4 13664 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [0,2,0,0,0,0|2,0,0]=4 13665 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [0,2,0,0,0,0|1,0,0]=3 13666 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [0,2,0,0,0,0|1,1,0]=4 13667 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [0,2,0,0,0,0|1,1,0]=4 13668 B12R1.19 Cc1cnc(cc1Br)OC(C)C 34a_100009831917_100000210206 [0,2,0,0,0,0|2,0,0]=4 13669 B12R1.19 Cc1nc(ccc1Br)OC(C)C 34a_100000691680_100000210206 [0,2,0,0,0,0|2,0,0]=4 13670 B12R1.19 Cc1nc(ccc1Cl)OC(C)C 34a_200009863735_100000210206 [0,2,0,0,0,0|2,0,0]=4 13671 B12R1.19 Cc1nc(ccc1O)OC(C)C 271570a_203496583355_200012350186 [0,2,0,0,0,0|1,0,0]=3 13672 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100000210206_100010233687 [0,2,0,0,0,0|1,1,0]=4 13673 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100010233687_100000210206 [0,2,0,0,0,0|1,1,0]=4 13674 B12R1.19 Cc1ncc(cc1Br)OC(C)C 34a_100009819603_100000210206 [0,2,0,0,0,0|2,0,0]=4 13675 B12R1.19 Cc1ncc(cc1Br)OC(C)C 7a_100009819603_100000210206 [0,2,0,0,0,0|2,0,0]=4 13676 B12R1.19 Nc1cc(ccc1O)OC(F)F 271570a_203496583355_100010145974 [0,2,0,0,0,0|1,0,0]=3 13677 B12R1.19 Nc1ccc(cc1O)OC(F)F 271570a_203496583355_100010212270 [0,2,0,0,0,0|2,0,0]=4 13678 B12R1.19 Oc1ccc(cc1F)OC(F)F 271570a_203496583355_100000722742 [0,2,0,0,0,0|1,0,0]=3 13679 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [0,2,0,0,0,0|1,0,1]=4 13680 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [0,2,0,0,0,0|1,0,1]=4 13681 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [0,2,0,0,0,0|1,0,1]=4 13682 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [0,2,0,0,0,0|1,0,1]=4 13683 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,2,0,0,0,0|1,0,1]=4 13684 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,2,0,0,0,0|1,0,1]=4 13685 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,2,0,0,0,0|1,0,1]=4 13686 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,2,0,0,0,0|1,0,1]=4 13687 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,2,0,0,0,0|1,0,1]=4 13688 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,2,0,0,0,0|1,0,1]=4 13689 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,2,0,0,0,0|1,0,1]=4 13690 B12R1.20 CC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000210206 [0,2,0,0,0,0|2,0,0]=4 13691 B12R1.20 CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210206 [0,2,0,0,0,0|2,0,0]=4 13692 B12R1.20 CC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000210206 [0,2,0,0,0,0|2,0,0]=4 13693 B12R1.20 CC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000210206 [0,2,0,0,0,0|2,0,0]=4 13694 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,2,0,0,0,0|1,0,0]=3 13695 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,2,0,0,0,0|1,0,0]=3 13696 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 2230a_100000219623_100000210206 [0,2,0,0,0,0|2,0,0]=4 13697 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 2230a_100000219625_200000210301 [0,2,0,0,0,0|2,0,0]=4 13698 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 269982a_100000219623_100000210206 [0,2,0,0,0,0|2,0,0]=4 13699 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 269982a_100000219625_200000210301 [0,2,0,0,0,0|2,0,0]=4 13700 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 34a_100000219623_100000210206 [0,2,0,0,0,0|2,0,0]=4 13701 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 34a_100000219625_200000210301 [0,2,0,0,0,0|2,0,0]=4 13702 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 7a_100000219625_200000210301 [0,2,0,0,0,0|2,0,0]=4 13703 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 2230a_100000749197_200000210301 [0,2,0,0,0,0|2,0,0]=4 13704 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 2230a_100020629279_100000210206 [0,2,0,0,0,0|2,0,0]=4 13705 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 269982a_100000749197_200000210301 [0,2,0,0,0,0|2,0,0]=4 13706 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 269982a_100020629279_100000210206 [0,2,0,0,0,0|2,0,0]=4 13707 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 34a_100000749197_200000210301 [0,2,0,0,0,0|2,0,0]=4 13708 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 34a_100020629279_100000210206 [0,2,0,0,0,0|2,0,0]=4 13709 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 7a_100000749197_200000210301 [0,2,0,0,0,0|2,0,0]=4 13710 B12R1.20 CC(C)N(C)c1ccc(cc1)F 2230a_100000219829_100000210206 [0,2,0,0,0,0|2,0,0]=4 13711 B12R1.20 CC(C)N(C)c1ccc(cc1)F 2230a_100000219830_200000210301 [0,2,0,0,0,0|2,0,0]=4 13712 B12R1.20 CC(C)N(C)c1ccc(cc1)F 269982a_100000219829_100000210206 [0,2,0,0,0,0|2,0,0]=4 13713 B12R1.20 CC(C)N(C)c1ccc(cc1)F 269982a_100000219830_200000210301 [0,2,0,0,0,0|2,0,0]=4 13714 B12R1.20 CC(C)N(C)c1ccc(cc1)F 34a_100000219829_100000210206 [0,2,0,0,0,0|2,0,0]=4 13715 B12R1.20 CC(C)N(C)c1ccc(cc1)F 34a_100000219830_200000210301 [0,2,0,0,0,0|2,0,0]=4 13716 B12R1.20 CC(C)N(C)c1ccc(cc1)F 7a_100000219830_200000210301 [0,2,0,0,0,0|2,0,0]=4 13717 B12R1.20 CC(C)N(C)c1ccc(cc1)I 2230a_100000743151_100000210206 [0,2,0,0,0,0|2,0,0]=4 13718 B12R1.20 CC(C)N(C)c1ccc(cc1)I 269982a_100000743151_100000210206 [0,2,0,0,0,0|2,0,0]=4 13719 B12R1.20 CC(C)N(C)c1ccc(cc1)I 34a_100000743151_100000210206 [0,2,0,0,0,0|2,0,0]=4 13720 B12R1.20 CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000210206 [0,2,0,0,0,0|1,0,0]=3 13721 B12R1.20 CC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000210206 [0,2,0,0,0,0|1,0,0]=3 13722 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 2230a_100000219625_200025704644 [0,2,0,0,0,0|2,0,0]=4 13723 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 269982a_100000219625_200025704644 [0,2,0,0,0,0|2,0,0]=4 13724 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 34a_100000219625_200025704644 [0,2,0,0,0,0|2,0,0]=4 13725 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 7a_100000219625_200025704644 [0,2,0,0,0,0|2,0,0]=4 13726 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 2230a_100000749197_200025704644 [0,2,0,0,0,0|2,0,0]=4 13727 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 269982a_100000749197_200025704644 [0,2,0,0,0,0|2,0,0]=4 13728 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 34a_100000749197_200025704644 [0,2,0,0,0,0|2,0,0]=4 13729 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 7a_100000749197_200025704644 [0,2,0,0,0,0|2,0,0]=4 13730 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 2230a_100000219830_200025704644 [0,2,0,0,0,0|2,0,0]=4 13731 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 269982a_100000219830_200025704644 [0,2,0,0,0,0|2,0,0]=4 13732 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 34a_100000219830_200025704644 [0,2,0,0,0,0|2,0,0]=4 13733 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 7a_100000219830_200025704644 [0,2,0,0,0,0|2,0,0]=4 13734 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [0,2,0,0,0,0|0,1,0]=3 13735 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [0,2,0,0,0,0|1,0,0]=3 13736 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 240690a_100102631434_100000212099 [0,2,0,0,0,0|2,0,0]=4 13737 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000159574 [0,2,0,0,0,0|2,0,0]=4 13738 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 527a_100102631434_100000212099 [0,2,0,0,0,0|2,0,0]=4 13739 B12R1.20 Cc1ccc(cc1)C(=O)C(C)C 1458a_100000188618_100000210206 [0,2,0,0,0,0|2,0,0]=4 13740 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000219977_100000210206 [0,2,0,0,0,0|2,0,0]=4 13741 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000748792_200000210301 [0,2,0,0,0,0|2,0,0]=4 13742 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000219977_100000210206 [0,2,0,0,0,0|2,0,0]=4 13743 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000748792_200000210301 [0,2,0,0,0,0|2,0,0]=4 13744 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000219977_100000210206 [0,2,0,0,0,0|2,0,0]=4 13745 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000748792_200000210301 [0,2,0,0,0,0|2,0,0]=4 13746 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 7a_100000748792_200000210301 [0,2,0,0,0,0|2,0,0]=4 13747 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 2230a_100000748792_200025704644 [0,2,0,0,0,0|2,0,0]=4 13748 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 269982a_100000748792_200025704644 [0,2,0,0,0,0|2,0,0]=4 13749 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 34a_100000748792_200025704644 [0,2,0,0,0,0|2,0,0]=4 13750 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 7a_100000748792_200025704644 [0,2,0,0,0,0|2,0,0]=4 13751 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,2,0,0,0,0|1,0,1]=4 13752 B12R1.106 CC(C)(C)Nc1ccc(cc1)Br 34a_100000210018_100000210625 [0,2,0,0,0,0|2,0,0]=4 13753 B12R1.106 CC(C)(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210625 [0,2,0,0,0,0|2,0,0]=4 13754 B12R1.106 CC(C)(C)Nc1ccc(cc1)F 34a_100000185862_100000210625 [0,2,0,0,0,0|2,0,0]=4 13755 B12R1.106 CC(C)(C)Nc1ccc(cc1)I 34a_100000185761_100000210625 [0,2,0,0,0,0|2,0,0]=4 13756 B12R1.106 CC(C)(C)Nc1ccc(cc1)O 34a_100000185829_100000210625 [0,2,0,0,0,0|1,0,0]=3 13757 B12R1.106 CC(C)(C)Oc1ccc(=O)[nH]c1 34a_100000075641_100000210625 [0,2,0,0,0,0|1,0,1]=4 13758 B12R1.106 CC(C)(C)Oc1ccc(cc1)Br 34a_100000185759_100000210625 [0,2,0,0,0,0|1,0,0]=3 13759 B12R1.106 CC(C)(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210625 [0,2,0,0,0,0|1,0,0]=3 13760 B12R1.106 CC(C)(C)Oc1ccc(cc1)F 34a_100000210339_100000210625 [0,2,0,0,0,0|1,0,0]=3 13761 B12R1.106 CC(C)(C)Oc1ccc(cc1)I 34a_100000212066_100000210625 [0,2,0,0,0,0|1,0,0]=3 13762 B12R1.106 CC(C)(C)Oc1ccc(cc1)N 34a_100000185829_100000210625 [0,2,0,0,0,0|1,0,0]=3 13763 B12R1.106 CC(C)(C)Oc1ccc(cc1)O 271570a_203496583355_100000701926 [0,2,0,0,0,0|0,0,0]=2 13764 B12R1.106 CC(C)(C)Oc1ccc(cn1)Cl 34a_100011215309_100000210625 [0,2,0,0,0,0|2,0,0]=4 13765 B12R1.106 CC(C)(C)Oc1ccc(cn1)F 34a_100000742473_100000210625 [0,2,0,0,0,0|2,0,0]=4 13766 B12R1.106 CC(C)(C)Oc1ccc(cn1)N 34a_100000729260_100000210625 [0,2,0,0,0,0|2,0,0]=4 13767 B12R1.106 CC(C)(C)Oc1ccc(cn1)O 271570a_203496583355_200000688780 [0,2,0,0,0,0|1,0,0]=3 13768 B12R1.106 CC(C)(C)Oc1ccc(nc1)Br 34a_100000685995_100000210625 [0,2,0,0,0,0|2,0,0]=4 13769 B12R1.106 CC(C)(C)Oc1ccc(nc1)Cl 34a_100000744096_100000210625 [0,2,0,0,0,0|2,0,0]=4 13770 B12R1.106 CC(C)(C)Oc1ccc(nc1)F 34a_100000688820_100000210625 [0,2,0,0,0,0|2,0,0]=4 13771 B12R1.106 CC(C)(C)Oc1ccc(nc1)I 34a_100000687607_100000210625 [0,2,0,0,0,0|2,0,0]=4 13772 B12R1.106 CC(C)(C)Oc1ccc(nc1)N 34a_100015188713_100000210625 [0,2,0,0,0,0|2,0,0]=4 13773 B12R1.106 CC(C)(C)Oc1ccc(nn1)O 271570a_203496583355_100011250755 [0,2,0,0,0,0|2,0,0]=4 13774 B12R1.106 CC(C)(C)Oc1ncc(cn1)O 271570a_203496583355_100011830486 [0,2,0,0,0,0|2,0,0]=4 13775 B12R1.106 CC(C)(C)Sc1ccc(cc1)Br 62a_100000211941_100000752885 [0,2,0,0,0,0|1,1,0]=4 13776 B12R1.106 CC(C)(C)Sc1ccc(cc1)Br 62a_100000752885_100000211941 [0,2,0,0,0,0|1,1,0]=4 13777 B12R1.106 CC(C)(C)Sc1ccc(cc1)Cl 62a_100000211941_100000755918 [0,2,0,0,0,0|1,1,0]=4 13778 B12R1.106 CC(C)(C)Sc1ccc(cc1)Cl 62a_100000755918_100000211941 [0,2,0,0,0,0|1,1,0]=4 13779 B12R1.106 CC(C)(C)Sc1ccc(cc1)F 62a_100000211213_100000211941 [0,2,0,0,0,0|1,1,0]=4 13780 B12R1.106 CC(C)(C)Sc1ccc(cc1)F 62a_100000211941_100000211213 [0,2,0,0,0,0|1,1,0]=4 13781 B12R1.106 CC(C)(C)Sc1ccc(cc1)N 62a_100000185761_100000211941 [0,2,0,0,0,0|1,1,0]=4 13782 B12R1.106 CC(C)(C)Sc1ccc(cc1)N 62a_100000211941_100000185761 [0,2,0,0,0,0|1,1,0]=4 13783 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 271570a_203496583355_200009816747 [0,2,0,0,0,0|0,1,0]=3 13784 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 62a_100000211941_100000185759 [0,2,0,0,0,0|0,1,0]=3 13785 B12R1.106 CC(C)(C)Sc1ccc(cn1)O 62a_100000211941_100000744096 [0,2,0,0,0,0|1,1,0]=4 13786 B12R1.106 CC(C)(C)Sc1ccc(cn1)O 62a_100000685995_100000211941 [0,2,0,0,0,0|1,1,0]=4 13787 B12R1.106 CC(F)(F)Cc1ccc(cc1)O 271570a_203496583355_100010238340 [0,2,0,0,0,0|1,0,0]=3 13788 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [0,2,0,0,0,0|2,0,0]=4 13789 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)O 271570a_203496583355_200000165602 [0,2,0,0,0,0|2,0,0]=4 13790 B12R1.106 C[Si](C)(C)Cc1ccc(cc1)O 271570a_203496583355_100009813299 [0,2,0,0,0,0|1,1,0]=4 13791 B12R1.106 C[Si](C)(C)Oc1ccc(cc1)O 271570a_203496583355_100009813852 [0,2,0,0,0,0|0,1,0]=3 13792 B12R1.106 Cc1ccc(cc1)NC(C)(C)C 34a_100000124888_100000210625 [0,2,0,0,0,0|2,0,0]=4 13793 B12R1.106 Cc1ccc(cc1)OC(C)(C)C 34a_100000210336_100000210625 [0,2,0,0,0,0|1,0,0]=3 13794 B12R1.106 Cc1ccc(cc1)OC(F)(F)F 34a_100000210336_200103152311 [0,2,0,0,0,0|2,0,0]=4 13795 B12R1.106 Cc1ccc(cc1)OC(F)(F)F 7a_100000210336_200000243211 [0,2,0,0,0,0|2,0,0]=4 13796 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000186775_100000211941 [0,2,0,0,0,0|1,1,0]=4 13797 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000186775 [0,2,0,0,0,0|1,1,0]=4 13798 B12R1.106 Cc1ccc(cn1)OC(C)(C)C 34a_100000745506_100000210625 [0,2,0,0,0,0|2,0,0]=4 13799 B12R1.106 Cc1ccc(nc1)OC(C)(C)C 34a_100000759353_100000210625 [0,2,0,0,0,0|2,0,0]=4 13800 B12R1.106 FC(F)(F)Oc1ccc(cc1)Br 34a_100000185759_200103152311 [0,2,0,0,0,0|2,0,0]=4 13801 B12R1.106 FC(F)(F)Oc1ccc(cc1)Br 7a_100000185759_200000243211 [0,2,0,0,0,0|2,0,0]=4 13802 B12R1.106 FC(F)(F)Oc1ccc(cc1)Cl 34a_100000210216_200103152311 [0,2,0,0,0,0|2,0,0]=4 13803 B12R1.106 FC(F)(F)Oc1ccc(cc1)Cl 7a_100000210216_200000243211 [0,2,0,0,0,0|2,0,0]=4 13804 B12R1.106 FC(F)(F)Oc1ccc(cc1)I 34a_100000212066_200103152311 [0,2,0,0,0,0|2,0,0]=4 13805 B12R1.106 FC(F)(F)Oc1ccc(cc1)I 7a_100000212066_200000243211 [0,2,0,0,0,0|2,0,0]=4 13806 B12R1.106 Fc1ccc(cc1)OC(F)(F)F 34a_100000210339_200103152311 [0,2,0,0,0,0|2,0,0]=4 13807 B12R1.106 Nc1ccc(cc1)OC(F)(F)F 34a_100000185829_200103152311 [0,2,0,0,0,0|2,0,0]=4 13808 B12R1.106 Oc1ccc(cc1)CC(F)(F)F 271570a_203496583355_100000723781 [0,2,0,0,0,0|2,0,0]=4 13809 B12R1.106 Oc1ccc(cc1)NC(F)(F)F 34a_100000185829_200103152311 [0,2,0,0,0,0|2,0,0]=4 13810 B12R1.106 Oc1ccc(cc1)OC(F)(F)F 271570a_203496583355_100011215100 [0,2,0,0,0,0|1,0,0]=3 13811 B12R1.106 Oc1ccc(cc1)SC(F)(F)F 271570a_203496583355_100009813175 [0,2,0,0,0,0|1,1,0]=4 13812 B12R1.106 Oc1ccc(cc1)SC(F)(F)F 62a_200000243211_100000185759 [0,2,0,0,0,0|1,1,0]=4 13813 B12R1.106 Oc1ccc(cn1)OC(F)(F)F 271570a_203496583355_100000687329 [0,2,0,0,0,0|2,0,0]=4 13814 B12R1.233 CC(=Cc1ccc(cc1Br)O)C 271570a_100102525489_100000701344 [0,2,0,0,0,0|1,0,1]=4 13815 B12R1.233 CC(=Cc1ccc(cc1C)O)C 271570a_100102525489_100000729255 [0,2,0,0,0,0|1,0,1]=4 13816 B12R1.233 CC(=Cc1ccc(cc1Cl)O)C 271570a_100102525489_100000047559 [0,2,0,0,0,0|1,0,1]=4 13817 B12R1.233 CC(=Cc1ccc(cc1F)O)C 271570a_100102525489_100000755031 [0,2,0,0,0,0|1,0,1]=4 13818 B12R1.233 CC(=Cc1ccc(cc1N)O)C 271570a_100102525489_100011999798 [0,2,0,0,0,0|1,0,1]=4 13819 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,2,0,0,0,0|1,0,1]=4 13820 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,2,0,0,0,0|1,0,1]=4 13821 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,2,0,0,0,0|1,0,1]=4 13822 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000070787 [0,2,0,0,0,0|1,0,1]=4 13823 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100103153847 [0,2,0,0,0,0|1,0,1]=4 13824 B12R1.233 CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000070787 [0,2,0,0,0,0|1,0,1]=4 13825 B12R1.233 CC(=O)Nc1ccc(cc1C)O 271570a_203496583355_100000152120 [0,2,0,0,0,0|1,0,1]=4 13826 B12R1.233 CC(=O)Nc1ccc(cc1C)O 527a_100000756630_100103153847 [0,2,0,0,0,0|1,0,1]=4 13827 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000070787 [0,2,0,0,0,0|1,0,1]=4 13828 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 271570a_203496583355_100011273303 [0,2,0,0,0,0|1,0,1]=4 13829 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100103153847 [0,2,0,0,0,0|1,0,1]=4 13830 B12R1.233 CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000070787 [0,2,0,0,0,0|1,0,1]=4 13831 B12R1.233 CC(=O)Nc1ccc(cc1F)O 271570a_203496583355_100000155584 [0,2,0,0,0,0|1,0,1]=4 13832 B12R1.233 CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100103153847 [0,2,0,0,0,0|1,0,1]=4 13833 B12R1.233 CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000070787 [0,2,0,0,0,0|1,0,1]=4 13834 B12R1.233 CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100103153847 [0,2,0,0,0,0|1,0,1]=4 13835 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [0,2,0,0,0,0|1,0,1]=4 13836 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,2,0,0,0,0|1,0,1]=4 13837 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,2,0,0,0,0|1,0,1]=4 13838 B12R1.233 CC(=O)Oc1ccc(cc1F)O 271570a_203496583355_100009811628 [0,2,0,0,0,0|0,0,1]=3 13839 B12R1.233 CC(C)Nc1ccc(cc1Br)Br 34a_100000211012_100000210206 [0,2,0,0,0,0|2,0,0]=4 13840 B12R1.233 CC(C)Nc1ccc(cc1Br)Cl 34a_100000752454_100000210206 [0,2,0,0,0,0|2,0,0]=4 13841 B12R1.233 CC(C)Nc1ccc(cc1Br)F 34a_100000738039_100000210206 [0,2,0,0,0,0|2,0,0]=4 13842 B12R1.233 CC(C)Nc1ccc(cc1Br)O 34a_100012001276_100000210206 [0,2,0,0,0,0|1,0,0]=3 13843 B12R1.233 CC(C)Nc1ccc(cc1Cl)Br 34a_100000211467_100000210206 [0,2,0,0,0,0|2,0,0]=4 13844 B12R1.233 CC(C)Nc1ccc(cc1Cl)Cl 34a_100000185861_100000210206 [0,2,0,0,0,0|2,0,0]=4 13845 B12R1.233 CC(C)Nc1ccc(cc1Cl)F 34a_100000212003_100000210206 [0,2,0,0,0,0|2,0,0]=4 13846 B12R1.233 CC(C)Nc1ccc(cc1Cl)I 34a_100011218065_100000210206 [0,2,0,0,0,0|2,0,0]=4 13847 B12R1.233 CC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000210206 [0,2,0,0,0,0|1,0,0]=3 13848 B12R1.233 CC(C)Nc1ccc(cc1F)Br 34a_100000210722_100000210206 [0,2,0,0,0,0|2,0,0]=4 13849 B12R1.233 CC(C)Nc1ccc(cc1F)Cl 34a_100000211020_100000210206 [0,2,0,0,0,0|2,0,0]=4 13850 B12R1.233 CC(C)Nc1ccc(cc1F)F 34a_100000210720_100000210206 [0,2,0,0,0,0|2,0,0]=4 13851 B12R1.233 CC(C)Nc1ccc(cc1F)I 34a_100011215594_100000210206 [0,2,0,0,0,0|2,0,0]=4 13852 B12R1.233 CC(C)Nc1ccc(cc1F)O 34a_100000759473_100000210206 [0,2,0,0,0,0|1,0,0]=3 13853 B12R1.233 CC(C)Nc1ccc(cc1I)Br 34a_100000187925_100000210206 [0,2,0,0,0,0|2,0,0]=4 13854 B12R1.233 CC(C)Nc1ccc(cc1I)Cl 34a_100000761889_100000210206 [0,2,0,0,0,0|2,0,0]=4 13855 B12R1.233 CC(C)Nc1ccc(cc1I)F 34a_100000760547_100000210206 [0,2,0,0,0,0|2,0,0]=4 13856 B12R1.233 CC(C)Nc1ccc(cc1I)O 34a_100010084370_100000210206 [0,2,0,0,0,0|1,0,0]=3 13857 B12R1.233 CC(C)Nc1ccc(cc1O)Br 34a_100000739049_100000210206 [0,2,0,0,0,0|2,0,0]=4 13858 B12R1.233 CC(C)Nc1ccc(cc1O)Cl 34a_100000185728_100000210206 [0,2,0,0,0,0|2,0,0]=4 13859 B12R1.233 CC(C)Nc1ccc(cc1O)F 34a_100000753323_100000210206 [0,2,0,0,0,0|2,0,0]=4 13860 B12R1.233 CC(C)Nc1ccc(cc1O)O 34a_100000106777_100000210206 [0,2,0,0,0,0|1,0,0]=3 13861 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 34a_100000188717_100000210206 [0,2,0,0,0,0|1,0,0]=3 13862 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 7a_100000188717_100000210206 [0,2,0,0,0,0|1,0,0]=3 13863 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl 34a_100000211998_100000210206 [0,2,0,0,0,0|1,0,0]=3 13864 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl 7a_100000211998_100000210206 [0,2,0,0,0,0|1,0,0]=3 13865 B12R1.233 CC(C)Oc1ccc(cc1Br)F 34a_100000211999_100000210206 [0,2,0,0,0,0|1,0,0]=3 13866 B12R1.233 CC(C)Oc1ccc(cc1Br)F 7a_100000211999_100000210206 [0,2,0,0,0,0|1,0,0]=3 13867 B12R1.233 CC(C)Oc1ccc(cc1Br)I 34a_100012361655_100000210206 [0,2,0,0,0,0|1,0,0]=3 13868 B12R1.233 CC(C)Oc1ccc(cc1Br)I 7a_100012361655_100000210206 [0,2,0,0,0,0|1,0,0]=3 13869 B12R1.233 CC(C)Oc1ccc(cc1Br)N 34a_100011534360_100000210206 [0,2,0,0,0,0|1,0,0]=3 13870 B12R1.233 CC(C)Oc1ccc(cc1Br)N 7a_100011534360_100000210206 [0,2,0,0,0,0|1,0,0]=3 13871 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br 34a_100000186472_100000210206 [0,2,0,0,0,0|1,0,0]=3 13872 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br 7a_100000186472_100000210206 [0,2,0,0,0,0|1,0,0]=3 13873 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 34a_100015191787_100000210206 [0,2,0,0,0,0|1,0,0]=3 13874 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 7a_100015191787_100000210206 [0,2,0,0,0,0|1,0,0]=3 13875 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 34a_100000212004_100000210206 [0,2,0,0,0,0|1,0,0]=3 13876 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 7a_100000212004_100000210206 [0,2,0,0,0,0|1,0,0]=3 13877 B12R1.233 CC(C)Oc1ccc(cc1Cl)I 34a_100012360047_100000210206 [0,2,0,0,0,0|1,0,0]=3 13878 B12R1.233 CC(C)Oc1ccc(cc1Cl)I 7a_100012360047_100000210206 [0,2,0,0,0,0|1,0,0]=3 13879 B12R1.233 CC(C)Oc1ccc(cc1Cl)N 34a_100000744943_100000210206 [0,2,0,0,0,0|1,0,0]=3 13880 B12R1.233 CC(C)Oc1ccc(cc1Cl)N 7a_100000744943_100000210206 [0,2,0,0,0,0|1,0,0]=3 13881 B12R1.233 CC(C)Oc1ccc(cc1F)Br 34a_100000185481_100000210206 [0,2,0,0,0,0|1,0,0]=3 13882 B12R1.233 CC(C)Oc1ccc(cc1F)Br 7a_100000185481_100000210206 [0,2,0,0,0,0|1,0,0]=3 13883 B12R1.233 CC(C)Oc1ccc(cc1F)Cl 34a_100000230166_100000210206 [0,2,0,0,0,0|1,0,0]=3 13884 B12R1.233 CC(C)Oc1ccc(cc1F)Cl 7a_100000230166_100000210206 [0,2,0,0,0,0|1,0,0]=3 13885 B12R1.233 CC(C)Oc1ccc(cc1F)F 34a_100000230127_100000210206 [0,2,0,0,0,0|1,0,0]=3 13886 B12R1.233 CC(C)Oc1ccc(cc1F)F 7a_100000230127_100000210206 [0,2,0,0,0,0|1,0,0]=3 13887 B12R1.233 CC(C)Oc1ccc(cc1F)I 34a_100011356965_100000210206 [0,2,0,0,0,0|1,0,0]=3 13888 B12R1.233 CC(C)Oc1ccc(cc1F)I 7a_100011356965_100000210206 [0,2,0,0,0,0|1,0,0]=3 13889 B12R1.233 CC(C)Oc1ccc(cc1F)N 34a_100011220035_100000210206 [0,2,0,0,0,0|1,0,0]=3 13890 B12R1.233 CC(C)Oc1ccc(cc1F)N 7a_100011220035_100000210206 [0,2,0,0,0,0|1,0,0]=3 13891 B12R1.233 CC(C)Oc1ccc(cc1F)O 271570a_203496583355_100009811877 [0,2,0,0,0,0|0,0,0]=2 13892 B12R1.233 CC(C)Oc1ccc(cc1I)Br 34a_100012355227_100000210206 [0,2,0,0,0,0|1,0,0]=3 13893 B12R1.233 CC(C)Oc1ccc(cc1I)Br 7a_100012355227_100000210206 [0,2,0,0,0,0|1,0,0]=3 13894 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 34a_100011356953_100000210206 [0,2,0,0,0,0|1,0,0]=3 13895 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 7a_100011356953_100000210206 [0,2,0,0,0,0|1,0,0]=3 13896 B12R1.233 CC(C)Oc1ccc(cc1I)F 34a_100012355409_100000210206 [0,2,0,0,0,0|1,0,0]=3 13897 B12R1.233 CC(C)Oc1ccc(cc1I)F 7a_100012355409_100000210206 [0,2,0,0,0,0|1,0,0]=3 13898 B12R1.233 CC(C)Oc1ccc(cc1I)I 7a_100010001573_100000210206 [0,2,0,0,0,0|1,0,0]=3 13899 B12R1.233 CC(C)Oc1ccc(cc1N)Br 34a_100000752626_100000210206 [0,2,0,0,0,0|1,0,0]=3 13900 B12R1.233 CC(C)Oc1ccc(cc1N)Br 7a_100000752626_100000210206 [0,2,0,0,0,0|1,0,0]=3 13901 B12R1.233 CC(C)Oc1ccc(cc1N)Cl 34a_100000210500_100000210206 [0,2,0,0,0,0|1,0,0]=3 13902 B12R1.233 CC(C)Oc1ccc(cc1N)Cl 7a_100000210500_100000210206 [0,2,0,0,0,0|1,0,0]=3 13903 B12R1.233 CC(C)Oc1ccc(cc1N)F 34a_100000759472_100000210206 [0,2,0,0,0,0|1,0,0]=3 13904 B12R1.233 CC(C)Oc1ccc(cc1N)F 7a_100000759472_100000210206 [0,2,0,0,0,0|1,0,0]=3 13905 B12R1.233 CC(C)Oc1ccc(cc1N)I 34a_100000753495_100000210206 [0,2,0,0,0,0|1,0,0]=3 13906 B12R1.233 CC(C)Oc1ccc(cc1N)I 7a_100000753495_100000210206 [0,2,0,0,0,0|1,0,0]=3 13907 B12R1.233 CC(C)Oc1ccc(cc1N)N 34a_100000725306_100000210206 [0,2,0,0,0,0|1,0,0]=3 13908 B12R1.233 CC(C)Oc1ccc(cc1N)O 271570a_203496583355_100000690130 [0,2,0,0,0,0|0,0,0]=2 13909 B12R1.233 CC(C)Oc1ccc(cc1O)F 271570a_203496583355_100000171696 [0,2,0,0,0,0|1,0,0]=3 13910 B12R1.233 CC(C)Oc1ccc(cc1O)N 271570a_203496583355_200000706018 [0,2,0,0,0,0|1,0,0]=3 13911 B12R1.233 CC(C)Oc1ccc(nc1Br)Br 34a_100009999766_100000210206 [0,2,0,0,0,0|2,0,0]=4 13912 B12R1.233 CC(C)Oc1ccc(nc1Br)Br 7a_100009999766_100000210206 [0,2,0,0,0,0|2,0,0]=4 13913 B12R1.233 CC(C)Oc1ccc(nc1Br)Cl 34a_100010219353_100000210206 [0,2,0,0,0,0|2,0,0]=4 13914 B12R1.233 CC(C)Oc1ccc(nc1Br)Cl 7a_100010219353_100000210206 [0,2,0,0,0,0|2,0,0]=4 13915 B12R1.233 CC(C)Oc1ccc(nc1Br)F 34a_100009887730_100000210206 [0,2,0,0,0,0|2,0,0]=4 13916 B12R1.233 CC(C)Oc1ccc(nc1Br)F 7a_100009887730_100000210206 [0,2,0,0,0,0|2,0,0]=4 13917 B12R1.233 CC(C)Oc1ccc(nc1Br)I 34a_100000725334_100000210206 [0,2,0,0,0,0|2,0,0]=4 13918 B12R1.233 CC(C)Oc1ccc(nc1Br)I 7a_100000725334_100000210206 [0,2,0,0,0,0|2,0,0]=4 13919 B12R1.233 CC(C)Oc1ccc(nc1Cl)Br 34a_100010246206_100000210206 [0,2,0,0,0,0|2,0,0]=4 13920 B12R1.233 CC(C)Oc1ccc(nc1Cl)Br 7a_100010246206_100000210206 [0,2,0,0,0,0|2,0,0]=4 13921 B12R1.233 CC(C)Oc1ccc(nc1Cl)Cl 34a_100000101165_100000210206 [0,2,0,0,0,0|2,0,0]=4 13922 B12R1.233 CC(C)Oc1ccc(nc1Cl)Cl 7a_100000101165_100000210206 [0,2,0,0,0,0|2,0,0]=4 13923 B12R1.233 CC(C)Oc1ccc(nc1Cl)I 34a_100000721234_100000210206 [0,2,0,0,0,0|2,0,0]=4 13924 B12R1.233 CC(C)Oc1ccc(nc1Cl)I 7a_100000721234_100000210206 [0,2,0,0,0,0|2,0,0]=4 13925 B12R1.233 CC(C)Oc1ccc(nc1F)Br 34a_100009819667_100000210206 [0,2,0,0,0,0|2,0,0]=4 13926 B12R1.233 CC(C)Oc1ccc(nc1F)Br 7a_100009819667_100000210206 [0,2,0,0,0,0|2,0,0]=4 13927 B12R1.233 CC(C)Oc1ccc(nc1F)Cl 34a_100009880201_100000210206 [0,2,0,0,0,0|2,0,0]=4 13928 B12R1.233 CC(C)Oc1ccc(nc1F)Cl 7a_100009880201_100000210206 [0,2,0,0,0,0|2,0,0]=4 13929 B12R1.233 CC(C)Oc1ccc(nc1F)F 34a_100000101184_100000210206 [0,2,0,0,0,0|2,0,0]=4 13930 B12R1.233 CC(C)Oc1ccc(nc1F)F 7a_100000101184_100000210206 [0,2,0,0,0,0|2,0,0]=4 13931 B12R1.233 CC(C)Oc1ccc(nc1I)Br 34a_100010253912_100000210206 [0,2,0,0,0,0|2,0,0]=4 13932 B12R1.233 CC(C)Oc1ccc(nc1I)Br 7a_100010253912_100000210206 [0,2,0,0,0,0|2,0,0]=4 13933 B12R1.233 CC(C)Oc1ccc(nc1I)Cl 34a_100000696390_100000210206 [0,2,0,0,0,0|2,0,0]=4 13934 B12R1.233 CC(C)Oc1ccc(nc1I)Cl 7a_100000696390_100000210206 [0,2,0,0,0,0|2,0,0]=4 13935 B12R1.233 CC(C)Oc1ccc(nc1I)F 34a_100010382442_100000210206 [0,2,0,0,0,0|2,0,0]=4 13936 B12R1.233 CC(C)Oc1ccc(nc1I)F 7a_100010382442_100000210206 [0,2,0,0,0,0|2,0,0]=4 13937 B12R1.233 CC(C)Oc1ccc(nc1N)Br 34a_100000685527_100000210206 [0,2,0,0,0,0|2,0,0]=4 13938 B12R1.233 CC(C)Oc1ccc(nc1N)Br 7a_100000685527_100000210206 [0,2,0,0,0,0|2,0,0]=4 13939 B12R1.233 CC(C)Oc1ccc(nc1N)Cl 34a_100000717809_100000210206 [0,2,0,0,0,0|2,0,0]=4 13940 B12R1.233 CC(C)Oc1ccc(nc1N)Cl 7a_100000717809_100000210206 [0,2,0,0,0,0|2,0,0]=4 13941 B12R1.233 CC(C)Oc1cnc(cc1Cl)Cl 34a_100009868576_100000210206 [0,2,0,0,0,0|2,0,0]=4 13942 B12R1.233 CC(C)Oc1cnc(cc1Cl)Cl 7a_100009868576_100000210206 [0,2,0,0,0,0|2,0,0]=4 13943 B12R1.233 CC(C)Oc1cnc(cc1F)F 34a_100009885687_100000210206 [0,2,0,0,0,0|2,0,0]=4 13944 B12R1.233 CC(C)Oc1cnc(cc1F)F 7a_100009885687_100000210206 [0,2,0,0,0,0|2,0,0]=4 13945 B12R1.233 CC(C)Oc1cnc(cc1I)Cl 34a_100000698892_100000210206 [0,2,0,0,0,0|2,0,0]=4 13946 B12R1.233 CC(C)Oc1cnc(cc1I)Cl 7a_100000698892_100000210206 [0,2,0,0,0,0|2,0,0]=4 13947 B12R1.233 CC(C)Oc1cnc(cc1N)Br 34a_100009819941_100000210206 [0,2,0,0,0,0|2,0,0]=4 13948 B12R1.233 CC(C)Oc1cnc(cc1N)Br 7a_100009819941_100000210206 [0,2,0,0,0,0|2,0,0]=4 13949 B12R1.233 CC(C)Oc1ncc(cc1Br)Br 34a_100000701035_100000210206 [0,2,0,0,0,0|2,0,0]=4 13950 B12R1.233 CC(C)Oc1ncc(cc1Cl)Br 34a_100012339560_100000210206 [0,2,0,0,0,0|2,0,0]=4 13951 B12R1.233 CC(C)Oc1ncc(cc1Cl)F 34a_100009847679_100000210206 [0,2,0,0,0,0|2,0,0]=4 13952 B12R1.233 CC(C)Oc1ncc(cc1F)Cl 34a_100011998252_100000210206 [0,2,0,0,0,0|2,0,0]=4 13953 B12R1.233 CC(C)Oc1ncc(cc1F)F 34a_100012025737_100000210206 [0,2,0,0,0,0|2,0,0]=4 13954 B12R1.233 CC(C)Oc1ncc(cc1N)Br 34a_100000743729_100000210206 [0,2,0,0,0,0|2,0,0]=4 13955 B12R1.233 CC(C)Oc1ncc(cc1N)Cl 34a_100011998249_100000210206 [0,2,0,0,0,0|2,0,0]=4 13956 B12R1.233 CC(C)Oc1ncc(cc1O)Br 271570a_203496583355_200010177600 [0,2,0,0,0,0|2,0,0]=4 13957 B12R1.233 CC(C)Sc1ccc(cc1Br)Br 62a_100000210206_100011484698 [0,2,0,0,0,0|1,1,0]=4 13958 B12R1.233 CC(C)Sc1ccc(cc1Br)Br 62a_100011484698_100000210206 [0,2,0,0,0,0|1,1,0]=4 13959 B12R1.233 CC(C)Sc1ccc(cc1Br)Cl 62a_100000210206_100011219703 [0,2,0,0,0,0|1,1,0]=4 13960 B12R1.233 CC(C)Sc1ccc(cc1Br)Cl 62a_100011219703_100000210206 [0,2,0,0,0,0|1,1,0]=4 13961 B12R1.233 CC(C)Sc1ccc(cc1Br)F 62a_100000210206_100011217111 [0,2,0,0,0,0|1,1,0]=4 13962 B12R1.233 CC(C)Sc1ccc(cc1Br)F 62a_100011217111_100000210206 [0,2,0,0,0,0|1,1,0]=4 13963 B12R1.233 CC(C)Sc1ccc(cc1Br)N 62a_100000210206_100000750458 [0,2,0,0,0,0|1,1,0]=4 13964 B12R1.233 CC(C)Sc1ccc(cc1Br)N 62a_100000750458_100000210206 [0,2,0,0,0,0|1,1,0]=4 13965 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000210206_100000701344 [0,2,0,0,0,0|0,1,0]=3 13966 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000701344_100000210206 [0,2,0,0,0,0|0,1,0]=3 13967 B12R1.233 CC(C)Sc1ccc(cc1Cl)Br 62a_100000210206_100011216062 [0,2,0,0,0,0|1,1,0]=4 13968 B12R1.233 CC(C)Sc1ccc(cc1Cl)Br 62a_100011216062_100000210206 [0,2,0,0,0,0|1,1,0]=4 13969 B12R1.233 CC(C)Sc1ccc(cc1Cl)Cl 62a_100000210206_100000699841 [0,2,0,0,0,0|1,1,0]=4 13970 B12R1.233 CC(C)Sc1ccc(cc1Cl)Cl 62a_100000699841_100000210206 [0,2,0,0,0,0|1,1,0]=4 13971 B12R1.233 CC(C)Sc1ccc(cc1Cl)F 62a_100000210206_100000733362 [0,2,0,0,0,0|1,1,0]=4 13972 B12R1.233 CC(C)Sc1ccc(cc1Cl)F 62a_100000733362_100000210206 [0,2,0,0,0,0|1,1,0]=4 13973 B12R1.233 CC(C)Sc1ccc(cc1Cl)N 62a_100000210206_100000761885 [0,2,0,0,0,0|1,1,0]=4 13974 B12R1.233 CC(C)Sc1ccc(cc1Cl)N 62a_100000761885_100000210206 [0,2,0,0,0,0|1,1,0]=4 13975 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000047559_100000210206 [0,2,0,0,0,0|0,1,0]=3 13976 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000210206_100000047559 [0,2,0,0,0,0|0,1,0]=3 13977 B12R1.233 CC(C)Sc1ccc(cc1F)Br 62a_100000210206_100009814013 [0,2,0,0,0,0|1,1,0]=4 13978 B12R1.233 CC(C)Sc1ccc(cc1F)Br 62a_100009814013_100000210206 [0,2,0,0,0,0|1,1,0]=4 13979 B12R1.233 CC(C)Sc1ccc(cc1F)Cl 62a_100000210206_100011216042 [0,2,0,0,0,0|1,1,0]=4 13980 B12R1.233 CC(C)Sc1ccc(cc1F)Cl 62a_100011216042_100000210206 [0,2,0,0,0,0|1,1,0]=4 13981 B12R1.233 CC(C)Sc1ccc(cc1F)F 62a_100000210206_100000750030 [0,2,0,0,0,0|1,1,0]=4 13982 B12R1.233 CC(C)Sc1ccc(cc1F)F 62a_100000750030_100000210206 [0,2,0,0,0,0|1,1,0]=4 13983 B12R1.233 CC(C)Sc1ccc(cc1F)N 62a_100000210206_100011356925 [0,2,0,0,0,0|1,1,0]=4 13984 B12R1.233 CC(C)Sc1ccc(cc1F)N 62a_100011356925_100000210206 [0,2,0,0,0,0|1,1,0]=4 13985 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000210206_100000755031 [0,2,0,0,0,0|0,1,0]=3 13986 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000755031_100000210206 [0,2,0,0,0,0|0,1,0]=3 13987 B12R1.233 CC(C)Sc1ccc(cc1N)Br 62a_100000210206_100000743836 [0,2,0,0,0,0|1,1,0]=4 13988 B12R1.233 CC(C)Sc1ccc(cc1N)Br 62a_100000743836_100000210206 [0,2,0,0,0,0|1,1,0]=4 13989 B12R1.233 CC(C)Sc1ccc(cc1N)Cl 62a_100000210206_100000761886 [0,2,0,0,0,0|1,1,0]=4 13990 B12R1.233 CC(C)Sc1ccc(cc1N)Cl 62a_100000761886_100000210206 [0,2,0,0,0,0|1,1,0]=4 13991 B12R1.233 CC(C)Sc1ccc(cc1N)F 62a_100000210206_100000687223 [0,2,0,0,0,0|1,1,0]=4 13992 B12R1.233 CC(C)Sc1ccc(cc1N)F 62a_100000687223_100000210206 [0,2,0,0,0,0|1,1,0]=4 13993 B12R1.233 CC(C)Sc1ccc(cc1N)N 62a_100000210206_200012175722 [0,2,0,0,0,0|1,1,0]=4 13994 B12R1.233 CC(C)Sc1ccc(cc1N)N 62a_200012175722_100000210206 [0,2,0,0,0,0|1,1,0]=4 13995 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100000210206_100011999798 [0,2,0,0,0,0|0,1,0]=3 13996 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100011999798_100000210206 [0,2,0,0,0,0|0,1,0]=3 13997 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100000210206_100012344904 [0,2,0,0,0,0|1,1,0]=4 13998 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100012344904_100000210206 [0,2,0,0,0,0|1,1,0]=4 13999 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000050036_100000210206 [0,2,0,0,0,0|1,1,0]=4 14000 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000210206_100000050036 [0,2,0,0,0,0|1,1,0]=4 14001 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000210206_100000690578 [0,2,0,0,0,0|1,1,0]=4 14002 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000690578_100000210206 [0,2,0,0,0,0|1,1,0]=4 14003 B12R1.233 CC(C)Sc1ccc(cc1O)O 62a_100000210206_100009813921 [0,2,0,0,0,0|0,1,0]=3 14004 B12R1.233 CC(C)Sc1ccc(nc1F)O 62a_100000210206_100009879308 [0,2,0,0,0,0|1,1,0]=4 14005 B12R1.233 CC(C)Sc1ccc(nc1F)O 62a_100009879308_100000210206 [0,2,0,0,0,0|1,1,0]=4 14006 B12R1.233 CC(C)Sc1ncc(cc1F)O 62a_100000210206_100000063512 [0,2,0,0,0,0|1,1,0]=4 14007 B12R1.233 CN(C)Cc1ccc(cc1F)O 271570a_203496583355_100000174744 [0,2,0,0,0,0|2,0,0]=4 14008 B12R1.233 Cc1cc(=O)c(co1)OC(C)C 34a_100000081520_100000210206 [0,2,0,0,0,0|2,0,0]=4 14009 B12R1.233 Cc1cc(c(cn1)OC(C)C)Br 34a_100009843476_100000210206 [0,2,0,0,0,0|2,0,0]=4 14010 B12R1.233 Cc1cc(c(cn1)OC(C)C)Br 7a_100009843476_100000210206 [0,2,0,0,0,0|2,0,0]=4 14011 B12R1.233 Cc1cc(c(cn1)OC(C)C)C 34a_200000068632_100000210206 [0,2,0,0,0,0|2,0,0]=4 14012 B12R1.233 Cc1cc(c(cn1)OC(C)C)C 7a_200000068632_100000210206 [0,2,0,0,0,0|2,0,0]=4 14013 B12R1.233 Cc1cc(ccc1NC(C)C)Br 34a_100000211769_100000210206 [0,2,0,0,0,0|2,0,0]=4 14014 B12R1.233 Cc1cc(ccc1NC(C)C)Br 7a_100000211769_100000210206 [0,2,0,0,0,0|2,0,0]=4 14015 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 34a_100000210418_100000210206 [0,2,0,0,0,0|2,0,0]=4 14016 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 7a_100000210418_100000210206 [0,2,0,0,0,0|2,0,0]=4 14017 B12R1.233 Cc1cc(ccc1NC(C)C)F 34a_100000211637_100000210206 [0,2,0,0,0,0|2,0,0]=4 14018 B12R1.233 Cc1cc(ccc1NC(C)C)F 7a_100000211637_100000210206 [0,2,0,0,0,0|2,0,0]=4 14019 B12R1.233 Cc1cc(ccc1NC(C)C)I 34a_100000184554_100000210206 [0,2,0,0,0,0|2,0,0]=4 14020 B12R1.233 Cc1cc(ccc1NC(C)C)I 7a_100000184554_100000210206 [0,2,0,0,0,0|2,0,0]=4 14021 B12R1.233 Cc1cc(ccc1NC(C)C)O 34a_100000756630_100000210206 [0,2,0,0,0,0|1,0,0]=3 14022 B12R1.233 Cc1cc(ccc1OC(C)C)Br 34a_100000186361_100000210206 [0,2,0,0,0,0|1,0,0]=3 14023 B12R1.233 Cc1cc(ccc1OC(C)C)Br 7a_100000186361_100000210206 [0,2,0,0,0,0|1,0,0]=3 14024 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 34a_100000211091_100000210206 [0,2,0,0,0,0|1,0,0]=3 14025 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 7a_100000211091_100000210206 [0,2,0,0,0,0|1,0,0]=3 14026 B12R1.233 Cc1cc(ccc1OC(C)C)F 34a_100000764316_100000210206 [0,2,0,0,0,0|1,0,0]=3 14027 B12R1.233 Cc1cc(ccc1OC(C)C)F 7a_100000764316_100000210206 [0,2,0,0,0,0|1,0,0]=3 14028 B12R1.233 Cc1cc(ccc1OC(C)C)I 34a_100011218673_100000210206 [0,2,0,0,0,0|1,0,0]=3 14029 B12R1.233 Cc1cc(ccc1OC(C)C)I 7a_100011218673_100000210206 [0,2,0,0,0,0|1,0,0]=3 14030 B12R1.233 Cc1cc(ccc1OC(C)C)N 34a_100011218179_100000210206 [0,2,0,0,0,0|1,0,0]=3 14031 B12R1.233 Cc1cc(ccc1OC(C)C)N 7a_100011218179_100000210206 [0,2,0,0,0,0|1,0,0]=3 14032 B12R1.233 Cc1cc(ccc1OC(C)C)O 271570a_203496583355_200011825982 [0,2,0,0,0,0|0,0,0]=2 14033 B12R1.233 Cc1cc(ccc1OC(F)F)O 271570a_203496583355_100011825985 [0,2,0,0,0,0|1,0,0]=3 14034 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000210206_100000701812 [0,2,0,0,0,0|1,1,0]=4 14035 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000701812_100000210206 [0,2,0,0,0,0|1,1,0]=4 14036 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100000210206_100011219607 [0,2,0,0,0,0|1,1,0]=4 14037 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100011219607_100000210206 [0,2,0,0,0,0|1,1,0]=4 14038 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100000210206_100011205405 [0,2,0,0,0,0|1,1,0]=4 14039 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100011205405_100000210206 [0,2,0,0,0,0|1,1,0]=4 14040 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210206_100000210723 [0,2,0,0,0,0|1,1,0]=4 14041 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210723_100000210206 [0,2,0,0,0,0|1,1,0]=4 14042 B12R1.233 Cc1cc(ccc1SC(C)C)O 62a_100000210206_100000690111 [0,2,0,0,0,0|0,1,0]=3 14043 B12R1.233 Cc1cc(cnc1OC(C)C)Br 34a_100000685391_100000210206 [0,2,0,0,0,0|2,0,0]=4 14044 B12R1.233 Cc1cc(cnc1SC(C)C)O 62a_100000210206_100012000486 [0,2,0,0,0,0|1,1,0]=4 14045 B12R1.233 Cc1cc(cnc1SC(C)C)O 62a_100012000486_100000210206 [0,2,0,0,0,0|1,1,0]=4 14046 B12R1.233 Cc1cc(ncc1OC(C)C)Cl 34a_100000692680_100000210206 [0,2,0,0,0,0|2,0,0]=4 14047 B12R1.233 Cc1cc(ncc1OC(C)C)Cl 7a_100000692680_100000210206 [0,2,0,0,0,0|2,0,0]=4 14048 B12R1.233 Cc1cc(ncc1OC(C)C)F 34a_100009856773_100000210206 [0,2,0,0,0,0|2,0,0]=4 14049 B12R1.233 Cc1cc(ncc1OC(C)C)F 7a_100009856773_100000210206 [0,2,0,0,0,0|2,0,0]=4 14050 B12R1.233 Cc1cc(ncc1SC(C)C)O 62a_100000210206_100000766222 [0,2,0,0,0,0|1,1,0]=4 14051 B12R1.233 Cc1cc(ncc1SC(C)C)O 62a_100000766222_100000210206 [0,2,0,0,0,0|1,1,0]=4 14052 B12R1.233 Cc1ccc(c(c1)Br)NC(C)C 34a_100000210942_100000210206 [0,2,0,0,0,0|2,0,0]=4 14053 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 34a_100000210800_100000210206 [0,2,0,0,0,0|1,0,0]=3 14054 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 7a_100000210800_100000210206 [0,2,0,0,0,0|1,0,0]=3 14055 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100000210206_100009813563 [0,2,0,0,0,0|1,1,0]=4 14056 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100009813563_100000210206 [0,2,0,0,0,0|1,1,0]=4 14057 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 34a_100000736561_100000210206 [0,2,0,0,0,0|2,0,0]=4 14058 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 7a_100000736561_100000210206 [0,2,0,0,0,0|2,0,0]=4 14059 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 34a_100000211776_100000210206 [0,2,0,0,0,0|1,0,0]=3 14060 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 7a_100000211776_100000210206 [0,2,0,0,0,0|1,0,0]=3 14061 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100000210206_100011217332 [0,2,0,0,0,0|1,1,0]=4 14062 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100011217332_100000210206 [0,2,0,0,0,0|1,1,0]=4 14063 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C 34a_100000210522_100000210206 [0,2,0,0,0,0|2,0,0]=4 14064 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 34a_100000749699_100000210206 [0,2,0,0,0,0|1,0,0]=3 14065 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 7a_100000749699_100000210206 [0,2,0,0,0,0|1,0,0]=3 14066 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100000210206_100011263221 [0,2,0,0,0,0|1,1,0]=4 14067 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100011263221_100000210206 [0,2,0,0,0,0|1,1,0]=4 14068 B12R1.233 Cc1ccc(c(c1)F)NC(C)C 34a_100000211023_100000210206 [0,2,0,0,0,0|2,0,0]=4 14069 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 34a_100011216688_100000210206 [0,2,0,0,0,0|1,0,0]=3 14070 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 7a_100011216688_100000210206 [0,2,0,0,0,0|1,0,0]=3 14071 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100000210206_100011216119 [0,2,0,0,0,0|1,1,0]=4 14072 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100011216119_100000210206 [0,2,0,0,0,0|1,1,0]=4 14073 B12R1.233 Cc1ccc(c(c1)I)NC(C)C 34a_100011356834_100000210206 [0,2,0,0,0,0|2,0,0]=4 14074 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 34a_100000765521_100000210206 [0,2,0,0,0,0|1,0,0]=3 14075 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 7a_100000765521_100000210206 [0,2,0,0,0,0|1,0,0]=3 14076 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 34a_100011215204_100000210206 [0,2,0,0,0,0|1,0,0]=3 14077 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 7a_100011215204_100000210206 [0,2,0,0,0,0|1,0,0]=3 14078 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100000210206_100011216686 [0,2,0,0,0,0|1,1,0]=4 14079 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100011216686_100000210206 [0,2,0,0,0,0|1,1,0]=4 14080 B12R1.233 Cc1ccc(c(c1)O)NC(C)C 34a_100000211527_100000210206 [0,2,0,0,0,0|2,0,0]=4 14081 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100000210206_100012002257 [0,2,0,0,0,0|1,1,0]=4 14082 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100012002257_100000210206 [0,2,0,0,0,0|1,1,0]=4 14083 B12R1.233 Cc1ccc(c(n1)Br)OC(C)C 34a_100000702858_100000210206 [0,2,0,0,0,0|2,0,0]=4 14084 B12R1.233 Cc1ccc(c(n1)Br)OC(C)C 7a_100000702858_100000210206 [0,2,0,0,0,0|2,0,0]=4 14085 B12R1.233 Cc1ccc(c(n1)C)OC(C)C 34a_100011218912_100000210206 [0,2,0,0,0,0|2,0,0]=4 14086 B12R1.233 Cc1ccc(c(n1)C)OC(C)C 7a_100011218912_100000210206 [0,2,0,0,0,0|2,0,0]=4 14087 B12R1.233 Cc1ccc(c(n1)Cl)OC(C)C 34a_100000086286_100000210206 [0,2,0,0,0,0|2,0,0]=4 14088 B12R1.233 Cc1ccc(c(n1)Cl)OC(C)C 7a_100000086286_100000210206 [0,2,0,0,0,0|2,0,0]=4 14089 B12R1.233 Cc1ccc(c(n1)F)OC(C)C 34a_100000079963_100000210206 [0,2,0,0,0,0|2,0,0]=4 14090 B12R1.233 Cc1ccc(c(n1)F)OC(C)C 7a_100000079963_100000210206 [0,2,0,0,0,0|2,0,0]=4 14091 B12R1.233 Cc1ccc(c(n1)I)OC(C)C 34a_100000023897_100000210206 [0,2,0,0,0,0|2,0,0]=4 14092 B12R1.233 Cc1ccc(c(n1)I)OC(C)C 7a_100000023897_100000210206 [0,2,0,0,0,0|2,0,0]=4 14093 B12R1.233 Cc1ccc(c(n1)N)OC(C)C 34a_100000694039_100000210206 [0,2,0,0,0,0|2,0,0]=4 14094 B12R1.233 Cc1ccc(c(n1)N)OC(C)C 7a_100000694039_100000210206 [0,2,0,0,0,0|2,0,0]=4 14095 B12R1.233 Cc1cnc(c(c1)Br)OC(C)C 34a_100000719714_100000210206 [0,2,0,0,0,0|2,0,0]=4 14096 B12R1.233 Cc1cnc(c(c1)N)OC(C)C 34a_100012000488_100000210206 [0,2,0,0,0,0|2,0,0]=4 14097 B12R1.233 Cc1cnc(c(c1)O)OC(C)C 271570a_203496583355_200012348018 [0,2,0,0,0,0|2,0,0]=4 14098 B12R1.233 Cc1nc(ccc1OC(C)C)Br 34a_100012002022_100000210206 [0,2,0,0,0,0|2,0,0]=4 14099 B12R1.233 Cc1nc(ccc1OC(C)C)Br 7a_100012002022_100000210206 [0,2,0,0,0,0|2,0,0]=4 14100 B12R1.233 Cc1nc(ccc1OC(C)C)Cl 34a_100012184626_100000210206 [0,2,0,0,0,0|2,0,0]=4 14101 B12R1.233 Cc1nc(ccc1OC(C)C)Cl 7a_100012184626_100000210206 [0,2,0,0,0,0|2,0,0]=4 14102 B12R1.233 Cc1nc(ccc1OC(C)C)F 34a_100009881036_100000210206 [0,2,0,0,0,0|2,0,0]=4 14103 B12R1.233 Cc1nc(ccc1OC(C)C)F 7a_100009881036_100000210206 [0,2,0,0,0,0|2,0,0]=4 14104 B12R1.233 Cc1nc(ccc1OC(C)C)I 34a_100010233687_100000210206 [0,2,0,0,0,0|2,0,0]=4 14105 B12R1.233 Cc1nc(ccc1OC(C)C)I 7a_100010233687_100000210206 [0,2,0,0,0,0|2,0,0]=4 14106 B12R1.233 Cc1nc(ccc1SC(C)C)O 62a_100000210206_100000691680 [0,2,0,0,0,0|1,1,0]=4 14107 B12R1.233 Cc1nc(ccc1SC(C)C)O 62a_100000691680_100000210206 [0,2,0,0,0,0|1,1,0]=4 14108 B12R1.233 Nc1cc(ccc1OC(F)F)O 271570a_203496583355_100000759289 [0,2,0,0,0,0|1,0,0]=3 14109 B12R1.233 Oc1cc(ccc1OC(F)F)F 271570a_203496583355_100000179093 [0,2,0,0,0,0|2,0,0]=4 14110 B12R1.233 Oc1ccc(c(c1)F)OC(F)F 271570a_203496583355_100000728548 [0,2,0,0,0,0|1,0,0]=3 14111 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,2,0,0,0,0|1,0,1]=4 14112 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,2,0,0,0,0|1,0,1]=4 14113 B12R1.5 C#Cc1ccc(cc1)C(=O)CC 1458a_100011217615_100000210202 [0,2,0,0,0,0|2,0,0]=4 14114 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 1458a_100000687532_100000210202 [0,2,0,0,0,0|2,0,0]=4 14115 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 271570a_100011290941_100000211647 [0,2,0,0,0,0|2,0,0]=4 14116 B12R1.5 C=Cc1ccc(cc1)C(C)CC 271570a_100011290941_100011221364 [0,2,0,0,0,0|2,0,0]=4 14117 B12R1.5 C=Cc1ccc(cc1)C(O)CC 271570a_100011290941_100000246506 [0,2,0,0,0,0|2,0,0]=4 14118 B12R1.5 C=Cc1ccc(cc1)[C@@H](N)CC 271570a_100011290941_100025736560 [0,2,0,0,0,0|2,0,0]=4 14119 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [0,2,0,0,0,0|2,0,0]=4 14120 B12R1.5 CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210202 [0,2,0,0,0,0|2,0,0]=4 14121 B12R1.5 CCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210202 [0,2,0,0,0,0|2,0,0]=4 14122 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [0,2,0,0,0,0|1,0,0]=3 14123 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [0,2,0,0,0,0|1,0,0]=3 14124 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [0,2,0,0,0,0|1,0,0]=3 14125 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [0,2,0,0,0,0|1,0,0]=3 14126 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [0,2,0,0,0,0|1,0,0]=3 14127 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [0,2,0,0,0,0|1,0,0]=3 14128 B12R1.5 CCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210202 [0,2,0,0,0,0|1,1,0]=4 14129 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_100000211647_200000210301 [0,2,0,0,0,0|1,1,0]=4 14130 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_200000210301_100000211647 [0,2,0,0,0,0|1,1,0]=4 14131 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_100000211647_200025704644 [0,2,0,0,0,0|1,1,0]=4 14132 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000211647 [0,2,0,0,0,0|1,1,0]=4 14133 B12R1.5 CCC(C)c1ccc(cc1)NC 2230a_100000211316_200000210301 [0,2,0,0,0,0|2,0,0]=4 14134 B12R1.5 CCC(C)c1ccc(cc1)NC 34a_100000211316_200000210301 [0,2,0,0,0,0|2,0,0]=4 14135 B12R1.5 CCC(C)c1ccc(cc1)NC 7a_100000211316_200000210301 [0,2,0,0,0,0|2,0,0]=4 14136 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 2230a_100000211316_200025704644 [0,2,0,0,0,0|2,0,0]=4 14137 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 34a_100000211316_200025704644 [0,2,0,0,0,0|2,0,0]=4 14138 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 7a_100000211316_200025704644 [0,2,0,0,0,0|2,0,0]=4 14139 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [0,2,0,0,0,0|1,0,0]=3 14140 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [0,2,0,0,0,0|1,0,0]=3 14141 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [0,2,0,0,0,0|1,0,0]=3 14142 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [0,2,0,0,0,0|1,0,0]=3 14143 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_100011221364_200000210301 [0,2,0,0,0,0|1,1,0]=4 14144 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_200000210301_100011221364 [0,2,0,0,0,0|1,1,0]=4 14145 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_100011221364_200025704644 [0,2,0,0,0,0|1,1,0]=4 14146 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011221364 [0,2,0,0,0,0|1,1,0]=4 14147 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [0,2,0,0,0,0|1,0,0]=3 14148 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [0,2,0,0,0,0|1,0,0]=3 14149 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_100000246506_200000210301 [0,2,0,0,0,0|1,1,0]=4 14150 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_200000210301_100000246506 [0,2,0,0,0,0|1,1,0]=4 14151 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_100000246506_200025704644 [0,2,0,0,0,0|1,1,0]=4 14152 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000246506 [0,2,0,0,0,0|1,1,0]=4 14153 B12R1.5 CCN(C)c1ccc(cc1)C#N 269982a_100000218877_200000210301 [0,2,0,0,0,0|2,0,0]=4 14154 B12R1.5 CCN(C)c1ccc(cc1)C#N 269982a_100000739737_100000204670 [0,2,0,0,0,0|2,0,0]=4 14155 B12R1.5 CCN(C)c1ccc(cc1)C#N 34a_100000218877_200000210301 [0,2,0,0,0,0|2,0,0]=4 14156 B12R1.5 CCN(C)c1ccc(cc1)C#N 34a_100000739737_100000210202 [0,2,0,0,0,0|2,0,0]=4 14157 B12R1.5 CCN(C)c1ccc(cc1)C#N 7a_100000218877_200000210301 [0,2,0,0,0,0|2,0,0]=4 14158 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [0,2,0,0,0,0|1,0,0]=3 14159 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [0,2,0,0,0,0|1,0,0]=3 14160 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [0,2,0,0,0,0|1,0,0]=3 14161 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 269982a_100000218877_200025704644 [0,2,0,0,0,0|2,0,0]=4 14162 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 34a_100000218877_200025704644 [0,2,0,0,0,0|2,0,0]=4 14163 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 7a_100000218877_200025704644 [0,2,0,0,0,0|2,0,0]=4 14164 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_100025736560_200000210301 [0,2,0,0,0,0|1,1,0]=4 14165 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_200000210301_100025736560 [0,2,0,0,0,0|1,1,0]=4 14166 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_100025736560_200025704644 [0,2,0,0,0,0|1,1,0]=4 14167 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100025736560 [0,2,0,0,0,0|1,1,0]=4 14168 B12R1.5 CNC(=O)c1ccc(cc1)CO 1626a_100102657272_100000183892 [0,2,0,0,0,0|2,0,0]=4 14169 B12R1.5 CNC(=O)c1ccc(cc1)CO 240690a_100102657272_100000183892 [0,2,0,0,0,0|2,0,0]=4 14170 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [0,2,0,0,0,0|2,0,0]=4 14171 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [0,2,0,0,0,0|2,0,0]=4 14172 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [0,2,0,0,0,0|2,0,0]=4 14173 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [0,2,0,0,0,0|2,0,0]=4 14174 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [0,2,0,0,0,0|2,0,0]=4 14175 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [0,2,0,0,0,0|2,0,0]=4 14176 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [0,2,0,0,0,0|2,0,0]=4 14177 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [0,2,0,0,0,0|2,0,0]=4 14178 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [0,2,0,0,0,0|2,0,0]=4 14179 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [0,2,0,0,0,0|2,0,0]=4 14180 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [0,2,0,0,0,0|2,0,0]=4 14181 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [0,2,0,0,0,0|2,0,0]=4 14182 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [0,2,0,0,0,0|2,0,0]=4 14183 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [0,2,0,0,0,0|2,0,0]=4 14184 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [0,2,0,0,0,0|2,0,0]=4 14185 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [0,2,0,0,0,0|2,0,0]=4 14186 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [0,2,0,0,0,0|2,0,0]=4 14187 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [0,2,0,0,0,0|2,0,0]=4 14188 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [0,2,0,0,0,0|2,0,0]=4 14189 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [0,2,0,0,0,0|2,0,0]=4 14190 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [0,2,0,0,0,0|2,0,0]=4 14191 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [0,2,0,0,0,0|2,0,0]=4 14192 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [0,2,0,0,0,0|2,0,0]=4 14193 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [0,2,0,0,0,0|2,0,0]=4 14194 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [0,2,0,0,0,0|2,0,0]=4 14195 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [0,2,0,0,0,0|2,0,0]=4 14196 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [0,2,0,0,0,0|2,0,0]=4 14197 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [0,2,0,0,0,0|2,0,0]=4 14198 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [0,2,0,0,0,0|2,0,0]=4 14199 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [0,2,0,0,0,0|2,0,0]=4 14200 B12R1.5 COc1ccc(cc1)N(C)CF 269982a_100000220023_100015361967 [0,2,0,0,0,0|2,0,0]=4 14201 B12R1.5 COc1ccc(cc1)N(C)CF 34a_100000220023_100015361967 [0,2,0,0,0,0|2,0,0]=4 14202 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [0,2,0,0,0,0|2,0,0]=4 14203 B12R1.5 O=C(CF)c1ccc(cc1)CO 1458a_100000183892_100015361967 [0,2,0,0,0,0|2,0,0]=4 14204 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [0,2,0,0,0,0|2,0,0]=4 14205 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [0,2,0,0,0,0|2,0,0]=4 14206 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [0,2,0,0,0,0|2,0,0]=4 14207 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [0,2,0,0,0,0|2,0,0]=4 14208 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [0,2,0,0,0,0|2,0,0]=4 14209 B12R1.9 CCC(F)(F)c1ccc(cc1)O 271570a_203496583355_100010208532 [0,2,0,0,0,0|1,0,0]=3 14210 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,2,0,0,0,0|0,1,0]=3 14211 B12R1.9 CCS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_100009814650 [0,2,0,0,0,0|1,1,0]=4 14212 B12R1.9 CCS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100010142209 [0,2,0,0,0,0|1,1,0]=4 14213 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 270084a_100102657272_100020667864 [0,2,0,0,0,0|1,1,0]=4 14214 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000754977 [0,2,0,0,0,0|1,1,0]=4 14215 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 274078a_100102657272_100020667864 [0,2,0,0,0,0|1,1,0]=4 14216 B12R1.9 COS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000004522 [0,2,0,0,0,0|1,1,0]=4 14217 B12R1.12 CCC(NC)c1ccc(cc1)Br 269862a_106832991636_100000211647 [0,2,0,0,0,0|2,0,0]=4 14218 B12R1.12 CCC(NC)c1ccc(cc1)C 2230a_100000749201_200000210301 [0,2,0,0,0,0|2,0,0]=4 14219 B12R1.12 CCC(NC)c1ccc(cc1)C 269862a_106832991636_100000185863 [0,2,0,0,0,0|2,0,0]=4 14220 B12R1.12 CCC(NC)c1ccc(cc1)C 34a_100000749201_200000210301 [0,2,0,0,0,0|2,0,0]=4 14221 B12R1.12 CCC(NC)c1ccc(cc1)Cl 269862a_106832991636_100000210983 [0,2,0,0,0,0|2,0,0]=4 14222 B12R1.12 CCC(NC)c1ccc(cc1)F 2230a_100011191751_200000210301 [0,2,0,0,0,0|2,0,0]=4 14223 B12R1.12 CCC(NC)c1ccc(cc1)F 269862a_106832991636_100000211089 [0,2,0,0,0,0|2,0,0]=4 14224 B12R1.12 CCC(NC)c1ccc(cc1)F 34a_100011191751_200000210301 [0,2,0,0,0,0|2,0,0]=4 14225 B12R1.12 CCC(NC)c1ccc(cc1)I 269862a_106832991636_100000763097 [0,2,0,0,0,0|2,0,0]=4 14226 B12R1.12 CCC(NC)c1ccc(cc1)O 271570a_203496583355_100000231127 [0,2,0,0,0,0|1,0,0]=3 14227 B12R1.12 CCC(NC)c1ccc(cc1)O 34a_100015187210_200000210301 [0,2,0,0,0,0|1,0,0]=3 14228 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 2230a_100000749201_200025704644 [0,2,0,0,0,0|2,0,0]=4 14229 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 34a_100000749201_200025704644 [0,2,0,0,0,0|2,0,0]=4 14230 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 2230a_100011191751_200025704644 [0,2,0,0,0,0|2,0,0]=4 14231 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 34a_100011191751_200025704644 [0,2,0,0,0,0|2,0,0]=4 14232 B12R1.12 CCC(N[13CH3])c1ccc(cc1)O 34a_100015187210_200025704644 [0,2,0,0,0,0|1,0,0]=3 14233 B12R1.12 CCC(OC)c1ccc(cc1)Br 34a_100000246506_200000210301 [0,2,0,0,0,0|2,0,0]=4 14234 B12R1.12 CCC(OC)c1ccc(cc1)Br 7a_100000246506_200000210301 [0,2,0,0,0,0|2,0,0]=4 14235 B12R1.12 CCC(OC)c1ccc(cc1)C 34a_100000246521_200000210301 [0,2,0,0,0,0|2,0,0]=4 14236 B12R1.12 CCC(OC)c1ccc(cc1)C 7a_100000246521_200000210301 [0,2,0,0,0,0|2,0,0]=4 14237 B12R1.12 CCC(OC)c1ccc(cc1)Cl 34a_100000246471_200000210301 [0,2,0,0,0,0|2,0,0]=4 14238 B12R1.12 CCC(OC)c1ccc(cc1)Cl 7a_100000246471_200000210301 [0,2,0,0,0,0|2,0,0]=4 14239 B12R1.12 CCC(OC)c1ccc(cc1)F 34a_100000246474_200000210301 [0,2,0,0,0,0|2,0,0]=4 14240 B12R1.12 CCC(OC)c1ccc(cc1)F 7a_100000246474_200000210301 [0,2,0,0,0,0|2,0,0]=4 14241 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 34a_100000246506_200025704644 [0,2,0,0,0,0|2,0,0]=4 14242 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 7a_100000246506_200025704644 [0,2,0,0,0,0|2,0,0]=4 14243 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 34a_100000246521_200025704644 [0,2,0,0,0,0|2,0,0]=4 14244 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 7a_100000246521_200025704644 [0,2,0,0,0,0|2,0,0]=4 14245 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 34a_100000246471_200025704644 [0,2,0,0,0,0|2,0,0]=4 14246 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 7a_100000246471_200025704644 [0,2,0,0,0,0|2,0,0]=4 14247 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 34a_100000246474_200025704644 [0,2,0,0,0,0|2,0,0]=4 14248 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 7a_100000246474_200025704644 [0,2,0,0,0,0|2,0,0]=4 14249 B12R1.12 CCN(CC)c1ccc(cc1)Br 2230a_100000219632_100000210202 [0,2,0,0,0,0|2,0,0]=4 14250 B12R1.12 CCN(CC)c1ccc(cc1)Br 269982a_100000219632_100000204670 [0,2,0,0,0,0|2,0,0]=4 14251 B12R1.12 CCN(CC)c1ccc(cc1)Br 34a_100000219632_100000210202 [0,2,0,0,0,0|2,0,0]=4 14252 B12R1.12 CCN(CC)c1ccc(cc1)C 2230a_100000219985_100000210202 [0,2,0,0,0,0|2,0,0]=4 14253 B12R1.12 CCN(CC)c1ccc(cc1)C 269982a_100000219985_100000204670 [0,2,0,0,0,0|2,0,0]=4 14254 B12R1.12 CCN(CC)c1ccc(cc1)C 34a_100000219985_100000210202 [0,2,0,0,0,0|2,0,0]=4 14255 B12R1.12 CCN(CC)c1ccc(cc1)Cl 2230a_100000220165_100000210202 [0,2,0,0,0,0|2,0,0]=4 14256 B12R1.12 CCN(CC)c1ccc(cc1)Cl 269982a_100000220165_100000204670 [0,2,0,0,0,0|2,0,0]=4 14257 B12R1.12 CCN(CC)c1ccc(cc1)Cl 34a_100000220165_100000210202 [0,2,0,0,0,0|2,0,0]=4 14258 B12R1.12 CCN(CC)c1ccc(cc1)F 2230a_100102640331_100000210202 [0,2,0,0,0,0|2,0,0]=4 14259 B12R1.12 CCN(CC)c1ccc(cc1)F 269982a_100102640331_100000204670 [0,2,0,0,0,0|2,0,0]=4 14260 B12R1.12 CCN(CC)c1ccc(cc1)F 34a_100102640331_100000210202 [0,2,0,0,0,0|2,0,0]=4 14261 B12R1.12 CCN(CC)c1ccc(cc1)O 2230a_100011337800_100000210202 [0,2,0,0,0,0|1,0,0]=3 14262 B12R1.12 CCN(CC)c1ccc(cc1)O 269982a_100011337800_100000204670 [0,2,0,0,0,0|1,0,0]=3 14263 B12R1.12 CCN(CC)c1ccc(cc1)O 271570a_203496583355_100011216415 [0,2,0,0,0,0|1,0,0]=3 14264 B12R1.12 CCN(CC)c1ccc(cc1)O 34a_100011337800_100000210202 [0,2,0,0,0,0|1,0,0]=3 14265 B12R1.12 CCN(CC)c1ccc(cn1)O 271570a_203496583355_100011465332 [0,2,0,0,0,0|2,0,0]=4 14266 B12R1.12 CCN(CF)c1ccc(cc1)Br 269982a_100000219632_100015361967 [0,2,0,0,0,0|2,0,0]=4 14267 B12R1.12 CCN(CF)c1ccc(cc1)Br 34a_100000219632_100015361967 [0,2,0,0,0,0|2,0,0]=4 14268 B12R1.12 CCN(CF)c1ccc(cc1)C 269982a_100000219985_100015361967 [0,2,0,0,0,0|2,0,0]=4 14269 B12R1.12 CCN(CF)c1ccc(cc1)C 34a_100000219985_100015361967 [0,2,0,0,0,0|2,0,0]=4 14270 B12R1.12 CCN(CF)c1ccc(cc1)Cl 269982a_100000220165_100015361967 [0,2,0,0,0,0|2,0,0]=4 14271 B12R1.12 CCN(CF)c1ccc(cc1)Cl 34a_100000220165_100015361967 [0,2,0,0,0,0|2,0,0]=4 14272 B12R1.12 CCN(CF)c1ccc(cc1)F 269982a_100102640331_100015361967 [0,2,0,0,0,0|2,0,0]=4 14273 B12R1.12 CCN(CF)c1ccc(cc1)F 34a_100102640331_100015361967 [0,2,0,0,0,0|2,0,0]=4 14274 B12R1.12 CCN(CF)c1ccc(cc1)O 269982a_100011337800_100015361967 [0,2,0,0,0,0|1,0,0]=3 14275 B12R1.12 CCN(CF)c1ccc(cc1)O 34a_100011337800_100015361967 [0,2,0,0,0,0|1,0,0]=3 14276 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 2230a_100025736560_200000210301 [0,2,0,0,0,0|2,0,0]=4 14277 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 34a_100025736560_200000210301 [0,2,0,0,0,0|2,0,0]=4 14278 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 2230a_100015186824_200000210301 [0,2,0,0,0,0|2,0,0]=4 14279 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 34a_100015186824_200000210301 [0,2,0,0,0,0|2,0,0]=4 14280 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 2230a_100025736560_200025704644 [0,2,0,0,0,0|2,0,0]=4 14281 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 34a_100025736560_200025704644 [0,2,0,0,0,0|2,0,0]=4 14282 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015186824_200025704644 [0,2,0,0,0,0|2,0,0]=4 14283 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 34a_100015186824_200025704644 [0,2,0,0,0,0|2,0,0]=4 14284 B12R1.12 COC(OC)c1ccc(cc1)O 271570a_203496583355_100009813454 [0,2,0,0,0,0|2,0,0]=4 14285 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210202 [0,2,0,0,0,0|2,0,0]=4 14286 B12R1.367 CCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210202 [0,2,0,0,0,0|2,0,0]=4 14287 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210202 [0,2,0,0,0,0|2,0,0]=4 14288 B12R1.367 CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210202 [0,2,0,0,0,0|2,0,0]=4 14289 B12R1.367 CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210202 [0,2,0,0,0,0|2,0,0]=4 14290 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,2,0,0,0,0|1,0,0]=3 14291 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [0,2,0,0,0,0|2,0,0]=4 14292 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [0,2,0,0,0,0|2,0,0]=4 14293 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [0,2,0,0,0,0|2,0,0]=4 14294 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [0,2,0,0,0,0|2,0,0]=4 14295 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [0,2,0,0,0,0|2,0,0]=4 14296 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,2,0,0,0,0|1,0,0]=3 14297 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,2,0,0,0,0|1,0,0]=3 14298 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210202 [0,2,0,0,0,0|2,0,0]=4 14299 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210202 [0,2,0,0,0,0|2,0,0]=4 14300 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210202 [0,2,0,0,0,0|2,0,0]=4 14301 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210202 [0,2,0,0,0,0|2,0,0]=4 14302 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210202 [0,2,0,0,0,0|2,0,0]=4 14303 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,2,0,0,0,0|1,0,0]=3 14304 B12R1.367 CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210202 [0,2,0,0,0,0|2,0,0]=4 14305 B12R1.367 CCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210202 [0,2,0,0,0,0|2,0,0]=4 14306 B12R1.367 CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210202 [0,2,0,0,0,0|2,0,0]=4 14307 B12R1.367 CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210202 [0,2,0,0,0,0|2,0,0]=4 14308 B12R1.367 CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210202 [0,2,0,0,0,0|2,0,0]=4 14309 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,2,0,0,0,0|1,0,0]=3 14310 B12R1.367 CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210202 [0,2,0,0,0,0|2,0,0]=4 14311 B12R1.367 CCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210202 [0,2,0,0,0,0|2,0,0]=4 14312 B12R1.367 CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210202 [0,2,0,0,0,0|2,0,0]=4 14313 B12R1.367 CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210202 [0,2,0,0,0,0|2,0,0]=4 14314 B12R1.367 CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210202 [0,2,0,0,0,0|2,0,0]=4 14315 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,2,0,0,0,0|1,0,0]=3 14316 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [0,2,0,0,0,0|2,0,0]=4 14317 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [0,2,0,0,0,0|2,0,0]=4 14318 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [0,2,0,0,0,0|2,0,0]=4 14319 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [0,2,0,0,0,0|2,0,0]=4 14320 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [0,2,0,0,0,0|2,0,0]=4 14321 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [0,2,0,0,0,0|2,0,0]=4 14322 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,2,0,0,0,0|1,0,0]=3 14323 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 2230a_100000707694_100000210202 [0,2,0,0,0,0|2,0,0]=4 14324 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 269982a_100000707694_100000204670 [0,2,0,0,0,0|2,0,0]=4 14325 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 34a_100000707694_100000210202 [0,2,0,0,0,0|2,0,0]=4 14326 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 38a_100000707694_100000204670 [0,2,0,0,0,0|2,0,0]=4 14327 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 14328 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100102888905_100000210202 [0,2,0,0,0,0|2,0,0]=4 14329 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 14330 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100102888905_100000204670 [0,2,0,0,0,0|2,0,0]=4 14331 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 14332 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100102888905_100000210202 [0,2,0,0,0,0|2,0,0]=4 14333 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 7a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 14334 B12R1.367 CCN(C)c1ccc(c(c1)C)C 2230a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 14335 B12R1.367 CCN(C)c1ccc(c(c1)C)C 269982a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 14336 B12R1.367 CCN(C)c1ccc(c(c1)C)C 34a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 14337 B12R1.367 CCN(C)c1ccc(c(c1)C)C 7a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 14338 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 2230a_114849113799_100000210202 [0,2,0,0,0,0|2,0,0]=4 14339 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 269982a_114849113799_100000204670 [0,2,0,0,0,0|2,0,0]=4 14340 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 34a_114849113799_100000210202 [0,2,0,0,0,0|2,0,0]=4 14341 B12R1.367 CCN(C)c1ccc(c(c1)C)F 2230a_100011756966_100000210202 [0,2,0,0,0,0|2,0,0]=4 14342 B12R1.367 CCN(C)c1ccc(c(c1)C)F 269982a_100011756966_100000204670 [0,2,0,0,0,0|2,0,0]=4 14343 B12R1.367 CCN(C)c1ccc(c(c1)C)F 34a_100011756966_100000210202 [0,2,0,0,0,0|2,0,0]=4 14344 B12R1.367 CCN(C)c1ccc(c(c1)C)F 38a_100011756966_100000204670 [0,2,0,0,0,0|2,0,0]=4 14345 B12R1.367 CCN(C)c1ccc(c(c1)C)F 7a_100011756966_100000210202 [0,2,0,0,0,0|2,0,0]=4 14346 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 2230a_100000220120_100000210202 [0,2,0,0,0,0|2,0,0]=4 14347 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 269982a_100000220120_100000204670 [0,2,0,0,0,0|2,0,0]=4 14348 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 34a_100000220120_100000210202 [0,2,0,0,0,0|2,0,0]=4 14349 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 38a_100000220120_100000204670 [0,2,0,0,0,0|2,0,0]=4 14350 B12R1.367 CCN(C)c1ccc(c(c1)Cl)Cl 2230a_100000219944_100000210202 [0,2,0,0,0,0|2,0,0]=4 14351 B12R1.367 CCN(C)c1ccc(c(c1)Cl)Cl 269982a_100000219944_100000204670 [0,2,0,0,0,0|2,0,0]=4 14352 B12R1.367 CCN(C)c1ccc(c(c1)Cl)Cl 34a_100000219944_100000210202 [0,2,0,0,0,0|2,0,0]=4 14353 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 2230a_100000697440_100000210202 [0,2,0,0,0,0|2,0,0]=4 14354 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 269982a_100000697440_100000204670 [0,2,0,0,0,0|2,0,0]=4 14355 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 34a_100000697440_100000210202 [0,2,0,0,0,0|2,0,0]=4 14356 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 38a_100000697440_100000204670 [0,2,0,0,0,0|2,0,0]=4 14357 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 7a_100000697440_100000210202 [0,2,0,0,0,0|2,0,0]=4 14358 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 2230a_100012285320_100000210202 [0,2,0,0,0,0|2,0,0]=4 14359 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 269982a_100012285320_100000204670 [0,2,0,0,0,0|2,0,0]=4 14360 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 34a_100012285320_100000210202 [0,2,0,0,0,0|2,0,0]=4 14361 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 7a_100012285320_100000210202 [0,2,0,0,0,0|2,0,0]=4 14362 B12R1.367 CCN(C)c1ccc(c(c1)F)C 2230a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 14363 B12R1.367 CCN(C)c1ccc(c(c1)F)C 2230a_100160572069_100000210202 [0,2,0,0,0,0|2,0,0]=4 14364 B12R1.367 CCN(C)c1ccc(c(c1)F)C 269982a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 14365 B12R1.367 CCN(C)c1ccc(c(c1)F)C 269982a_100160572069_100000204670 [0,2,0,0,0,0|2,0,0]=4 14366 B12R1.367 CCN(C)c1ccc(c(c1)F)C 34a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 14367 B12R1.367 CCN(C)c1ccc(c(c1)F)C 34a_100160572069_100000210202 [0,2,0,0,0,0|2,0,0]=4 14368 B12R1.367 CCN(C)c1ccc(c(c1)F)C 38a_100160572069_100000204670 [0,2,0,0,0,0|2,0,0]=4 14369 B12R1.367 CCN(C)c1ccc(c(c1)F)C 7a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 14370 B12R1.367 CCN(C)c1ccc(c(c1)F)C 7a_100160572069_100000210202 [0,2,0,0,0,0|2,0,0]=4 14371 B12R1.367 CCN(C)c1ccc(c(c1)F)F 2230a_100000221014_100000210202 [0,2,0,0,0,0|2,0,0]=4 14372 B12R1.367 CCN(C)c1ccc(c(c1)F)F 2230a_100000221022_200000210301 [0,2,0,0,0,0|2,0,0]=4 14373 B12R1.367 CCN(C)c1ccc(c(c1)F)F 269982a_100000221014_100000204670 [0,2,0,0,0,0|2,0,0]=4 14374 B12R1.367 CCN(C)c1ccc(c(c1)F)F 269982a_100000221022_200000210301 [0,2,0,0,0,0|2,0,0]=4 14375 B12R1.367 CCN(C)c1ccc(c(c1)F)F 34a_100000221014_100000210202 [0,2,0,0,0,0|2,0,0]=4 14376 B12R1.367 CCN(C)c1ccc(c(c1)F)F 34a_100000221022_200000210301 [0,2,0,0,0,0|2,0,0]=4 14377 B12R1.367 CCN(C)c1ccc(c(c1)F)F 38a_100000221014_100000204670 [0,2,0,0,0,0|2,0,0]=4 14378 B12R1.367 CCN(C)c1ccc(c(c1)F)F 7a_100000221014_100000210202 [0,2,0,0,0,0|2,0,0]=4 14379 B12R1.367 CCN(C)c1ccc(c(c1)F)F 7a_100000221022_200000210301 [0,2,0,0,0,0|2,0,0]=4 14380 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 2230a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 14381 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 269982a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 14382 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 34a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 14383 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 7a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 14384 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 2230a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 14385 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 269982a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 14386 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 34a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 14387 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 7a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 14388 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 2230a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 14389 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 269982a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 14390 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 34a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 14391 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 7a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 14392 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 2230a_100000221022_200025704644 [0,2,0,0,0,0|2,0,0]=4 14393 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 269982a_100000221022_200025704644 [0,2,0,0,0,0|2,0,0]=4 14394 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 34a_100000221022_200025704644 [0,2,0,0,0,0|2,0,0]=4 14395 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 7a_100000221022_200025704644 [0,2,0,0,0,0|2,0,0]=4 14396 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [0,2,0,0,0,0|2,0,0]=4 14397 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [0,2,0,0,0,0|2,0,0]=4 14398 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [0,2,0,0,0,0|2,0,0]=4 14399 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [0,2,0,0,0,0|2,0,0]=4 14400 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [0,2,0,0,0,0|2,0,0]=4 14401 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [0,2,0,0,0,0|2,0,0]=4 14402 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [0,2,0,0,0,0|2,0,0]=4 14403 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [0,2,0,0,0,0|2,0,0]=4 14404 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [0,2,0,0,0,0|2,0,0]=4 14405 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [0,2,0,0,0,0|2,0,0]=4 14406 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [0,2,0,0,0,0|2,0,0]=4 14407 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [0,2,0,0,0,0|2,0,0]=4 14408 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [0,2,0,0,0,0|2,0,0]=4 14409 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [0,2,0,0,0,0|2,0,0]=4 14410 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [0,2,0,0,0,0|2,0,0]=4 14411 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [0,2,0,0,0,0|2,0,0]=4 14412 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [0,2,0,0,0,0|2,0,0]=4 14413 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [0,2,0,0,0,0|2,0,0]=4 14414 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [0,2,0,0,0,0|2,0,0]=4 14415 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [0,2,0,0,0,0|2,0,0]=4 14416 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,2,0,0,0,0|2,0,0]=4 14417 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,2,0,0,0,0|2,0,0]=4 14418 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,2,0,0,0,0|2,0,0]=4 14419 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,2,0,0,0,0|2,0,0]=4 14420 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,2,0,0,0,0|2,0,0]=4 14421 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,2,0,0,0,0|2,0,0]=4 14422 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,2,0,0,0,0|2,0,0]=4 14423 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [0,2,0,0,0,0|2,0,0]=4 14424 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [0,2,0,0,0,0|2,0,0]=4 14425 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [0,2,0,0,0,0|2,0,0]=4 14426 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [0,2,0,0,0,0|2,0,0]=4 14427 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [0,2,0,0,0,0|2,0,0]=4 14428 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,2,0,0,0,0|1,0,0]=3 14429 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [0,2,0,0,0,0|2,0,0]=4 14430 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [0,2,0,0,0,0|2,0,0]=4 14431 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [0,2,0,0,0,0|2,0,0]=4 14432 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [0,2,0,0,0,0|2,0,0]=4 14433 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [0,2,0,0,0,0|2,0,0]=4 14434 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,2,0,0,0,0|1,0,0]=3 14435 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,2,0,0,0,0|1,0,0]=3 14436 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [0,2,0,0,0,0|2,0,0]=4 14437 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [0,2,0,0,0,0|2,0,0]=4 14438 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [0,2,0,0,0,0|2,0,0]=4 14439 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [0,2,0,0,0,0|2,0,0]=4 14440 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [0,2,0,0,0,0|2,0,0]=4 14441 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,2,0,0,0,0|1,0,0]=3 14442 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [0,2,0,0,0,0|2,0,0]=4 14443 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [0,2,0,0,0,0|2,0,0]=4 14444 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [0,2,0,0,0,0|2,0,0]=4 14445 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [0,2,0,0,0,0|2,0,0]=4 14446 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [0,2,0,0,0,0|2,0,0]=4 14447 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,2,0,0,0,0|1,0,0]=3 14448 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,2,0,0,0,0|1,0,0]=3 14449 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [0,2,0,0,0,0|2,0,0]=4 14450 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [0,2,0,0,0,0|2,0,0]=4 14451 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [0,2,0,0,0,0|2,0,0]=4 14452 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [0,2,0,0,0,0|2,0,0]=4 14453 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [0,2,0,0,0,0|2,0,0]=4 14454 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [0,2,0,0,0,0|2,0,0]=4 14455 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [0,2,0,0,0,0|2,0,0]=4 14456 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [0,2,0,0,0,0|2,0,0]=4 14457 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [0,2,0,0,0,0|2,0,0]=4 14458 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [0,2,0,0,0,0|2,0,0]=4 14459 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,2,0,0,0,0|1,0,0]=3 14460 B12R1.1703 CCN(C)c1ccc(cc1Br)Br 269982a_200000221195_100000204670 [0,2,0,0,0,0|2,0,0]=4 14461 B12R1.1703 CCN(C)c1ccc(cc1Br)Br 34a_200000221195_100000210202 [0,2,0,0,0,0|2,0,0]=4 14462 B12R1.1703 CCN(C)c1ccc(cc1Br)C 2230a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 14463 B12R1.1703 CCN(C)c1ccc(cc1Br)C 269982a_100000221369_100000204670 [0,2,0,0,0,0|2,0,0]=4 14464 B12R1.1703 CCN(C)c1ccc(cc1Br)C 34a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 14465 B12R1.1703 CCN(C)c1ccc(cc1Br)Cl 269982a_100020633009_100000204670 [0,2,0,0,0,0|2,0,0]=4 14466 B12R1.1703 CCN(C)c1ccc(cc1Br)Cl 34a_100020633009_100000210202 [0,2,0,0,0,0|2,0,0]=4 14467 B12R1.1703 CCN(C)c1ccc(cc1Br)F 269982a_100011246292_100000204670 [0,2,0,0,0,0|2,0,0]=4 14468 B12R1.1703 CCN(C)c1ccc(cc1Br)F 34a_100011246292_100000210202 [0,2,0,0,0,0|2,0,0]=4 14469 B12R1.1703 CCN(C)c1ccc(cc1C)Br 2230a_100000221803_100000210202 [0,2,0,0,0,0|2,0,0]=4 14470 B12R1.1703 CCN(C)c1ccc(cc1C)Br 269982a_100000221803_100000204670 [0,2,0,0,0,0|2,0,0]=4 14471 B12R1.1703 CCN(C)c1ccc(cc1C)Br 34a_100000221803_100000210202 [0,2,0,0,0,0|2,0,0]=4 14472 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 2230a_114849113698_100000210202 [0,2,0,0,0,0|2,0,0]=4 14473 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 269982a_114849113698_100000204670 [0,2,0,0,0,0|2,0,0]=4 14474 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 34a_114849113698_100000210202 [0,2,0,0,0,0|2,0,0]=4 14475 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 38a_114849113698_100000204670 [0,2,0,0,0,0|2,0,0]=4 14476 B12R1.1703 CCN(C)c1ccc(cc1C)F 2230a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 14477 B12R1.1703 CCN(C)c1ccc(cc1C)F 269982a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 14478 B12R1.1703 CCN(C)c1ccc(cc1C)F 34a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 14479 B12R1.1703 CCN(C)c1ccc(cc1C)F 7a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 14480 B12R1.1703 CCN(C)c1ccc(cc1C)O 269982a_100161107805_100000204670 [0,2,0,0,0,0|1,0,0]=3 14481 B12R1.1703 CCN(C)c1ccc(cc1C)O 34a_100161107805_100000210202 [0,2,0,0,0,0|1,0,0]=3 14482 B12R1.1703 CCN(C)c1ccc(cc1Cl)Br 269982a_100000221650_100000204670 [0,2,0,0,0,0|2,0,0]=4 14483 B12R1.1703 CCN(C)c1ccc(cc1Cl)Br 34a_100000221650_100000210202 [0,2,0,0,0,0|2,0,0]=4 14484 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 269982a_100160557746_200000210301 [0,2,0,0,0,0|2,0,0]=4 14485 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_100000204670 [0,2,0,0,0,0|2,0,0]=4 14486 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 34a_100160557746_200000210301 [0,2,0,0,0,0|2,0,0]=4 14487 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 34a_114849113696_100000210202 [0,2,0,0,0,0|2,0,0]=4 14488 B12R1.1703 CCN(C)c1ccc(cc1F)Br 2230a_100000743884_100000210202 [0,2,0,0,0,0|2,0,0]=4 14489 B12R1.1703 CCN(C)c1ccc(cc1F)Br 269982a_100000743884_100000204670 [0,2,0,0,0,0|2,0,0]=4 14490 B12R1.1703 CCN(C)c1ccc(cc1F)Br 34a_100000743884_100000210202 [0,2,0,0,0,0|2,0,0]=4 14491 B12R1.1703 CCN(C)c1ccc(cc1F)F 2230a_100020633734_100000210202 [0,2,0,0,0,0|2,0,0]=4 14492 B12R1.1703 CCN(C)c1ccc(cc1F)F 269982a_100020633734_100000204670 [0,2,0,0,0,0|2,0,0]=4 14493 B12R1.1703 CCN(C)c1ccc(cc1F)F 34a_100020633734_100000210202 [0,2,0,0,0,0|2,0,0]=4 14494 B12R1.1703 CCN(C)c1ccc(cc1F)F 38a_100020633734_100000204670 [0,2,0,0,0,0|2,0,0]=4 14495 B12R1.1703 CCN(C)c1ccc(cc1F)I 269982a_114948340911_100000204670 [0,2,0,0,0,0|2,0,0]=4 14496 B12R1.1703 CCN(C)c1ccc(cc1F)I 34a_114948340911_100000210202 [0,2,0,0,0,0|2,0,0]=4 14497 B12R1.1703 CCN(C)c1ccc(cc1F)I 38a_114948340911_100000204670 [0,2,0,0,0,0|2,0,0]=4 14498 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 2230a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 14499 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 269982a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 14500 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 34a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 14501 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 7a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 14502 B12R1.1703 CCN([13CH3])c1ccc(cc1Cl)Cl 269982a_100160557746_200025704644 [0,2,0,0,0,0|2,0,0]=4 14503 B12R1.1703 CCN([13CH3])c1ccc(cc1Cl)Cl 34a_100160557746_200025704644 [0,2,0,0,0,0|2,0,0]=4 14504 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [0,2,0,0,0,0|2,0,0]=4 14505 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [0,2,0,0,0,0|2,0,0]=4 14506 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [0,2,0,0,0,0|2,0,0]=4 14507 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [0,2,0,0,0,0|2,0,0]=4 14508 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [0,2,0,0,0,0|2,0,0]=4 14509 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [0,2,0,0,0,0|2,0,0]=4 14510 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [0,2,0,0,0,0|2,0,0]=4 14511 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [0,2,0,0,0,0|2,0,0]=4 14512 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [0,2,0,0,0,0|2,0,0]=4 14513 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [0,2,0,0,0,0|2,0,0]=4 14514 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [0,2,0,0,0,0|2,0,0]=4 14515 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [0,2,0,0,0,0|2,0,0]=4 14516 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [0,2,0,0,0,0|2,0,0]=4 14517 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [0,2,0,0,0,0|2,0,0]=4 14518 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,2,0,0,0,0|2,0,0]=4 14519 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,2,0,0,0,0|2,0,0]=4 14520 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,2,0,0,0,0|2,0,0]=4 14521 B12R1.1703 Cc1cc(ccc1N(C)CF)O 269982a_100161107805_100015361967 [0,2,0,0,0,0|2,0,0]=4 14522 B12R1.1703 Cc1cc(ccc1N(C)CF)O 34a_100161107805_100015361967 [0,2,0,0,0,0|2,0,0]=4 14523 B12R1.1703 Cc1cc(ccc1[C@H](N)CO)O 271570a_203496583355_100138412551 [0,2,0,0,0,0|2,0,0]=4 14524 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,2,0,0,0,0|2,0,0]=4 14525 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,2,0,0,0,0|2,0,0]=4 14526 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,2,0,0,0,0|2,0,0]=4 14527 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,2,0,0,0,0|2,0,0]=4 14528 B12R1.112 C#Cc1cc(ccc1NCC)C 34a_200012001881_100000210202 [0,2,0,0,0,0|2,0,0]=4 14529 B12R1.112 C=Cc1cc(ccc1OCC)C 271570a_100011290941_200000230997 [0,2,0,0,0,0|1,0,0]=3 14530 B12R1.112 C=Cc1cc(ccc1OCC)F 271570a_100011290941_100000171695 [0,2,0,0,0,0|1,0,0]=3 14531 B12R1.112 C=Cc1cc(ccc1SCC)F 62a_100000210202_100012356183 [0,2,0,0,0,0|1,1,0]=4 14532 B12R1.112 C=Cc1cc(ccc1SCC)F 62a_100012356183_100000210202 [0,2,0,0,0,0|1,1,0]=4 14533 B12R1.112 C=Cc1cc(cnc1OCC)Br 271570a_100011290941_200010177599 [0,2,0,0,0,0|2,0,0]=4 14534 B12R1.112 CC=Cc1ccc(cc1C#N)O 271570a_100016259895_100009818209 [0,2,0,0,0,0|1,0,1]=4 14535 B12R1.112 CC=Cc1ccc(cc1C=O)O 271570a_100016259895_100000690577 [0,2,0,0,0,0|1,0,1]=4 14536 B12R1.112 CC=Cc1ccc(cc1CO)O 271570a_100016259895_100012351483 [0,2,0,0,0,0|1,0,1]=4 14537 B12R1.112 CC=Cc1ccc(cc1OC)O 271570a_100016259895_100011827694 [0,2,0,0,0,0|1,0,1]=4 14538 B12R1.112 CCNc1ccc(cc1C#N)Br 27a_100015525214_100011219714 [0,2,0,0,0,0|2,0,0]=4 14539 B12R1.112 CCNc1ccc(cc1C#N)Br 7a_100000688460_100000210202 [0,2,0,0,0,0|2,0,0]=4 14540 B12R1.112 CCNc1ccc(cc1C#N)C 7a_100011934023_100000210202 [0,2,0,0,0,0|2,0,0]=4 14541 B12R1.112 CCNc1ccc(cc1C#N)Cl 7a_100011219925_100000210202 [0,2,0,0,0,0|2,0,0]=4 14542 B12R1.112 CCNc1ccc(cc1C#N)F 34a_100000685569_100000210202 [0,2,0,0,0,0|2,0,0]=4 14543 B12R1.112 CCNc1ccc(cc1C#N)F 7a_100000685569_100000210202 [0,2,0,0,0,0|2,0,0]=4 14544 B12R1.112 CCNc1ccc(cc1C#N)I 7a_100000049818_100000210202 [0,2,0,0,0,0|2,0,0]=4 14545 B12R1.112 CCNc1ccc(cc1CC)Br 2230a_100000686106_100000210202 [0,2,0,0,0,0|2,0,0]=4 14546 B12R1.112 CCNc1ccc(cc1CC)Br 34a_100000686106_100000210202 [0,2,0,0,0,0|2,0,0]=4 14547 B12R1.112 CCNc1ccc(cc1CC)Br 7a_100000686106_100000210202 [0,2,0,0,0,0|2,0,0]=4 14548 B12R1.112 CCNc1ccc(cc1CC)Cl 2230a_100012017146_100000210202 [0,2,0,0,0,0|2,0,0]=4 14549 B12R1.112 CCNc1ccc(cc1CC)Cl 34a_100012017146_100000210202 [0,2,0,0,0,0|2,0,0]=4 14550 B12R1.112 CCNc1ccc(cc1CC)Cl 7a_100012017146_100000210202 [0,2,0,0,0,0|2,0,0]=4 14551 B12R1.112 CCNc1ccc(cc1CC)I 2230a_100000014069_100000210202 [0,2,0,0,0,0|2,0,0]=4 14552 B12R1.112 CCNc1ccc(cc1CC)I 34a_100000014069_100000210202 [0,2,0,0,0,0|2,0,0]=4 14553 B12R1.112 CCNc1ccc(cc1CC)I 7a_100000014069_100000210202 [0,2,0,0,0,0|2,0,0]=4 14554 B12R1.112 CCNc1ccc(cc1CO)Br 34a_100012353972_100000210202 [0,2,0,0,0,0|2,0,0]=4 14555 B12R1.112 CCNc1ccc(cc1CO)C 34a_100011215565_100000210202 [0,2,0,0,0,0|2,0,0]=4 14556 B12R1.112 CCNc1ccc(cc1CO)Cl 34a_100011214999_100000210202 [0,2,0,0,0,0|2,0,0]=4 14557 B12R1.112 CCNc1ccc(cc1CO)F 34a_100011296978_100000210202 [0,2,0,0,0,0|2,0,0]=4 14558 B12R1.112 CCNc1ccc(cc1OC)Br 34a_100011279103_100000210202 [0,2,0,0,0,0|2,0,0]=4 14559 B12R1.112 CCNc1ccc(cc1OC)C 2230a_100000746441_100000210202 [0,2,0,0,0,0|2,0,0]=4 14560 B12R1.112 CCNc1ccc(cc1OC)C 34a_100000746441_100000210202 [0,2,0,0,0,0|2,0,0]=4 14561 B12R1.112 CCNc1ccc(cc1OC)Cl 34a_100000707585_100000210202 [0,2,0,0,0,0|2,0,0]=4 14562 B12R1.112 CCNc1ccc(cc1OC)F 34a_100000737216_100000210202 [0,2,0,0,0,0|2,0,0]=4 14563 B12R1.112 CCNc1ccc(cc1OC)I 34a_100015196925_100000210202 [0,2,0,0,0,0|2,0,0]=4 14564 B12R1.112 CCNc1ccc(cc1OC)O 34a_100015326901_100000210202 [0,2,0,0,0,0|1,0,0]=3 14565 B12R1.112 CCNc1ncc(cc1C#N)O 271570a_203496583355_100012343968 [0,2,0,0,0,0|2,0,0]=4 14566 B12R1.112 CCOc1ccc(cc1C#N)Br 34a_100000687585_100000210202 [0,2,0,0,0,0|1,0,0]=3 14567 B12R1.112 CCOc1ccc(cc1C#N)Br 7a_100000687585_100000210202 [0,2,0,0,0,0|1,0,0]=3 14568 B12R1.112 CCOc1ccc(cc1C#N)C 34a_200012180384_100000210202 [0,2,0,0,0,0|1,0,0]=3 14569 B12R1.112 CCOc1ccc(cc1C#N)C 7a_200012180384_100000210202 [0,2,0,0,0,0|1,0,0]=3 14570 B12R1.112 CCOc1ccc(cc1C#N)Cl 34a_100011219380_100000210202 [0,2,0,0,0,0|1,0,0]=3 14571 B12R1.112 CCOc1ccc(cc1C#N)Cl 7a_100011219380_100000210202 [0,2,0,0,0,0|1,0,0]=3 14572 B12R1.112 CCOc1ccc(cc1C#N)F 34a_100011900173_100000210202 [0,2,0,0,0,0|1,0,0]=3 14573 B12R1.112 CCOc1ccc(cc1C#N)F 7a_100011900173_100000210202 [0,2,0,0,0,0|1,0,0]=3 14574 B12R1.112 CCOc1ccc(cc1C#N)I 34a_200000049958_100000210202 [0,2,0,0,0,0|1,0,0]=3 14575 B12R1.112 CCOc1ccc(cc1C#N)I 7a_200000049958_100000210202 [0,2,0,0,0,0|1,0,0]=3 14576 B12R1.112 CCOc1ccc(cc1C#N)N 34a_100011249283_100000210202 [0,2,0,0,0,0|1,0,0]=3 14577 B12R1.112 CCOc1ccc(cc1C#N)N 7a_100011249283_100000210202 [0,2,0,0,0,0|1,0,0]=3 14578 B12R1.112 CCOc1ccc(cc1C#N)O 271570a_203496583355_100000188824 [0,2,0,0,0,0|0,0,0]=2 14579 B12R1.112 CCOc1ccc(cc1C=O)O 271570a_203496583355_100000170027 [0,2,0,0,0,0|0,0,0]=2 14580 B12R1.112 CCOc1ccc(cc1CBr)F 34a_100010161318_100000210202 [0,2,0,0,0,0|1,0,0]=3 14581 B12R1.112 CCOc1ccc(cc1CBr)F 7a_100010161318_100000210202 [0,2,0,0,0,0|1,0,0]=3 14582 B12R1.112 CCOc1ccc(cc1CC)Br 34a_100012338938_100000210202 [0,2,0,0,0,0|1,0,0]=3 14583 B12R1.112 CCOc1ccc(cc1CC)Br 7a_100012338938_100000210202 [0,2,0,0,0,0|1,0,0]=3 14584 B12R1.112 CCOc1ccc(cc1CC)C 34a_100009844793_100000210202 [0,2,0,0,0,0|1,0,0]=3 14585 B12R1.112 CCOc1ccc(cc1CC)C 7a_100009844793_100000210202 [0,2,0,0,0,0|1,0,0]=3 14586 B12R1.112 CCOc1ccc(cc1CC)F 34a_200000035566_100000210202 [0,2,0,0,0,0|1,0,0]=3 14587 B12R1.112 CCOc1ccc(cc1CC)F 7a_200000035566_100000210202 [0,2,0,0,0,0|1,0,0]=3 14588 B12R1.112 CCOc1ccc(cc1CC)O 271570a_203496583355_200010070707 [0,2,0,0,0,0|0,0,0]=2 14589 B12R1.112 CCOc1ccc(cc1CN)Br 34a_100000730032_100000210202 [0,2,0,0,0,0|1,0,0]=3 14590 B12R1.112 CCOc1ccc(cc1CN)Cl 34a_100000238540_100000210202 [0,2,0,0,0,0|1,0,0]=3 14591 B12R1.112 CCOc1ccc(cc1CO)Br 34a_100000184703_100000210202 [0,2,0,0,0,0|1,0,0]=3 14592 B12R1.112 CCOc1ccc(cc1CO)Br 7a_100000184703_100000210202 [0,2,0,0,0,0|1,0,0]=3 14593 B12R1.112 CCOc1ccc(cc1CO)C 34a_200011846009_100000210202 [0,2,0,0,0,0|1,0,0]=3 14594 B12R1.112 CCOc1ccc(cc1CO)C 7a_200011846009_100000210202 [0,2,0,0,0,0|1,0,0]=3 14595 B12R1.112 CCOc1ccc(cc1CO)Cl 34a_100011218961_100000210202 [0,2,0,0,0,0|1,0,0]=3 14596 B12R1.112 CCOc1ccc(cc1CO)Cl 7a_100011218961_100000210202 [0,2,0,0,0,0|1,0,0]=3 14597 B12R1.112 CCOc1ccc(cc1CO)F 34a_100011291448_100000210202 [0,2,0,0,0,0|1,0,0]=3 14598 B12R1.112 CCOc1ccc(cc1CO)F 7a_100011291448_100000210202 [0,2,0,0,0,0|1,0,0]=3 14599 B12R1.112 CCOc1ccc(cc1CO)I 34a_100000049520_100000210202 [0,2,0,0,0,0|1,0,0]=3 14600 B12R1.112 CCOc1ccc(cc1CO)I 7a_100000049520_100000210202 [0,2,0,0,0,0|1,0,0]=3 14601 B12R1.112 CCOc1ccc(cc1NC)Br 2230a_100000751366_200000210301 [0,2,0,0,0,0|1,0,0]=3 14602 B12R1.112 CCOc1ccc(cc1NC)Br 34a_100000751366_200000210301 [0,2,0,0,0,0|1,0,0]=3 14603 B12R1.112 CCOc1ccc(cc1NC)C 2230a_100011202655_200000210301 [0,2,0,0,0,0|1,0,0]=3 14604 B12R1.112 CCOc1ccc(cc1NC)C 34a_100011202655_200000210301 [0,2,0,0,0,0|1,0,0]=3 14605 B12R1.112 CCOc1ccc(cc1NC)Cl 2230a_100000742605_200000210301 [0,2,0,0,0,0|1,0,0]=3 14606 B12R1.112 CCOc1ccc(cc1NC)Cl 34a_100000742605_200000210301 [0,2,0,0,0,0|1,0,0]=3 14607 B12R1.112 CCOc1ccc(cc1N[13CH3])Br 2230a_100000751366_200025704644 [0,2,0,0,0,0|1,0,0]=3 14608 B12R1.112 CCOc1ccc(cc1N[13CH3])Br 34a_100000751366_200025704644 [0,2,0,0,0,0|1,0,0]=3 14609 B12R1.112 CCOc1ccc(cc1N[13CH3])C 2230a_100011202655_200025704644 [0,2,0,0,0,0|1,0,0]=3 14610 B12R1.112 CCOc1ccc(cc1N[13CH3])C 34a_100011202655_200025704644 [0,2,0,0,0,0|1,0,0]=3 14611 B12R1.112 CCOc1ccc(cc1N[13CH3])Cl 2230a_100000742605_200025704644 [0,2,0,0,0,0|1,0,0]=3 14612 B12R1.112 CCOc1ccc(cc1N[13CH3])Cl 34a_100000742605_200025704644 [0,2,0,0,0,0|1,0,0]=3 14613 B12R1.112 CCOc1ccc(cc1OC)Br 34a_100000694246_100000210202 [0,2,0,0,0,0|1,0,0]=3 14614 B12R1.112 CCOc1ccc(cc1OC)Br 7a_100000694246_100000210202 [0,2,0,0,0,0|1,0,0]=3 14615 B12R1.112 CCOc1ccc(cc1OC)C 34a_100000186466_100000210202 [0,2,0,0,0,0|1,0,0]=3 14616 B12R1.112 CCOc1ccc(cc1OC)Cl 34a_100000033002_100000210202 [0,2,0,0,0,0|1,0,0]=3 14617 B12R1.112 CCOc1ccc(cc1OC)F 34a_100000036057_100000210202 [0,2,0,0,0,0|1,0,0]=3 14618 B12R1.112 CCOc1ccc(cc1OC)F 7a_100000036057_100000210202 [0,2,0,0,0,0|1,0,0]=3 14619 B12R1.112 CCOc1ccc(cc1OC)I 34a_100000049635_100000210202 [0,2,0,0,0,0|1,0,0]=3 14620 B12R1.112 CCOc1ccc(cc1OC)N 34a_100000726020_100000210202 [0,2,0,0,0,0|1,0,0]=3 14621 B12R1.112 CCOc1ccc(cc1OC)O 271570a_203496583355_200012344064 [0,2,0,0,0,0|0,0,0]=2 14622 B12R1.112 CCOc1ccc(cc1SC)C 62a_200000210301_200000230997 [0,2,0,0,0,0|1,0,0]=3 14623 B12R1.112 CCOc1ccc(cc1SC)C 62a_200000230997_200000210301 [0,2,0,0,0,0|1,0,0]=3 14624 B12R1.112 CCOc1ccc(cc1SC)F 62a_100000171695_200000210301 [0,2,0,0,0,0|1,0,0]=3 14625 B12R1.112 CCOc1ccc(cc1SC)F 62a_200000210301_100000171695 [0,2,0,0,0,0|1,0,0]=3 14626 B12R1.112 CCOc1ccc(cc1S[13CH3])C 62a_200000230997_200025704644 [0,2,0,0,0,0|1,0,0]=3 14627 B12R1.112 CCOc1ccc(cc1S[13CH3])C 62a_200025704644_200000230997 [0,2,0,0,0,0|1,0,0]=3 14628 B12R1.112 CCOc1ccc(cc1S[13CH3])F 62a_100000171695_200025704644 [0,2,0,0,0,0|1,0,0]=3 14629 B12R1.112 CCOc1ccc(cc1S[13CH3])F 62a_200025704644_100000171695 [0,2,0,0,0,0|1,0,0]=3 14630 B12R1.112 CCOc1ccc(nc1CC)C 34a_100000718140_100000210202 [0,2,0,0,0,0|2,0,0]=4 14631 B12R1.112 CCOc1ccc(nc1CC)C 7a_100000718140_100000210202 [0,2,0,0,0,0|2,0,0]=4 14632 B12R1.112 CCOc1ccc(nc1CCl)C 34a_100020630696_100000210202 [0,2,0,0,0,0|2,0,0]=4 14633 B12R1.112 CCOc1ccc(nc1CCl)C 7a_100020630696_100000210202 [0,2,0,0,0,0|2,0,0]=4 14634 B12R1.112 CCOc1ccc(nc1CO)C 34a_100000751967_100000210202 [0,2,0,0,0,0|2,0,0]=4 14635 B12R1.112 CCOc1ccc(nc1OC)Br 34a_100010893133_100000210202 [0,2,0,0,0,0|2,0,0]=4 14636 B12R1.112 CCOc1ncc(cc1OC)Cl 34a_200009845368_100000210202 [0,2,0,0,0,0|2,0,0]=4 14637 B12R1.112 CCOc1ncc(cc1OC)O 271570a_203496583355_200010116856 [0,2,0,0,0,0|1,0,0]=3 14638 B12R1.112 CCOc1ncc(cc1SC)Br 62a_200000210301_200010177599 [0,2,0,0,0,0|2,0,0]=4 14639 B12R1.112 CCOc1ncc(cc1SC)Br 62a_200010177599_200000210301 [0,2,0,0,0,0|2,0,0]=4 14640 B12R1.112 CCOc1ncc(cc1S[13CH3])Br 62a_200010177599_200025704644 [0,2,0,0,0,0|2,0,0]=4 14641 B12R1.112 CCOc1ncc(cc1S[13CH3])Br 62a_200025704644_200010177599 [0,2,0,0,0,0|2,0,0]=4 14642 B12R1.112 CCSc1ccc(cc1C#N)Br 62a_100000210202_100011219714 [0,2,0,0,0,0|1,1,0]=4 14643 B12R1.112 CCSc1ccc(cc1C#N)C 62a_100000210202_100011935190 [0,2,0,0,0,0|1,1,0]=4 14644 B12R1.112 CCSc1ccc(cc1C#N)Cl 62a_100000210202_200011356825 [0,2,0,0,0,0|1,1,0]=4 14645 B12R1.112 CCSc1ccc(cc1C#N)F 62a_100000210202_100000747550 [0,2,0,0,0,0|1,1,0]=4 14646 B12R1.112 CCSc1ccc(cc1C#N)N 62a_100000210202_100011934039 [0,2,0,0,0,0|1,1,0]=4 14647 B12R1.112 CCSc1ccc(cc1C#N)O 62a_100000210202_100009818209 [0,2,0,0,0,0|0,1,0]=3 14648 B12R1.112 CCSc1ccc(cc1C=O)Br 62a_100000210202_100010185651 [0,2,0,0,0,0|1,1,0]=4 14649 B12R1.112 CCSc1ccc(cc1C=O)Br 62a_100010185651_100000210202 [0,2,0,0,0,0|1,1,0]=4 14650 B12R1.112 CCSc1ccc(cc1C=O)C 62a_100000210202_100011551863 [0,2,0,0,0,0|1,1,0]=4 14651 B12R1.112 CCSc1ccc(cc1C=O)C 62a_100011551863_100000210202 [0,2,0,0,0,0|1,1,0]=4 14652 B12R1.112 CCSc1ccc(cc1C=O)Cl 62a_100000210202_100010254386 [0,2,0,0,0,0|1,1,0]=4 14653 B12R1.112 CCSc1ccc(cc1C=O)Cl 62a_100010254386_100000210202 [0,2,0,0,0,0|1,1,0]=4 14654 B12R1.112 CCSc1ccc(cc1C=O)F 62a_100000210202_100011218309 [0,2,0,0,0,0|1,1,0]=4 14655 B12R1.112 CCSc1ccc(cc1C=O)F 62a_100011218309_100000210202 [0,2,0,0,0,0|1,1,0]=4 14656 B12R1.112 CCSc1ccc(cc1C=O)O 62a_100000210202_100000690577 [0,2,0,0,0,0|0,1,0]=3 14657 B12R1.112 CCSc1ccc(cc1C=O)O 62a_100000690577_100000210202 [0,2,0,0,0,0|0,1,0]=3 14658 B12R1.112 CCSc1ccc(cc1CC)Br 62a_100000210202_100011216195 [0,2,0,0,0,0|1,1,0]=4 14659 B12R1.112 CCSc1ccc(cc1CC)Br 62a_100011216195_100000210202 [0,2,0,0,0,0|1,1,0]=4 14660 B12R1.112 CCSc1ccc(cc1CC)N 62a_100000210202_100010109747 [0,2,0,0,0,0|1,1,0]=4 14661 B12R1.112 CCSc1ccc(cc1CC)N 62a_100010109747_100000210202 [0,2,0,0,0,0|1,1,0]=4 14662 B12R1.112 CCSc1ccc(cc1CN)F 62a_100000210202_100000742738 [0,2,0,0,0,0|1,1,0]=4 14663 B12R1.112 CCSc1ccc(cc1CN)F 62a_100000742738_100000210202 [0,2,0,0,0,0|1,1,0]=4 14664 B12R1.112 CCSc1ccc(cc1CO)Br 62a_100000210202_100011356890 [0,2,0,0,0,0|1,1,0]=4 14665 B12R1.112 CCSc1ccc(cc1CO)Br 62a_100011356890_100000210202 [0,2,0,0,0,0|1,1,0]=4 14666 B12R1.112 CCSc1ccc(cc1CO)C 62a_100000210202_100012361352 [0,2,0,0,0,0|1,1,0]=4 14667 B12R1.112 CCSc1ccc(cc1CO)C 62a_100012361352_100000210202 [0,2,0,0,0,0|1,1,0]=4 14668 B12R1.112 CCSc1ccc(cc1CO)F 62a_100000210202_100011217561 [0,2,0,0,0,0|1,1,0]=4 14669 B12R1.112 CCSc1ccc(cc1CO)F 62a_100011217561_100000210202 [0,2,0,0,0,0|1,1,0]=4 14670 B12R1.112 CCSc1ccc(cc1CO)N 62a_100000210202_100012347228 [0,2,0,0,0,0|1,1,0]=4 14671 B12R1.112 CCSc1ccc(cc1CO)N 62a_100012347228_100000210202 [0,2,0,0,0,0|1,1,0]=4 14672 B12R1.112 CCSc1ccc(cc1CO)O 62a_100000210202_100012351483 [0,2,0,0,0,0|0,1,0]=3 14673 B12R1.112 CCSc1ccc(cc1CO)O 62a_100012351483_100000210202 [0,2,0,0,0,0|0,1,0]=3 14674 B12R1.112 CCSc1ccc(cc1NC)Cl 34a_100000752208_200000210301 [0,2,0,0,0,0|1,1,0]=4 14675 B12R1.112 CCSc1ccc(cc1NC)F 62a_100000210202_100020633008 [0,2,0,0,0,0|1,1,0]=4 14676 B12R1.112 CCSc1ccc(cc1NC)F 62a_100020633008_100000210202 [0,2,0,0,0,0|1,1,0]=4 14677 B12R1.112 CCSc1ccc(cc1NN)F 62a_100000210202_100012362518 [0,2,0,0,0,0|1,1,0]=4 14678 B12R1.112 CCSc1ccc(cc1NN)F 62a_100012362518_100000210202 [0,2,0,0,0,0|1,1,0]=4 14679 B12R1.112 CCSc1ccc(cc1N[13CH3])Cl 34a_100000752208_200025704644 [0,2,0,0,0,0|1,1,0]=4 14680 B12R1.112 CCSc1ccc(cc1OC)Br 62a_100000210202_100010245111 [0,2,0,0,0,0|1,1,0]=4 14681 B12R1.112 CCSc1ccc(cc1OC)Br 62a_100010245111_100000210202 [0,2,0,0,0,0|1,1,0]=4 14682 B12R1.112 CCSc1ccc(cc1OC)C 62a_100000210202_100010200004 [0,2,0,0,0,0|1,1,0]=4 14683 B12R1.112 CCSc1ccc(cc1OC)C 62a_100010200004_100000210202 [0,2,0,0,0,0|1,1,0]=4 14684 B12R1.112 CCSc1ccc(cc1OC)Cl 62a_100000050115_100000210202 [0,2,0,0,0,0|1,1,0]=4 14685 B12R1.112 CCSc1ccc(cc1OC)Cl 62a_100000210202_100000050115 [0,2,0,0,0,0|1,1,0]=4 14686 B12R1.112 CCSc1ccc(cc1OC)F 62a_100000210202_100000757151 [0,2,0,0,0,0|1,1,0]=4 14687 B12R1.112 CCSc1ccc(cc1OC)F 62a_100000757151_100000210202 [0,2,0,0,0,0|1,1,0]=4 14688 B12R1.112 CCSc1ccc(cc1OC)N 62a_100000210202_100000765947 [0,2,0,0,0,0|1,1,0]=4 14689 B12R1.112 CCSc1ccc(cc1OC)N 62a_100000765947_100000210202 [0,2,0,0,0,0|1,1,0]=4 14690 B12R1.112 CCSc1ccc(cc1OC)O 62a_100000210202_100011827694 [0,2,0,0,0,0|0,1,0]=3 14691 B12R1.112 CCSc1ccc(cc1SC)C 62a_100000210202_200010709736 [0,2,0,0,0,0|1,1,0]=4 14692 B12R1.112 CCSc1ccc(cc1SC)C 62a_200010709736_100000210202 [0,2,0,0,0,0|1,1,0]=4 14693 B12R1.112 CCSc1cnc(cc1C=O)O 62a_100000210202_100010064890 [0,2,0,0,0,0|1,1,0]=4 14694 B12R1.112 CCSc1cnc(cc1C=O)O 62a_100010064890_100000210202 [0,2,0,0,0,0|1,1,0]=4 14695 B12R1.112 CCc1cc(ccc1OCF)Br 34a_100012338938_100015361967 [0,2,0,0,0,0|2,0,0]=4 14696 B12R1.112 CCc1cc(ccc1OCF)Br 7a_100012338938_100015361967 [0,2,0,0,0,0|2,0,0]=4 14697 B12R1.112 CCc1cc(ccc1OCF)C 34a_100009844793_100015361967 [0,2,0,0,0,0|2,0,0]=4 14698 B12R1.112 CCc1cc(ccc1OCF)C 7a_100009844793_100015361967 [0,2,0,0,0,0|2,0,0]=4 14699 B12R1.112 CCc1cc(ccc1OCF)F 34a_200000035566_100015361967 [0,2,0,0,0,0|2,0,0]=4 14700 B12R1.112 CCc1cc(ccc1OCF)F 7a_200000035566_100015361967 [0,2,0,0,0,0|2,0,0]=4 14701 B12R1.112 COc1cc(ccc1NCF)O 34a_100015326901_100015361967 [0,2,0,0,0,0|2,0,0]=4 14702 B12R1.112 COc1cc(ccc1OCF)Br 34a_100000694246_100015361967 [0,2,0,0,0,0|2,0,0]=4 14703 B12R1.112 COc1cc(ccc1OCF)Br 7a_100000694246_100015361967 [0,2,0,0,0,0|2,0,0]=4 14704 B12R1.112 COc1cc(ccc1OCF)C 34a_100000186466_100015361967 [0,2,0,0,0,0|2,0,0]=4 14705 B12R1.112 COc1cc(ccc1OCF)Cl 34a_100000033002_100015361967 [0,2,0,0,0,0|2,0,0]=4 14706 B12R1.112 COc1cc(ccc1OCF)F 34a_100000036057_100015361967 [0,2,0,0,0,0|2,0,0]=4 14707 B12R1.112 COc1cc(ccc1OCF)F 7a_100000036057_100015361967 [0,2,0,0,0,0|2,0,0]=4 14708 B12R1.112 COc1cc(ccc1OCF)I 34a_100000049635_100015361967 [0,2,0,0,0,0|2,0,0]=4 14709 B12R1.112 COc1cc(ccc1OCF)N 34a_100000726020_100015361967 [0,2,0,0,0,0|2,0,0]=4 14710 B12R1.112 COc1cc(ccc1SCF)O 62a_100015361967_100011827694 [0,2,0,0,0,0|1,1,0]=4 14711 B12R1.112 Cc1ccc(c(c1)C#N)OCF 34a_200012180384_100015361967 [0,2,0,0,0,0|2,0,0]=4 14712 B12R1.112 Cc1ccc(c(c1)C#N)OCF 7a_200012180384_100015361967 [0,2,0,0,0,0|2,0,0]=4 14713 B12R1.112 Cc1ccc(c(c1)CO)OCF 34a_200011846009_100015361967 [0,2,0,0,0,0|2,0,0]=4 14714 B12R1.112 Cc1ccc(c(c1)CO)OCF 7a_200011846009_100015361967 [0,2,0,0,0,0|2,0,0]=4 14715 B12R1.112 FCOc1ccc(cc1CBr)F 34a_100010161318_100015361967 [0,2,0,0,0,0|2,0,0]=4 14716 B12R1.112 FCOc1ccc(cc1CBr)F 7a_100010161318_100015361967 [0,2,0,0,0,0|2,0,0]=4 14717 B12R1.112 N#Cc1cc(ccc1OCF)Br 34a_100000687585_100015361967 [0,2,0,0,0,0|2,0,0]=4 14718 B12R1.112 N#Cc1cc(ccc1OCF)Br 7a_100000687585_100015361967 [0,2,0,0,0,0|2,0,0]=4 14719 B12R1.112 N#Cc1cc(ccc1OCF)Cl 34a_100011219380_100015361967 [0,2,0,0,0,0|2,0,0]=4 14720 B12R1.112 N#Cc1cc(ccc1OCF)Cl 7a_100011219380_100015361967 [0,2,0,0,0,0|2,0,0]=4 14721 B12R1.112 N#Cc1cc(ccc1OCF)F 34a_100011900173_100015361967 [0,2,0,0,0,0|2,0,0]=4 14722 B12R1.112 N#Cc1cc(ccc1OCF)F 7a_100011900173_100015361967 [0,2,0,0,0,0|2,0,0]=4 14723 B12R1.112 N#Cc1cc(ccc1OCF)I 34a_200000049958_100015361967 [0,2,0,0,0,0|2,0,0]=4 14724 B12R1.112 N#Cc1cc(ccc1OCF)I 7a_200000049958_100015361967 [0,2,0,0,0,0|2,0,0]=4 14725 B12R1.112 N#Cc1cc(ccc1OCF)N 34a_100011249283_100015361967 [0,2,0,0,0,0|2,0,0]=4 14726 B12R1.112 N#Cc1cc(ccc1OCF)N 7a_100011249283_100015361967 [0,2,0,0,0,0|2,0,0]=4 14727 B12R1.112 N#Cc1cc(ccc1SCF)O 62a_100015361967_100009818209 [0,2,0,0,0,0|1,1,0]=4 14728 B12R1.112 NCc1cc(ccc1OCF)Br 34a_100000730032_100015361967 [0,2,0,0,0,0|2,0,0]=4 14729 B12R1.112 NCc1cc(ccc1OCF)Cl 34a_100000238540_100015361967 [0,2,0,0,0,0|2,0,0]=4 14730 B12R1.112 O=Cc1cc(ccc1SCF)O 62a_100000690577_100015361967 [0,2,0,0,0,0|1,1,0]=4 14731 B12R1.112 O=Cc1cc(ccc1SCF)O 62a_100015361967_100000690577 [0,2,0,0,0,0|1,1,0]=4 14732 B12R1.112 OCc1cc(ccc1OCF)Br 34a_100000184703_100015361967 [0,2,0,0,0,0|2,0,0]=4 14733 B12R1.112 OCc1cc(ccc1OCF)Br 7a_100000184703_100015361967 [0,2,0,0,0,0|2,0,0]=4 14734 B12R1.112 OCc1cc(ccc1OCF)Cl 34a_100011218961_100015361967 [0,2,0,0,0,0|2,0,0]=4 14735 B12R1.112 OCc1cc(ccc1OCF)Cl 7a_100011218961_100015361967 [0,2,0,0,0,0|2,0,0]=4 14736 B12R1.112 OCc1cc(ccc1OCF)F 34a_100011291448_100015361967 [0,2,0,0,0,0|2,0,0]=4 14737 B12R1.112 OCc1cc(ccc1OCF)F 7a_100011291448_100015361967 [0,2,0,0,0,0|2,0,0]=4 14738 B12R1.112 OCc1cc(ccc1OCF)I 34a_100000049520_100015361967 [0,2,0,0,0,0|2,0,0]=4 14739 B12R1.112 OCc1cc(ccc1OCF)I 7a_100000049520_100015361967 [0,2,0,0,0,0|2,0,0]=4 14740 B12R1.112 OCc1cc(ccc1SCF)O 62a_100012351483_100015361967 [0,2,0,0,0,0|1,1,0]=4 14741 B12R1.112 OCc1cc(ccc1SCF)O 62a_100015361967_100012351483 [0,2,0,0,0,0|1,1,0]=4 14742 B12R1.114 C=Cc1ccc(c(c1)C)OCC 271570a_100011290941_100011308936 [0,2,0,0,0,0|1,0,0]=3 14743 B12R1.114 C=Cc1ccc(c(c1)F)OCC 271570a_100011290941_200000171753 [0,2,0,0,0,0|1,0,0]=3 14744 B12R1.114 C=Cc1ccc(c(c1)N)OCC 271570a_100011290941_100000751366 [0,2,0,0,0,0|1,0,0]=3 14745 B12R1.114 C=Cc1cnc(c(c1)C)OCC 271570a_100011290941_100012351028 [0,2,0,0,0,0|2,0,0]=4 14746 B12R1.114 C=Cc1cnc(c(c1)N)OCC 271570a_100011290941_100011433076 [0,2,0,0,0,0|2,0,0]=4 14747 B12R1.114 CC=Cc1ccc(cc1Br)OC 271570a_100016259895_100012349170 [0,2,0,0,0,0|1,0,1]=4 14748 B12R1.114 CC=Cc1ccc(cc1C)CO 271570a_100016259895_100000718852 [0,2,0,0,0,0|1,0,1]=4 14749 B12R1.114 CC=Cc1ccc(cc1C)OC 271570a_100016259895_100000759875 [0,2,0,0,0,0|1,0,1]=4 14750 B12R1.114 CC=Cc1ccc(cc1Cl)CO 271570a_100016259895_100000718186 [0,2,0,0,0,0|1,0,1]=4 14751 B12R1.114 CC=Cc1ccc(cc1F)CO 271570a_100016259895_100011533735 [0,2,0,0,0,0|1,0,1]=4 14752 B12R1.114 CC=Cc1ccc(cc1F)OC 271570a_100016259895_100000753793 [0,2,0,0,0,0|1,0,1]=4 14753 B12R1.114 CC=Cc1ccc(cc1N)CO 271570a_100016259895_100012347568 [0,2,0,0,0,0|1,0,1]=4 14754 B12R1.114 CC=Cc1ccc(cc1N)OC 271570a_100016259895_100000748021 [0,2,0,0,0,0|1,0,1]=4 14755 B12R1.114 CC=Cc1ccc(cc1O)CO 271570a_100016259895_100000049605 [0,2,0,0,0,0|1,0,1]=4 14756 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [0,2,0,0,0,0|1,0,1]=4 14757 B12R1.114 CCNc1ccc(cc1Br)C#N 34a_100000736769_100000210202 [0,2,0,0,0,0|2,0,0]=4 14758 B12R1.114 CCNc1ccc(cc1Br)C#N 7a_100000736769_100000210202 [0,2,0,0,0,0|2,0,0]=4 14759 B12R1.114 CCNc1ccc(cc1Br)CC 2230a_100012339725_100000210202 [0,2,0,0,0,0|2,0,0]=4 14760 B12R1.114 CCNc1ccc(cc1Br)CC 34a_100012339725_100000210202 [0,2,0,0,0,0|2,0,0]=4 14761 B12R1.114 CCNc1ccc(cc1Br)OC 34a_100015195136_100000210202 [0,2,0,0,0,0|1,0,0]=3 14762 B12R1.114 CCNc1ccc(cc1C)C#N 34a_100011216260_100000210202 [0,2,0,0,0,0|2,0,0]=4 14763 B12R1.114 CCNc1ccc(cc1C)C#N 7a_100011216260_100000210202 [0,2,0,0,0,0|2,0,0]=4 14764 B12R1.114 CCNc1ccc(cc1C)CC 2230a_100011226020_100000210202 [0,2,0,0,0,0|2,0,0]=4 14765 B12R1.114 CCNc1ccc(cc1C)CC 34a_100011226020_100000210202 [0,2,0,0,0,0|2,0,0]=4 14766 B12R1.114 CCNc1ccc(cc1C)CC 7a_100011226020_100000210202 [0,2,0,0,0,0|2,0,0]=4 14767 B12R1.114 CCNc1ccc(cc1C)CO 2230a_200011997030_100000210202 [0,2,0,0,0,0|1,0,0]=3 14768 B12R1.114 CCNc1ccc(cc1C)CO 34a_200011997030_100000210202 [0,2,0,0,0,0|1,0,0]=3 14769 B12R1.114 CCNc1ccc(cc1C)OC 34a_100000750285_100000210202 [0,2,0,0,0,0|1,0,0]=3 14770 B12R1.114 CCNc1ccc(cc1Cl)C#N 34a_100000690208_100000210202 [0,2,0,0,0,0|2,0,0]=4 14771 B12R1.114 CCNc1ccc(cc1Cl)C#N 7a_100000690208_100000210202 [0,2,0,0,0,0|2,0,0]=4 14772 B12R1.114 CCNc1ccc(cc1Cl)OC 34a_100000747055_100000210202 [0,2,0,0,0,0|1,0,0]=3 14773 B12R1.114 CCNc1ccc(cc1F)C#N 34a_100000760432_100000210202 [0,2,0,0,0,0|2,0,0]=4 14774 B12R1.114 CCNc1ccc(cc1F)C#N 7a_100000760432_100000210202 [0,2,0,0,0,0|2,0,0]=4 14775 B12R1.114 CCNc1ccc(cc1F)CC 2230a_100016177294_100000210202 [0,2,0,0,0,0|2,0,0]=4 14776 B12R1.114 CCNc1ccc(cc1F)CC 34a_100016177294_100000210202 [0,2,0,0,0,0|2,0,0]=4 14777 B12R1.114 CCNc1ccc(cc1F)CO 2230a_100011217239_100000210202 [0,2,0,0,0,0|1,0,0]=3 14778 B12R1.114 CCNc1ccc(cc1F)CO 34a_100011217239_100000210202 [0,2,0,0,0,0|1,0,0]=3 14779 B12R1.114 CCNc1ccc(cc1F)OC 34a_100011299463_100000210202 [0,2,0,0,0,0|1,0,0]=3 14780 B12R1.114 CCNc1ccc(cc1F)SC 34a_100012056844_100000210202 [0,2,0,0,0,0|1,1,0]=4 14781 B12R1.114 CCNc1ccc(cc1I)C#N 7a_100000067503_100000210202 [0,2,0,0,0,0|2,0,0]=4 14782 B12R1.114 CCNc1ccc(cc1I)OC 34a_100000049804_100000210202 [0,2,0,0,0,0|1,0,0]=3 14783 B12R1.114 CCNc1ccc(cc1O)C#N 34a_100011997735_100000210202 [0,2,0,0,0,0|2,0,0]=4 14784 B12R1.114 CCNc1ccc(cc1O)CC 34a_100000124328_100000210202 [0,2,0,0,0,0|2,0,0]=4 14785 B12R1.114 CCNc1ccc(cc1O)OC 34a_100016989039_100000210202 [0,2,0,0,0,0|1,0,0]=3 14786 B12R1.114 CCOc1ccc(cc1Br)C#N 34a_100011216086_100000210202 [0,2,0,0,0,0|1,0,0]=3 14787 B12R1.114 CCOc1ccc(cc1Br)C#N 7a_100011216086_100000210202 [0,2,0,0,0,0|1,0,0]=3 14788 B12R1.114 CCOc1ccc(cc1Br)CC 34a_100012339963_100000210202 [0,2,0,0,0,0|1,0,0]=3 14789 B12R1.114 CCOc1ccc(cc1Br)CC 7a_100012339963_100000210202 [0,2,0,0,0,0|1,0,0]=3 14790 B12R1.114 CCOc1ccc(cc1Br)CO 34a_100011191544_100000210202 [0,2,0,0,0,0|0,0,0]=2 14791 B12R1.114 CCOc1ccc(cc1Br)CO 7a_100011191544_100000210202 [0,2,0,0,0,0|0,0,0]=2 14792 B12R1.114 CCOc1ccc(cc1Br)OC 34a_100000685887_100000210202 [0,2,0,0,0,0|0,0,0]=2 14793 B12R1.114 CCOc1ccc(cc1Br)OC 7a_100000685887_100000210202 [0,2,0,0,0,0|0,0,0]=2 14794 B12R1.114 CCOc1ccc(cc1C)C#N 34a_100000749339_100000210202 [0,2,0,0,0,0|1,0,0]=3 14795 B12R1.114 CCOc1ccc(cc1C)C#N 7a_100000749339_100000210202 [0,2,0,0,0,0|1,0,0]=3 14796 B12R1.114 CCOc1ccc(cc1C)CO 34a_100000075815_100000210202 [0,2,0,0,0,0|0,0,0]=2 14797 B12R1.114 CCOc1ccc(cc1C)CO 7a_100000075815_100000210202 [0,2,0,0,0,0|0,0,0]=2 14798 B12R1.114 CCOc1ccc(cc1C)OC 34a_100012002223_100000210202 [0,2,0,0,0,0|0,0,0]=2 14799 B12R1.114 CCOc1ccc(cc1C)OC 7a_100012002223_100000210202 [0,2,0,0,0,0|0,0,0]=2 14800 B12R1.114 CCOc1ccc(cc1C)SC 62a_100011308936_200000210301 [0,2,0,0,0,0|0,1,0]=3 14801 B12R1.114 CCOc1ccc(cc1C)SC 62a_200000210301_100011308936 [0,2,0,0,0,0|0,1,0]=3 14802 B12R1.114 CCOc1ccc(cc1C)S[13CH3] 62a_100011308936_200025704644 [0,2,0,0,0,0|0,1,0]=3 14803 B12R1.114 CCOc1ccc(cc1C)S[13CH3] 62a_200025704644_100011308936 [0,2,0,0,0,0|0,1,0]=3 14804 B12R1.114 CCOc1ccc(cc1Cl)C#N 34a_100000205955_100000210202 [0,2,0,0,0,0|1,0,0]=3 14805 B12R1.114 CCOc1ccc(cc1Cl)C#N 7a_100000205955_100000210202 [0,2,0,0,0,0|1,0,0]=3 14806 B12R1.114 CCOc1ccc(cc1Cl)NC 2230a_100000741444_200000210301 [0,2,0,0,0,0|1,0,0]=3 14807 B12R1.114 CCOc1ccc(cc1Cl)NC 34a_100000741444_200000210301 [0,2,0,0,0,0|1,0,0]=3 14808 B12R1.114 CCOc1ccc(cc1Cl)NC 7a_100000741444_200000210301 [0,2,0,0,0,0|1,0,0]=3 14809 B12R1.114 CCOc1ccc(cc1Cl)N[13CH3] 2230a_100000741444_200025704644 [0,2,0,0,0,0|1,0,0]=3 14810 B12R1.114 CCOc1ccc(cc1Cl)N[13CH3] 34a_100000741444_200025704644 [0,2,0,0,0,0|1,0,0]=3 14811 B12R1.114 CCOc1ccc(cc1Cl)N[13CH3] 7a_100000741444_200025704644 [0,2,0,0,0,0|1,0,0]=3 14812 B12R1.114 CCOc1ccc(cc1Cl)OC 34a_100000038596_100000210202 [0,2,0,0,0,0|0,0,0]=2 14813 B12R1.114 CCOc1ccc(cc1Cl)OC 7a_100000038596_100000210202 [0,2,0,0,0,0|0,0,0]=2 14814 B12R1.114 CCOc1ccc(cc1F)C#N 34a_100000751310_100000210202 [0,2,0,0,0,0|1,0,0]=3 14815 B12R1.114 CCOc1ccc(cc1F)C#N 7a_100000751310_100000210202 [0,2,0,0,0,0|1,0,0]=3 14816 B12R1.114 CCOc1ccc(cc1F)CN 34a_100000758358_100000210202 [0,2,0,0,0,0|1,0,0]=3 14817 B12R1.114 CCOc1ccc(cc1F)OC 34a_100000036999_100000210202 [0,2,0,0,0,0|0,0,0]=2 14818 B12R1.114 CCOc1ccc(cc1F)OC 34a_100012771078_200000210301 [0,2,0,0,0,0|0,0,0]=2 14819 B12R1.114 CCOc1ccc(cc1F)OC 7a_100000036999_100000210202 [0,2,0,0,0,0|0,0,0]=2 14820 B12R1.114 CCOc1ccc(cc1F)OC 7a_100012771078_200000210301 [0,2,0,0,0,0|0,0,0]=2 14821 B12R1.114 CCOc1ccc(cc1F)O[13CH3] 34a_100012771078_200025704644 [0,2,0,0,0,0|0,0,0]=2 14822 B12R1.114 CCOc1ccc(cc1F)O[13CH3] 7a_100012771078_200025704644 [0,2,0,0,0,0|0,0,0]=2 14823 B12R1.114 CCOc1ccc(cc1F)SC 62a_200000171753_200000210301 [0,2,0,0,0,0|0,1,0]=3 14824 B12R1.114 CCOc1ccc(cc1F)SC 62a_200000210301_200000171753 [0,2,0,0,0,0|0,1,0]=3 14825 B12R1.114 CCOc1ccc(cc1F)S[13CH3] 62a_200000171753_200025704644 [0,2,0,0,0,0|0,1,0]=3 14826 B12R1.114 CCOc1ccc(cc1F)S[13CH3] 62a_200025704644_200000171753 [0,2,0,0,0,0|0,1,0]=3 14827 B12R1.114 CCOc1ccc(cc1I)C#N 34a_100000725478_100000210202 [0,2,0,0,0,0|1,0,0]=3 14828 B12R1.114 CCOc1ccc(cc1I)C#N 7a_100000725478_100000210202 [0,2,0,0,0,0|1,0,0]=3 14829 B12R1.114 CCOc1ccc(cc1N)C#N 34a_100000766272_100000210202 [0,2,0,0,0,0|1,0,0]=3 14830 B12R1.114 CCOc1ccc(cc1N)C#N 7a_100000766272_100000210202 [0,2,0,0,0,0|1,0,0]=3 14831 B12R1.114 CCOc1ccc(cc1N)CC 34a_100000765835_100000210202 [0,2,0,0,0,0|1,0,0]=3 14832 B12R1.114 CCOc1ccc(cc1N)CC 7a_100000765835_100000210202 [0,2,0,0,0,0|1,0,0]=3 14833 B12R1.114 CCOc1ccc(cc1N)CO 34a_100000123545_100000210202 [0,2,0,0,0,0|0,0,0]=2 14834 B12R1.114 CCOc1ccc(cc1N)OC 34a_100000188146_100000210202 [0,2,0,0,0,0|0,0,0]=2 14835 B12R1.114 CCOc1ccc(cc1N)SC 62a_100000751366_200000210301 [0,2,0,0,0,0|0,1,0]=3 14836 B12R1.114 CCOc1ccc(cc1N)S[13CH3] 62a_100000751366_200025704644 [0,2,0,0,0,0|0,1,0]=3 14837 B12R1.114 CCOc1ccc(cc1O)C#N 271570a_203496583355_100000189309 [0,2,0,0,0,0|1,0,0]=3 14838 B12R1.114 CCOc1ccc(cc1O)C=O 271570a_203496583355_100000173028 [0,2,0,0,0,0|0,0,1]=3 14839 B12R1.114 CCOc1ccc(cc1O)CO 271570a_203496583355_200011800839 [0,2,0,0,0,0|0,0,0]=2 14840 B12R1.114 CCOc1ccc(nc1Br)CO 34a_200009817064_100000210202 [0,2,0,0,0,0|1,0,0]=3 14841 B12R1.114 CCOc1ccc(nc1Br)CO 7a_200009817064_100000210202 [0,2,0,0,0,0|1,0,0]=3 14842 B12R1.114 CCOc1ccc(nc1C)OC 34a_200009873766_100000210202 [0,2,0,0,0,0|1,0,0]=3 14843 B12R1.114 CCOc1ccc(nc1Cl)CO 34a_200000118097_100000210202 [0,2,0,0,0,0|1,0,0]=3 14844 B12R1.114 CCOc1ccc(nc1Cl)CO 7a_200000118097_100000210202 [0,2,0,0,0,0|1,0,0]=3 14845 B12R1.114 CCOc1coc(cc1=O)CCl 34a_100000010605_100000210202 [0,2,0,0,0,0|2,0,0]=4 14846 B12R1.114 CCOc1coc(cc1=O)CO 34a_100000211585_100000210202 [0,2,0,0,0,0|1,0,0]=3 14847 B12R1.114 CCOc1ncc(cc1C)SC 62a_100012351028_200000210301 [0,2,0,0,0,0|1,1,0]=4 14848 B12R1.114 CCOc1ncc(cc1C)SC 62a_200000210301_100012351028 [0,2,0,0,0,0|1,1,0]=4 14849 B12R1.114 CCOc1ncc(cc1C)S[13CH3] 62a_100012351028_200025704644 [0,2,0,0,0,0|1,1,0]=4 14850 B12R1.114 CCOc1ncc(cc1C)S[13CH3] 62a_200025704644_100012351028 [0,2,0,0,0,0|1,1,0]=4 14851 B12R1.114 CCOc1ncc(cc1N)SC 62a_100011433076_200000210301 [0,2,0,0,0,0|1,1,0]=4 14852 B12R1.114 CCOc1ncc(cc1N)SC 62a_200000210301_100011433076 [0,2,0,0,0,0|1,1,0]=4 14853 B12R1.114 CCOc1ncc(cc1N)S[13CH3] 62a_100011433076_200025704644 [0,2,0,0,0,0|1,1,0]=4 14854 B12R1.114 CCOc1ncc(cc1N)S[13CH3] 62a_200025704644_100011433076 [0,2,0,0,0,0|1,1,0]=4 14855 B12R1.114 CCSc1ccc(cc1Br)C#N 62a_100000210202_100012356348 [0,2,0,0,0,0|1,1,0]=4 14856 B12R1.114 CCSc1ccc(cc1Br)CC 62a_100000210202_200009997437 [0,2,0,0,0,0|1,1,0]=4 14857 B12R1.114 CCSc1ccc(cc1Br)CC 62a_200009997437_100000210202 [0,2,0,0,0,0|1,1,0]=4 14858 B12R1.114 CCSc1ccc(cc1Br)OC 62a_100000210202_100012349170 [0,2,0,0,0,0|0,1,0]=3 14859 B12R1.114 CCSc1ccc(cc1Br)OC 62a_100012349170_100000210202 [0,2,0,0,0,0|0,1,0]=3 14860 B12R1.114 CCSc1ccc(cc1C)C#N 62a_100000210202_100000212329 [0,2,0,0,0,0|1,1,0]=4 14861 B12R1.114 CCSc1ccc(cc1C)C=O 62a_100000210202_100000765772 [0,2,0,0,0,0|0,1,1]=4 14862 B12R1.114 CCSc1ccc(cc1C)C=O 62a_100000765772_100000210202 [0,2,0,0,0,0|0,1,1]=4 14863 B12R1.114 CCSc1ccc(cc1C)CN 62a_100000210202_100015205234 [0,2,0,0,0,0|1,1,0]=4 14864 B12R1.114 CCSc1ccc(cc1C)CN 62a_100015205234_100000210202 [0,2,0,0,0,0|1,1,0]=4 14865 B12R1.114 CCSc1ccc(cc1C)CO 62a_100000210202_100000718852 [0,2,0,0,0,0|0,1,0]=3 14866 B12R1.114 CCSc1ccc(cc1C)CO 62a_100000718852_100000210202 [0,2,0,0,0,0|0,1,0]=3 14867 B12R1.114 CCSc1ccc(cc1C)NC 62a_100000210202_100102888905 [0,2,0,0,0,0|1,1,0]=4 14868 B12R1.114 CCSc1ccc(cc1C)NC 62a_100102888905_100000210202 [0,2,0,0,0,0|1,1,0]=4 14869 B12R1.114 CCSc1ccc(cc1C)NN 62a_100000210202_100000745493 [0,2,0,0,0,0|1,1,0]=4 14870 B12R1.114 CCSc1ccc(cc1C)NN 62a_100000745493_100000210202 [0,2,0,0,0,0|1,1,0]=4 14871 B12R1.114 CCSc1ccc(cc1C)OC 62a_100000210202_100000759875 [0,2,0,0,0,0|0,1,0]=3 14872 B12R1.114 CCSc1ccc(cc1C)OC 62a_100000759875_100000210202 [0,2,0,0,0,0|0,1,0]=3 14873 B12R1.114 CCSc1ccc(cc1Cl)C#N 62a_100000210202_100012349663 [0,2,0,0,0,0|1,1,0]=4 14874 B12R1.114 CCSc1ccc(cc1Cl)CO 62a_100000210202_100000718186 [0,2,0,0,0,0|0,1,0]=3 14875 B12R1.114 CCSc1ccc(cc1Cl)CO 62a_100000718186_100000210202 [0,2,0,0,0,0|0,1,0]=3 14876 B12R1.114 CCSc1ccc(cc1F)C#N 62a_100000210202_100000050172 [0,2,0,0,0,0|1,1,0]=4 14877 B12R1.114 CCSc1ccc(cc1F)C=O 62a_100000210202_100000686674 [0,2,0,0,0,0|0,1,1]=4 14878 B12R1.114 CCSc1ccc(cc1F)C=O 62a_100000686674_100000210202 [0,2,0,0,0,0|0,1,1]=4 14879 B12R1.114 CCSc1ccc(cc1F)CC 62a_100000210202_200010339503 [0,2,0,0,0,0|1,1,0]=4 14880 B12R1.114 CCSc1ccc(cc1F)CC 62a_200010339503_100000210202 [0,2,0,0,0,0|1,1,0]=4 14881 B12R1.114 CCSc1ccc(cc1F)CN 62a_100000210202_100000755036 [0,2,0,0,0,0|1,1,0]=4 14882 B12R1.114 CCSc1ccc(cc1F)CN 62a_100000755036_100000210202 [0,2,0,0,0,0|1,1,0]=4 14883 B12R1.114 CCSc1ccc(cc1F)CO 62a_100000210202_100011533735 [0,2,0,0,0,0|0,1,0]=3 14884 B12R1.114 CCSc1ccc(cc1F)CO 62a_100011533735_100000210202 [0,2,0,0,0,0|0,1,0]=3 14885 B12R1.114 CCSc1ccc(cc1F)NC 62a_100000210202_100012285320 [0,2,0,0,0,0|1,1,0]=4 14886 B12R1.114 CCSc1ccc(cc1F)NC 62a_100012285320_100000210202 [0,2,0,0,0,0|1,1,0]=4 14887 B12R1.114 CCSc1ccc(cc1F)NN 62a_100000210202_100016992936 [0,2,0,0,0,0|1,1,0]=4 14888 B12R1.114 CCSc1ccc(cc1F)NN 62a_100016992936_100000210202 [0,2,0,0,0,0|1,1,0]=4 14889 B12R1.114 CCSc1ccc(cc1F)OC 62a_100000210202_100000753793 [0,2,0,0,0,0|0,1,0]=3 14890 B12R1.114 CCSc1ccc(cc1F)OC 62a_100000753793_100000210202 [0,2,0,0,0,0|0,1,0]=3 14891 B12R1.114 CCSc1ccc(cc1F)SC 62a_100000210202_100009816902 [0,2,0,0,0,0|0,2,0]=4 14892 B12R1.114 CCSc1ccc(cc1F)SC 62a_100009816902_100000210202 [0,2,0,0,0,0|0,2,0]=4 14893 B12R1.114 CCSc1ccc(cc1N)C#N 62a_100000210202_100012001879 [0,2,0,0,0,0|1,1,0]=4 14894 B12R1.114 CCSc1ccc(cc1N)CO 62a_100000210202_100012347568 [0,2,0,0,0,0|0,1,0]=3 14895 B12R1.114 CCSc1ccc(cc1N)CO 62a_100012347568_100000210202 [0,2,0,0,0,0|0,1,0]=3 14896 B12R1.114 CCSc1ccc(cc1N)OC 62a_100000210202_100000748021 [0,2,0,0,0,0|0,1,0]=3 14897 B12R1.114 CCSc1ccc(cc1N)OC 62a_100000748021_100000210202 [0,2,0,0,0,0|0,1,0]=3 14898 B12R1.114 CCSc1ccc(cc1O)C#N 62a_100000210202_100009877741 [0,2,0,0,0,0|1,1,0]=4 14899 B12R1.114 CCSc1ccc(cc1O)C=O 62a_100000041418_100000210202 [0,2,0,0,0,0|0,1,1]=4 14900 B12R1.114 CCSc1ccc(cc1O)C=O 62a_100000210202_100000041418 [0,2,0,0,0,0|0,1,1]=4 14901 B12R1.114 CCSc1ccc(cc1O)CO 62a_100000049605_100000210202 [0,2,0,0,0,0|0,1,0]=3 14902 B12R1.114 CCSc1ccc(cc1O)CO 62a_100000210202_100000049605 [0,2,0,0,0,0|0,1,0]=3 14903 B12R1.114 CCSc1ccc(cc1O)OC 62a_100000210202_100000719091 [0,2,0,0,0,0|0,1,0]=3 14904 B12R1.114 CCSc1ccc(nc1C)CO 62a_100000210202_100010114280 [0,2,0,0,0,0|1,1,0]=4 14905 B12R1.114 CCSc1ccc(nc1C)CO 62a_100010114280_100000210202 [0,2,0,0,0,0|1,1,0]=4 14906 B12R1.114 CCSc1ccc(nc1C)OC 62a_100000210202_100000766551 [0,2,0,0,0,0|1,1,0]=4 14907 B12R1.114 CCSc1ccc(nc1C)OC 62a_100000766551_100000210202 [0,2,0,0,0,0|1,1,0]=4 14908 B12R1.114 CCSc1ccc(nc1F)OC 62a_100000210202_100010067559 [0,2,0,0,0,0|1,1,0]=4 14909 B12R1.114 CCSc1ccc(nc1F)OC 62a_100010067559_100000210202 [0,2,0,0,0,0|1,1,0]=4 14910 B12R1.114 CCSc1ccc(nc1N)OC 62a_100010187629_100000210202 [0,2,0,0,0,0|1,1,0]=4 14911 B12R1.114 CCSc1cnc(cc1C)CO 62a_100000210202_200010713146 [0,2,0,0,0,0|1,1,0]=4 14912 B12R1.114 CCSc1cnc(cc1C)CO 62a_200010713146_100000210202 [0,2,0,0,0,0|1,1,0]=4 14913 B12R1.114 CCSc1cnc(cc1C)OC 62a_100000210202_100011934368 [0,2,0,0,0,0|1,1,0]=4 14914 B12R1.114 CCSc1cnc(cc1C)OC 62a_100011934368_100000210202 [0,2,0,0,0,0|1,1,0]=4 14915 B12R1.114 CCSc1cnc(cc1F)OC 62a_100000210202_100010136277 [0,2,0,0,0,0|1,1,0]=4 14916 B12R1.114 CCSc1cnc(cc1F)OC 62a_100010136277_100000210202 [0,2,0,0,0,0|1,1,0]=4 14917 B12R1.114 CCSc1cnc(cc1N)OC 62a_100000210202_100010254562 [0,2,0,0,0,0|1,1,0]=4 14918 B12R1.114 CCSc1cnc(cc1N)OC 62a_100010254562_100000210202 [0,2,0,0,0,0|1,1,0]=4 14919 B12R1.114 CCSc1cnc(cc1O)OC 62a_100000210202_100010738159 [0,2,0,0,0,0|1,1,0]=4 14920 B12R1.114 CCSc1cnc(cc1O)OC 62a_100010738159_100000210202 [0,2,0,0,0,0|1,1,0]=4 14921 B12R1.114 CCSc1ncc(cc1C)CO 62a_100000210202_200000092119 [0,2,0,0,0,0|1,1,0]=4 14922 B12R1.114 CCSc1ncc(cc1C)CO 62a_200000092119_100000210202 [0,2,0,0,0,0|1,1,0]=4 14923 B12R1.114 CCSc1ncc(cc1C)OC 62a_100000210202_200009851512 [0,2,0,0,0,0|1,1,0]=4 14924 B12R1.114 CCSc1ncc(cc1F)CO 62a_100000210202_100010065243 [0,2,0,0,0,0|1,1,0]=4 14925 B12R1.114 CCSc1ncc(cc1F)CO 62a_100010065243_100000210202 [0,2,0,0,0,0|1,1,0]=4 14926 B12R1.114 CCSc1ncc(cc1N)OC 62a_100000210202_100010074831 [0,2,0,0,0,0|1,1,0]=4 14927 B12R1.114 CCSc1ncc(cc1N)OC 62a_100010074831_100000210202 [0,2,0,0,0,0|1,1,0]=4 14928 B12R1.114 CCc1ccc(c(c1)Br)OCF 34a_100012339963_100015361967 [0,2,0,0,0,0|2,0,0]=4 14929 B12R1.114 CCc1ccc(c(c1)Br)OCF 7a_100012339963_100015361967 [0,2,0,0,0,0|2,0,0]=4 14930 B12R1.114 CCc1ccc(c(c1)N)OCF 34a_100000765835_100015361967 [0,2,0,0,0,0|2,0,0]=4 14931 B12R1.114 CCc1ccc(c(c1)N)OCF 7a_100000765835_100015361967 [0,2,0,0,0,0|2,0,0]=4 14932 B12R1.114 CNCc1ccc(cc1Br)CO 26a_100102657272_100011191544 [0,2,0,0,0,0|2,0,0]=4 14933 B12R1.114 CNCc1ccc(cc1Br)OC 207a_100102657272_100000723261 [0,2,0,0,0,0|2,0,0]=4 14934 B12R1.114 CNCc1ccc(cc1Br)OC 2230a_106832991635_100011982828 [0,2,0,0,0,0|2,0,0]=4 14935 B12R1.114 CNCc1ccc(cc1Br)OC 26a_100102657272_100000685887 [0,2,0,0,0,0|2,0,0]=4 14936 B12R1.114 CNCc1ccc(cc1Br)OC 270004a_106832991635_100000723261 [0,2,0,0,0,0|2,0,0]=4 14937 B12R1.114 CNCc1ccc(cc1Br)OC 34a_100102657272_100011982828 [0,2,0,0,0,0|2,0,0]=4 14938 B12R1.114 CNCc1ccc(cc1Br)OC 7a_106832991635_100011982828 [0,2,0,0,0,0|2,0,0]=4 14939 B12R1.114 CNCc1ccc(cc1C)CO 207a_100102657272_100015695768 [0,2,0,0,0,0|2,0,0]=4 14940 B12R1.114 CNCc1ccc(cc1C)CO 270004a_106832991635_100015695768 [0,2,0,0,0,0|2,0,0]=4 14941 B12R1.114 CNCc1ccc(cc1C)OC 207a_100102657272_100011214997 [0,2,0,0,0,0|2,0,0]=4 14942 B12R1.114 CNCc1ccc(cc1C)OC 270004a_106832991635_100011214997 [0,2,0,0,0,0|2,0,0]=4 14943 B12R1.114 CNCc1ccc(cc1Cl)OC 207a_100102657272_100000235372 [0,2,0,0,0,0|2,0,0]=4 14944 B12R1.114 CNCc1ccc(cc1Cl)OC 2230a_106832991635_200011830453 [0,2,0,0,0,0|2,0,0]=4 14945 B12R1.114 CNCc1ccc(cc1Cl)OC 26a_100102657272_100000038596 [0,2,0,0,0,0|2,0,0]=4 14946 B12R1.114 CNCc1ccc(cc1Cl)OC 270004a_106832991635_100000235372 [0,2,0,0,0,0|2,0,0]=4 14947 B12R1.114 CNCc1ccc(cc1Cl)OC 34a_100102657272_200011830453 [0,2,0,0,0,0|2,0,0]=4 14948 B12R1.114 CNCc1ccc(cc1Cl)OC 34a_100138410423_200000210301 [0,2,0,0,0,0|2,0,0]=4 14949 B12R1.114 CNCc1ccc(cc1Cl)OC 7a_106832991635_200011830453 [0,2,0,0,0,0|2,0,0]=4 14950 B12R1.114 CNCc1ccc(cc1F)OC 207a_100102657272_100011216087 [0,2,0,0,0,0|2,0,0]=4 14951 B12R1.114 CNCc1ccc(cc1F)OC 2230a_106832991635_100011260761 [0,2,0,0,0,0|2,0,0]=4 14952 B12R1.114 CNCc1ccc(cc1F)OC 26a_100102657272_100000036999 [0,2,0,0,0,0|2,0,0]=4 14953 B12R1.114 CNCc1ccc(cc1F)OC 270004a_106832991635_100011216087 [0,2,0,0,0,0|2,0,0]=4 14954 B12R1.114 CNCc1ccc(cc1F)OC 34a_100000687396_200000210301 [0,2,0,0,0,0|2,0,0]=4 14955 B12R1.114 CNCc1ccc(cc1F)OC 34a_100102657272_100011260761 [0,2,0,0,0,0|2,0,0]=4 14956 B12R1.114 CNCc1ccc(cc1F)OC 7a_106832991635_100011260761 [0,2,0,0,0,0|2,0,0]=4 14957 B12R1.114 CNCc1ccc(cc1I)OC 207a_100102657272_100010159643 [0,2,0,0,0,0|2,0,0]=4 14958 B12R1.114 CNCc1ccc(cc1I)OC 270004a_106832991635_100010159643 [0,2,0,0,0,0|2,0,0]=4 14959 B12R1.114 COCc1ccc(cc1Br)OC 34a_100011982768_200000210301 [0,2,0,0,0,0|2,0,0]=4 14960 B12R1.114 COCc1ccc(cc1Br)OC 34a_100138415774_100011982828 [0,2,0,0,0,0|2,0,0]=4 14961 B12R1.114 COCc1ccc(cc1Br)OC 7a_100011982768_200000210301 [0,2,0,0,0,0|2,0,0]=4 14962 B12R1.114 COCc1ccc(cc1Cl)OC 34a_100011982767_200000210301 [0,2,0,0,0,0|2,0,0]=4 14963 B12R1.114 COCc1ccc(cc1Cl)OC 34a_100138415774_200011830453 [0,2,0,0,0,0|2,0,0]=4 14964 B12R1.114 COCc1ccc(cc1Cl)OC 7a_100011982767_200000210301 [0,2,0,0,0,0|2,0,0]=4 14965 B12R1.114 COCc1ccc(cc1F)OC 34a_100011830421_200000210301 [0,2,0,0,0,0|2,0,0]=4 14966 B12R1.114 COCc1ccc(cc1F)OC 34a_100138415774_100011260761 [0,2,0,0,0,0|2,0,0]=4 14967 B12R1.114 COCc1ccc(cc1F)OC 7a_100011830421_200000210301 [0,2,0,0,0,0|2,0,0]=4 14968 B12R1.114 COCc1ccc(cc1N)OC 34a_100011998734_200000210301 [0,2,0,0,0,0|2,0,0]=4 14969 B12R1.114 COc1ccc(c(c1)Br)CO[13CH3] 34a_100011982768_200025704644 [0,2,0,0,0,0|2,0,0]=4 14970 B12R1.114 COc1ccc(c(c1)Br)CO[13CH3] 7a_100011982768_200025704644 [0,2,0,0,0,0|2,0,0]=4 14971 B12R1.114 COc1ccc(c(c1)Br)CSC 62a_100011982828_200000210301 [0,2,0,0,0,0|2,0,0]=4 14972 B12R1.114 COc1ccc(c(c1)Br)CSC 62a_200000210301_100011982828 [0,2,0,0,0,0|2,0,0]=4 14973 B12R1.114 COc1ccc(c(c1)Br)CS[13CH3] 62a_100011982828_200025704644 [0,2,0,0,0,0|2,0,0]=4 14974 B12R1.114 COc1ccc(c(c1)Br)CS[13CH3] 62a_200025704644_100011982828 [0,2,0,0,0,0|2,0,0]=4 14975 B12R1.114 COc1ccc(c(c1)Br)NCF 34a_100015195136_100015361967 [0,2,0,0,0,0|2,0,0]=4 14976 B12R1.114 COc1ccc(c(c1)Br)OCF 34a_100000685887_100015361967 [0,2,0,0,0,0|1,0,0]=3 14977 B12R1.114 COc1ccc(c(c1)Br)OCF 7a_100000685887_100015361967 [0,2,0,0,0,0|1,0,0]=3 14978 B12R1.114 COc1ccc(c(c1)Br)SCF 62a_100012349170_100015361967 [0,2,0,0,0,0|1,1,0]=4 14979 B12R1.114 COc1ccc(c(c1)Br)SCF 62a_100015361967_100012349170 [0,2,0,0,0,0|1,1,0]=4 14980 B12R1.114 COc1ccc(c(c1)C)NCF 34a_100000750285_100015361967 [0,2,0,0,0,0|2,0,0]=4 14981 B12R1.114 COc1ccc(c(c1)C)OCF 34a_100012002223_100015361967 [0,2,0,0,0,0|1,0,0]=3 14982 B12R1.114 COc1ccc(c(c1)C)OCF 7a_100012002223_100015361967 [0,2,0,0,0,0|1,0,0]=3 14983 B12R1.114 COc1ccc(c(c1)C)SCF 62a_100000759875_100015361967 [0,2,0,0,0,0|1,1,0]=4 14984 B12R1.114 COc1ccc(c(c1)C)SCF 62a_100015361967_100000759875 [0,2,0,0,0,0|1,1,0]=4 14985 B12R1.114 COc1ccc(c(c1)Cl)CN[13CH3] 34a_100138410423_200025704644 [0,2,0,0,0,0|2,0,0]=4 14986 B12R1.114 COc1ccc(c(c1)Cl)CO[13CH3] 34a_100011982767_200025704644 [0,2,0,0,0,0|2,0,0]=4 14987 B12R1.114 COc1ccc(c(c1)Cl)CO[13CH3] 7a_100011982767_200025704644 [0,2,0,0,0,0|2,0,0]=4 14988 B12R1.114 COc1ccc(c(c1)Cl)CSC 62a_200000210301_200011830453 [0,2,0,0,0,0|2,0,0]=4 14989 B12R1.114 COc1ccc(c(c1)Cl)CSC 62a_200011830453_200000210301 [0,2,0,0,0,0|2,0,0]=4 14990 B12R1.114 COc1ccc(c(c1)Cl)CS[13CH3] 62a_200011830453_200025704644 [0,2,0,0,0,0|2,0,0]=4 14991 B12R1.114 COc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_200011830453 [0,2,0,0,0,0|2,0,0]=4 14992 B12R1.114 COc1ccc(c(c1)Cl)NCF 34a_100000747055_100015361967 [0,2,0,0,0,0|2,0,0]=4 14993 B12R1.114 COc1ccc(c(c1)Cl)OCF 34a_100000038596_100015361967 [0,2,0,0,0,0|1,0,0]=3 14994 B12R1.114 COc1ccc(c(c1)Cl)OCF 7a_100000038596_100015361967 [0,2,0,0,0,0|1,0,0]=3 14995 B12R1.114 COc1ccc(c(c1)F)CN[13CH3] 34a_100000687396_200025704644 [0,2,0,0,0,0|2,0,0]=4 14996 B12R1.114 COc1ccc(c(c1)F)CO[13CH3] 34a_100011830421_200025704644 [0,2,0,0,0,0|2,0,0]=4 14997 B12R1.114 COc1ccc(c(c1)F)CO[13CH3] 7a_100011830421_200025704644 [0,2,0,0,0,0|2,0,0]=4 14998 B12R1.114 COc1ccc(c(c1)F)CSC 62a_100011260761_200000210301 [0,2,0,0,0,0|2,0,0]=4 14999 B12R1.114 COc1ccc(c(c1)F)CSC 62a_200000210301_100011260761 [0,2,0,0,0,0|2,0,0]=4 15000 B12R1.114 COc1ccc(c(c1)F)CS[13CH3] 62a_100011260761_200025704644 [0,2,0,0,0,0|2,0,0]=4 15001 B12R1.114 COc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011260761 [0,2,0,0,0,0|2,0,0]=4 15002 B12R1.114 COc1ccc(c(c1)F)NCF 34a_100011299463_100015361967 [0,2,0,0,0,0|2,0,0]=4 15003 B12R1.114 COc1ccc(c(c1)F)OCF 34a_100000036999_100015361967 [0,2,0,0,0,0|1,0,0]=3 15004 B12R1.114 COc1ccc(c(c1)F)OCF 7a_100000036999_100015361967 [0,2,0,0,0,0|1,0,0]=3 15005 B12R1.114 COc1ccc(c(c1)F)SCF 62a_100000753793_100015361967 [0,2,0,0,0,0|1,1,0]=4 15006 B12R1.114 COc1ccc(c(c1)F)SCF 62a_100015361967_100000753793 [0,2,0,0,0,0|1,1,0]=4 15007 B12R1.114 COc1ccc(c(c1)I)NCF 34a_100000049804_100015361967 [0,2,0,0,0,0|2,0,0]=4 15008 B12R1.114 COc1ccc(c(c1)N)CO[13CH3] 34a_100011998734_200025704644 [0,2,0,0,0,0|2,0,0]=4 15009 B12R1.114 COc1ccc(c(c1)N)OCF 34a_100000188146_100015361967 [0,2,0,0,0,0|1,0,0]=3 15010 B12R1.114 COc1ccc(c(c1)N)SCF 62a_100000748021_100015361967 [0,2,0,0,0,0|1,1,0]=4 15011 B12R1.114 COc1ccc(c(c1)N)SCF 62a_100015361967_100000748021 [0,2,0,0,0,0|1,1,0]=4 15012 B12R1.114 COc1ccc(c(c1)O)NCF 34a_100016989039_100015361967 [0,2,0,0,0,0|2,0,0]=4 15013 B12R1.114 COc1ccc(c(c1)O)SCF 62a_100015361967_100000719091 [0,2,0,0,0,0|1,1,0]=4 15014 B12R1.114 COc1ccc(c(n1)C)OCF 34a_200009873766_100015361967 [0,2,0,0,0,0|2,0,0]=4 15015 B12R1.114 Cc1cc(ccc1NCF)CO 34a_200011997030_100015361967 [0,2,0,0,0,0|2,0,0]=4 15016 B12R1.114 Cc1cc(ccc1OCF)C#N 34a_100000749339_100015361967 [0,2,0,0,0,0|2,0,0]=4 15017 B12R1.114 Cc1cc(ccc1OCF)C#N 7a_100000749339_100015361967 [0,2,0,0,0,0|2,0,0]=4 15018 B12R1.114 Cc1cc(ccc1OCF)CO 34a_100000075815_100015361967 [0,2,0,0,0,0|1,0,0]=3 15019 B12R1.114 Cc1cc(ccc1OCF)CO 7a_100000075815_100015361967 [0,2,0,0,0,0|1,0,0]=3 15020 B12R1.114 Cc1cc(ccc1SCF)CO 62a_100000718852_100015361967 [0,2,0,0,0,0|1,1,0]=4 15021 B12R1.114 Cc1cc(ccc1SCF)CO 62a_100015361967_100000718852 [0,2,0,0,0,0|1,1,0]=4 15022 B12R1.114 N#Cc1ccc(c(c1)Br)OCF 34a_100011216086_100015361967 [0,2,0,0,0,0|2,0,0]=4 15023 B12R1.114 N#Cc1ccc(c(c1)Br)OCF 7a_100011216086_100015361967 [0,2,0,0,0,0|2,0,0]=4 15024 B12R1.114 N#Cc1ccc(c(c1)Cl)OCF 34a_100000205955_100015361967 [0,2,0,0,0,0|2,0,0]=4 15025 B12R1.114 N#Cc1ccc(c(c1)Cl)OCF 7a_100000205955_100015361967 [0,2,0,0,0,0|2,0,0]=4 15026 B12R1.114 N#Cc1ccc(c(c1)F)OCF 34a_100000751310_100015361967 [0,2,0,0,0,0|2,0,0]=4 15027 B12R1.114 N#Cc1ccc(c(c1)F)OCF 7a_100000751310_100015361967 [0,2,0,0,0,0|2,0,0]=4 15028 B12R1.114 N#Cc1ccc(c(c1)I)OCF 34a_100000725478_100015361967 [0,2,0,0,0,0|2,0,0]=4 15029 B12R1.114 N#Cc1ccc(c(c1)I)OCF 7a_100000725478_100015361967 [0,2,0,0,0,0|2,0,0]=4 15030 B12R1.114 N#Cc1ccc(c(c1)N)OCF 34a_100000766272_100015361967 [0,2,0,0,0,0|2,0,0]=4 15031 B12R1.114 N#Cc1ccc(c(c1)N)OCF 7a_100000766272_100015361967 [0,2,0,0,0,0|2,0,0]=4 15032 B12R1.114 NCc1ccc(c(c1)F)OCF 34a_100000758358_100015361967 [0,2,0,0,0,0|2,0,0]=4 15033 B12R1.114 Nc1cc(ccc1OCF)CO 34a_100000123545_100015361967 [0,2,0,0,0,0|1,0,0]=3 15034 B12R1.114 Nc1cc(ccc1SCF)CO 62a_100012347568_100015361967 [0,2,0,0,0,0|1,1,0]=4 15035 B12R1.114 Nc1cc(ccc1SCF)CO 62a_100015361967_100012347568 [0,2,0,0,0,0|1,1,0]=4 15036 B12R1.114 O=c1cc(occ1OCF)CO 34a_100000211585_100015361967 [0,2,0,0,0,0|2,0,0]=4 15037 B12R1.114 OCc1ccc(c(c1)Br)OCF 34a_100011191544_100015361967 [0,2,0,0,0,0|1,0,0]=3 15038 B12R1.114 OCc1ccc(c(c1)Br)OCF 7a_100011191544_100015361967 [0,2,0,0,0,0|1,0,0]=3 15039 B12R1.114 OCc1ccc(c(c1)Cl)SCF 62a_100000718186_100015361967 [0,2,0,0,0,0|1,1,0]=4 15040 B12R1.114 OCc1ccc(c(c1)Cl)SCF 62a_100015361967_100000718186 [0,2,0,0,0,0|1,1,0]=4 15041 B12R1.114 OCc1ccc(c(c1)F)NCF 34a_100011217239_100015361967 [0,2,0,0,0,0|2,0,0]=4 15042 B12R1.114 OCc1ccc(c(c1)F)SCF 62a_100011533735_100015361967 [0,2,0,0,0,0|1,1,0]=4 15043 B12R1.114 OCc1ccc(c(c1)F)SCF 62a_100015361967_100011533735 [0,2,0,0,0,0|1,1,0]=4 15044 B12R1.114 OCc1ccc(c(c1)O)SCF 62a_100000049605_100015361967 [0,2,0,0,0,0|1,1,0]=4 15045 B12R1.114 OCc1ccc(c(c1)O)SCF 62a_100015361967_100000049605 [0,2,0,0,0,0|1,1,0]=4 15046 B12R1.114 OCc1ccc(c(n1)Br)OCF 34a_200009817064_100015361967 [0,2,0,0,0,0|2,0,0]=4 15047 B12R1.114 OCc1ccc(c(n1)Br)OCF 7a_200009817064_100015361967 [0,2,0,0,0,0|2,0,0]=4 15048 B12R1.114 OCc1ccc(c(n1)Cl)OCF 34a_200000118097_100015361967 [0,2,0,0,0,0|2,0,0]=4 15049 B12R1.114 OCc1ccc(c(n1)Cl)OCF 7a_200000118097_100015361967 [0,2,0,0,0,0|2,0,0]=4 15050 B12R1.544 CC=Cc1ccc(c(c1C)C)O 271570a_100016259895_100012353674 [0,2,0,0,0,0|1,0,1]=4 15051 B12R1.544 CC=Cc1ccc(c(c1C)N)O 271570a_100016259895_100013039247 [0,2,0,0,0,0|1,0,1]=4 15052 B12R1.544 CC=Cc1ccc(c(c1F)C)O 271570a_100016259895_100010390934 [0,2,0,0,0,0|1,0,1]=4 15053 B12R1.544 CC=Cc1ccc(c(c1F)F)O 271570a_100016259895_100011830415 [0,2,0,0,0,0|1,0,1]=4 15054 B12R1.544 CCNc1ccc(c(c1Br)Br)Br 34a_100010151465_100000210202 [0,2,0,0,0,0|2,0,0]=4 15055 B12R1.544 CCNc1ccc(c(c1Br)Cl)Cl 34a_100021501213_100000210202 [0,2,0,0,0,0|2,0,0]=4 15056 B12R1.544 CCNc1ccc(c(c1Br)F)F 2230a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 15057 B12R1.544 CCNc1ccc(c(c1Br)F)F 34a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 15058 B12R1.544 CCNc1ccc(c(c1Br)F)F 7a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 15059 B12R1.544 CCNc1ccc(c(c1Br)F)I 34a_100015781493_100000210202 [0,2,0,0,0,0|2,0,0]=4 15060 B12R1.544 CCNc1ccc(c(c1C)Br)Br 2230a_100010244494_100000210202 [0,2,0,0,0,0|2,0,0]=4 15061 B12R1.544 CCNc1ccc(c(c1C)Br)Br 34a_100010244494_100000210202 [0,2,0,0,0,0|2,0,0]=4 15062 B12R1.544 CCNc1ccc(c(c1C)Br)Br 7a_100010244494_100000210202 [0,2,0,0,0,0|2,0,0]=4 15063 B12R1.544 CCNc1ccc(c(c1C)Br)C 2230a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 15064 B12R1.544 CCNc1ccc(c(c1C)Br)C 34a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 15065 B12R1.544 CCNc1ccc(c(c1C)Br)C 7a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 15066 B12R1.544 CCNc1ccc(c(c1C)Br)Cl 2230a_100016073598_100000210202 [0,2,0,0,0,0|2,0,0]=4 15067 B12R1.544 CCNc1ccc(c(c1C)Br)Cl 34a_100016073598_100000210202 [0,2,0,0,0,0|2,0,0]=4 15068 B12R1.544 CCNc1ccc(c(c1C)Br)Cl 7a_100016073598_100000210202 [0,2,0,0,0,0|2,0,0]=4 15069 B12R1.544 CCNc1ccc(c(c1C)C)Br 2230a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 15070 B12R1.544 CCNc1ccc(c(c1C)C)Br 34a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 15071 B12R1.544 CCNc1ccc(c(c1C)C)Br 7a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 15072 B12R1.544 CCNc1ccc(c(c1C)C)C 2230a_100000116900_100000210202 [0,2,0,0,0,0|2,0,0]=4 15073 B12R1.544 CCNc1ccc(c(c1C)C)C 34a_100000116900_100000210202 [0,2,0,0,0,0|2,0,0]=4 15074 B12R1.544 CCNc1ccc(c(c1C)C)C 7a_100000116900_100000210202 [0,2,0,0,0,0|2,0,0]=4 15075 B12R1.544 CCNc1ccc(c(c1C)C)F 2230a_100000062172_100000210202 [0,2,0,0,0,0|2,0,0]=4 15076 B12R1.544 CCNc1ccc(c(c1C)C)F 34a_100000062172_100000210202 [0,2,0,0,0,0|2,0,0]=4 15077 B12R1.544 CCNc1ccc(c(c1C)C)F 7a_100000062172_100000210202 [0,2,0,0,0,0|2,0,0]=4 15078 B12R1.544 CCNc1ccc(c(c1C)C)O 34a_200011216674_100000210202 [0,2,0,0,0,0|1,0,0]=3 15079 B12R1.544 CCNc1ccc(c(c1C)C)O 7a_200011216674_100000210202 [0,2,0,0,0,0|1,0,0]=3 15080 B12R1.544 CCNc1ccc(c(c1C)Cl)Br 2230a_100009816872_100000210202 [0,2,0,0,0,0|2,0,0]=4 15081 B12R1.544 CCNc1ccc(c(c1C)Cl)Br 34a_100009816872_100000210202 [0,2,0,0,0,0|2,0,0]=4 15082 B12R1.544 CCNc1ccc(c(c1C)Cl)Br 7a_100009816872_100000210202 [0,2,0,0,0,0|2,0,0]=4 15083 B12R1.544 CCNc1ccc(c(c1C)Cl)C 2230a_100009954856_100000210202 [0,2,0,0,0,0|2,0,0]=4 15084 B12R1.544 CCNc1ccc(c(c1C)Cl)C 34a_100009954856_100000210202 [0,2,0,0,0,0|2,0,0]=4 15085 B12R1.544 CCNc1ccc(c(c1C)Cl)C 7a_100009954856_100000210202 [0,2,0,0,0,0|2,0,0]=4 15086 B12R1.544 CCNc1ccc(c(c1C)Cl)Cl 2230a_114948340058_100000210202 [0,2,0,0,0,0|2,0,0]=4 15087 B12R1.544 CCNc1ccc(c(c1C)Cl)Cl 34a_114948340058_100000210202 [0,2,0,0,0,0|2,0,0]=4 15088 B12R1.544 CCNc1ccc(c(c1C)Cl)Cl 7a_114948340058_100000210202 [0,2,0,0,0,0|2,0,0]=4 15089 B12R1.544 CCNc1ccc(c(c1C)F)Br 2230a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 15090 B12R1.544 CCNc1ccc(c(c1C)F)Br 34a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 15091 B12R1.544 CCNc1ccc(c(c1C)F)Br 7a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 15092 B12R1.544 CCNc1ccc(c(c1C)F)I 34a_100010291050_100000210202 [0,2,0,0,0,0|2,0,0]=4 15093 B12R1.544 CCNc1ccc(c(c1C)F)I 7a_100010291050_100000210202 [0,2,0,0,0,0|2,0,0]=4 15094 B12R1.544 CCNc1ccc(c(c1C)I)C 34a_100011170560_100000210202 [0,2,0,0,0,0|2,0,0]=4 15095 B12R1.544 CCNc1ccc(c(c1C)I)C 7a_100011170560_100000210202 [0,2,0,0,0,0|2,0,0]=4 15096 B12R1.544 CCNc1ccc(c(c1Cl)C)Cl 34a_100011935240_100000210202 [0,2,0,0,0,0|2,0,0]=4 15097 B12R1.544 CCNc1ccc(c(c1Cl)C)Cl 7a_100011935240_100000210202 [0,2,0,0,0,0|2,0,0]=4 15098 B12R1.544 CCNc1ccc(c(c1Cl)C)F 2230a_100009863382_100000210202 [0,2,0,0,0,0|2,0,0]=4 15099 B12R1.544 CCNc1ccc(c(c1Cl)C)F 34a_100009863382_100000210202 [0,2,0,0,0,0|2,0,0]=4 15100 B12R1.544 CCNc1ccc(c(c1Cl)C)F 7a_100009863382_100000210202 [0,2,0,0,0,0|2,0,0]=4 15101 B12R1.544 CCNc1ccc(c(c1Cl)Cl)Br 34a_100000701039_100000210202 [0,2,0,0,0,0|2,0,0]=4 15102 B12R1.544 CCNc1ccc(c(c1Cl)Cl)Cl 34a_200000033989_100000210202 [0,2,0,0,0,0|2,0,0]=4 15103 B12R1.544 CCNc1ccc(c(c1Cl)Cl)F 2230a_100000068956_100000210202 [0,2,0,0,0,0|2,0,0]=4 15104 B12R1.544 CCNc1ccc(c(c1Cl)Cl)F 34a_100000068956_100000210202 [0,2,0,0,0,0|2,0,0]=4 15105 B12R1.544 CCNc1ccc(c(c1Cl)Cl)F 7a_100000068956_100000210202 [0,2,0,0,0,0|2,0,0]=4 15106 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000210202 [0,2,0,0,0,0|1,0,0]=3 15107 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000210202 [0,2,0,0,0,0|1,0,0]=3 15108 B12R1.544 CCNc1ccc(c(c1Cl)F)Br 2230a_100010109752_100000210202 [0,2,0,0,0,0|2,0,0]=4 15109 B12R1.544 CCNc1ccc(c(c1Cl)F)Br 34a_100010109752_100000210202 [0,2,0,0,0,0|2,0,0]=4 15110 B12R1.544 CCNc1ccc(c(c1Cl)F)Cl 2230a_100000069711_100000210202 [0,2,0,0,0,0|2,0,0]=4 15111 B12R1.544 CCNc1ccc(c(c1Cl)F)Cl 34a_100000069711_100000210202 [0,2,0,0,0,0|2,0,0]=4 15112 B12R1.544 CCNc1ccc(c(c1Cl)F)Cl 7a_100000069711_100000210202 [0,2,0,0,0,0|2,0,0]=4 15113 B12R1.544 CCNc1ccc(c(c1Cl)F)F 2230a_100000101296_100000210202 [0,2,0,0,0,0|2,0,0]=4 15114 B12R1.544 CCNc1ccc(c(c1Cl)F)F 34a_100000101296_100000210202 [0,2,0,0,0,0|2,0,0]=4 15115 B12R1.544 CCNc1ccc(c(c1Cl)F)F 7a_100000101296_100000210202 [0,2,0,0,0,0|2,0,0]=4 15116 B12R1.544 CCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000210202 [0,2,0,0,0,0|2,0,0]=4 15117 B12R1.544 CCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000210202 [0,2,0,0,0,0|2,0,0]=4 15118 B12R1.544 CCNc1ccc(c(c1F)Br)F 2230a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 15119 B12R1.544 CCNc1ccc(c(c1F)Br)F 34a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 15120 B12R1.544 CCNc1ccc(c(c1F)Br)F 7a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 15121 B12R1.544 CCNc1ccc(c(c1F)C)Br 2230a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 15122 B12R1.544 CCNc1ccc(c(c1F)C)Br 34a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 15123 B12R1.544 CCNc1ccc(c(c1F)C)Br 7a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 15124 B12R1.544 CCNc1ccc(c(c1F)C)F 2230a_102495366501_100000210202 [0,2,0,0,0,0|2,0,0]=4 15125 B12R1.544 CCNc1ccc(c(c1F)C)F 34a_102495366501_100000210202 [0,2,0,0,0,0|2,0,0]=4 15126 B12R1.544 CCNc1ccc(c(c1F)C)F 7a_102495366501_100000210202 [0,2,0,0,0,0|2,0,0]=4 15127 B12R1.544 CCNc1ccc(c(c1F)C)O 34a_200000126710_100000210202 [0,2,0,0,0,0|1,0,0]=3 15128 B12R1.544 CCNc1ccc(c(c1F)C)O 7a_200000126710_100000210202 [0,2,0,0,0,0|1,0,0]=3 15129 B12R1.544 CCNc1ccc(c(c1F)Cl)Br 2230a_100009813730_100000210202 [0,2,0,0,0,0|2,0,0]=4 15130 B12R1.544 CCNc1ccc(c(c1F)Cl)Br 34a_100009813730_100000210202 [0,2,0,0,0,0|2,0,0]=4 15131 B12R1.544 CCNc1ccc(c(c1F)Cl)Cl 2230a_100000036759_100000210202 [0,2,0,0,0,0|2,0,0]=4 15132 B12R1.544 CCNc1ccc(c(c1F)Cl)Cl 34a_100000036759_100000210202 [0,2,0,0,0,0|2,0,0]=4 15133 B12R1.544 CCNc1ccc(c(c1F)Cl)F 2230a_100000038966_100000210202 [0,2,0,0,0,0|2,0,0]=4 15134 B12R1.544 CCNc1ccc(c(c1F)Cl)F 34a_100000038966_100000210202 [0,2,0,0,0,0|2,0,0]=4 15135 B12R1.544 CCNc1ccc(c(c1F)Cl)F 7a_100000038966_100000210202 [0,2,0,0,0,0|2,0,0]=4 15136 B12R1.544 CCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000210202 [0,2,0,0,0,0|1,0,0]=3 15137 B12R1.544 CCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000210202 [0,2,0,0,0,0|1,0,0]=3 15138 B12R1.544 CCNc1ccc(c(c1F)F)Br 2230a_100010200256_100000210202 [0,2,0,0,0,0|2,0,0]=4 15139 B12R1.544 CCNc1ccc(c(c1F)F)Br 34a_100010200256_100000210202 [0,2,0,0,0,0|2,0,0]=4 15140 B12R1.544 CCNc1ccc(c(c1F)F)C 2230a_100000062217_100000210202 [0,2,0,0,0,0|2,0,0]=4 15141 B12R1.544 CCNc1ccc(c(c1F)F)C 34a_100000062217_100000210202 [0,2,0,0,0,0|2,0,0]=4 15142 B12R1.544 CCNc1ccc(c(c1F)F)C 7a_100000062217_100000210202 [0,2,0,0,0,0|2,0,0]=4 15143 B12R1.544 CCNc1ccc(c(c1F)F)Cl 2230a_100000088996_100000210202 [0,2,0,0,0,0|2,0,0]=4 15144 B12R1.544 CCNc1ccc(c(c1F)F)Cl 34a_100000088996_100000210202 [0,2,0,0,0,0|2,0,0]=4 15145 B12R1.544 CCNc1ccc(c(c1F)F)Cl 7a_100000088996_100000210202 [0,2,0,0,0,0|2,0,0]=4 15146 B12R1.544 CCNc1ccc(c(c1F)F)F 2230a_100000210235_100000210202 [0,2,0,0,0,0|2,0,0]=4 15147 B12R1.544 CCNc1ccc(c(c1F)F)F 34a_100000210235_100000210202 [0,2,0,0,0,0|2,0,0]=4 15148 B12R1.544 CCNc1ccc(c(c1F)F)F 7a_100000210235_100000210202 [0,2,0,0,0,0|2,0,0]=4 15149 B12R1.544 CCNc1ccc(c(c1F)F)I 34a_100010291506_100000210202 [0,2,0,0,0,0|2,0,0]=4 15150 B12R1.544 CCNc1ccc(c(c1F)F)I 7a_100010291506_100000210202 [0,2,0,0,0,0|2,0,0]=4 15151 B12R1.544 CCNc1ccc(c(c1F)F)O 34a_100015204651_100000210202 [0,2,0,0,0,0|1,0,0]=3 15152 B12R1.544 CCNc1ccc(c(c1F)F)O 7a_100015204651_100000210202 [0,2,0,0,0,0|1,0,0]=3 15153 B12R1.544 CCNc1ccc(c(c1F)I)F 34a_100015510717_100000210202 [0,2,0,0,0,0|2,0,0]=4 15154 B12R1.544 CCNc1ccc(c(c1I)Br)F 34a_100020765651_100000210202 [0,2,0,0,0,0|2,0,0]=4 15155 B12R1.544 CCNc1ccc(c(c1I)Cl)Br 34a_200010779962_100000210202 [0,2,0,0,0,0|2,0,0]=4 15156 B12R1.544 CCNc1ccc(c(c1I)Cl)Cl 34a_200011093878_100000210202 [0,2,0,0,0,0|2,0,0]=4 15157 B12R1.544 CCNc1ccc(c(c1I)F)Cl 34a_100010134325_100000210202 [0,2,0,0,0,0|2,0,0]=4 15158 B12R1.544 CCNc1ccc(c(c1O)Br)F 34a_100010128263_100000210202 [0,2,0,0,0,0|2,0,0]=4 15159 B12R1.544 CCNc1ccc(c(c1O)F)F 34a_100015205010_100000210202 [0,2,0,0,0,0|2,0,0]=4 15160 B12R1.544 CCOc1ccc(c(c1C)Br)C 34a_100010659238_100000210202 [0,2,0,0,0,0|1,0,0]=3 15161 B12R1.544 CCOc1ccc(c(c1C)Br)C 7a_100010659238_100000210202 [0,2,0,0,0,0|1,0,0]=3 15162 B12R1.544 CCOc1ccc(c(c1C)C)Br 34a_100012353674_100000210202 [0,2,0,0,0,0|1,0,0]=3 15163 B12R1.544 CCOc1ccc(c(c1C)C)Br 7a_100012353674_100000210202 [0,2,0,0,0,0|1,0,0]=3 15164 B12R1.544 CCOc1ccc(c(c1C)C)F 34a_100009847123_100000210202 [0,2,0,0,0,0|1,0,0]=3 15165 B12R1.544 CCOc1ccc(c(c1C)C)F 7a_100009847123_100000210202 [0,2,0,0,0,0|1,0,0]=3 15166 B12R1.544 CCOc1ccc(c(c1C)C)I 34a_100011356951_100000210202 [0,2,0,0,0,0|1,0,0]=3 15167 B12R1.544 CCOc1ccc(c(c1C)C)I 7a_100011356951_100000210202 [0,2,0,0,0,0|1,0,0]=3 15168 B12R1.544 CCOc1ccc(c(c1C)C)N 34a_200011216674_100000210202 [0,2,0,0,0,0|1,0,0]=3 15169 B12R1.544 CCOc1ccc(c(c1C)C)N 7a_200011216674_100000210202 [0,2,0,0,0,0|1,0,0]=3 15170 B12R1.544 CCOc1ccc(c(c1C)F)Br 34a_100010390934_100000210202 [0,2,0,0,0,0|1,0,0]=3 15171 B12R1.544 CCOc1ccc(c(c1C)F)Br 7a_100010390934_100000210202 [0,2,0,0,0,0|1,0,0]=3 15172 B12R1.544 CCOc1ccc(c(c1C)F)N 34a_200000126710_100000210202 [0,2,0,0,0,0|1,0,0]=3 15173 B12R1.544 CCOc1ccc(c(c1C)F)N 7a_200000126710_100000210202 [0,2,0,0,0,0|1,0,0]=3 15174 B12R1.544 CCOc1ccc(c(c1Cl)C)Br 34a_100021574527_100000210202 [0,2,0,0,0,0|1,0,0]=3 15175 B12R1.544 CCOc1ccc(c(c1Cl)C)Br 7a_100021574527_100000210202 [0,2,0,0,0,0|1,0,0]=3 15176 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Br 34a_100011988769_100000210202 [0,2,0,0,0,0|1,0,0]=3 15177 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Br 7a_100011988769_100000210202 [0,2,0,0,0,0|1,0,0]=3 15178 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Cl 34a_200011215298_100000210202 [0,2,0,0,0,0|1,0,0]=3 15179 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_100000210202 [0,2,0,0,0,0|1,0,0]=3 15180 B12R1.544 CCOc1ccc(c(c1Cl)Cl)N 34a_100012017499_100000210202 [0,2,0,0,0,0|1,0,0]=3 15181 B12R1.544 CCOc1ccc(c(c1Cl)Cl)N 7a_100012017499_100000210202 [0,2,0,0,0,0|1,0,0]=3 15182 B12R1.544 CCOc1ccc(c(c1Cl)F)Br 34a_100010245746_100000210202 [0,2,0,0,0,0|1,0,0]=3 15183 B12R1.544 CCOc1ccc(c(c1Cl)F)Br 7a_100010245746_100000210202 [0,2,0,0,0,0|1,0,0]=3 15184 B12R1.544 CCOc1ccc(c(c1Cl)F)N 34a_200000098347_100000210202 [0,2,0,0,0,0|1,0,0]=3 15185 B12R1.544 CCOc1ccc(c(c1Cl)F)N 7a_200000098347_100000210202 [0,2,0,0,0,0|1,0,0]=3 15186 B12R1.544 CCOc1ccc(c(c1Cl)N)Cl 34a_100016988457_100000210202 [0,2,0,0,0,0|1,0,0]=3 15187 B12R1.544 CCOc1ccc(c(c1Cl)N)Cl 7a_100016988457_100000210202 [0,2,0,0,0,0|1,0,0]=3 15188 B12R1.544 CCOc1ccc(c(c1F)F)Br 34a_100011830415_100000210202 [0,2,0,0,0,0|1,0,0]=3 15189 B12R1.544 CCOc1ccc(c(c1F)F)Br 7a_100011830415_100000210202 [0,2,0,0,0,0|1,0,0]=3 15190 B12R1.544 CCOc1ccc(c(c1F)F)C 34a_100000036877_100000210202 [0,2,0,0,0,0|1,0,0]=3 15191 B12R1.544 CCOc1ccc(c(c1F)F)C 7a_100000036877_100000210202 [0,2,0,0,0,0|1,0,0]=3 15192 B12R1.544 CCOc1ccc(c(c1F)F)F 34a_100000230025_100000210202 [0,2,0,0,0,0|1,0,0]=3 15193 B12R1.544 CCOc1ccc(c(c1F)F)F 7a_100000230025_100000210202 [0,2,0,0,0,0|1,0,0]=3 15194 B12R1.544 CCOc1ccc(c(c1F)F)I 34a_200011356956_100000210202 [0,2,0,0,0,0|1,0,0]=3 15195 B12R1.544 CCOc1ccc(c(c1F)F)I 7a_200011356956_100000210202 [0,2,0,0,0,0|1,0,0]=3 15196 B12R1.544 CCOc1ccc(c(c1F)F)N 34a_100015204651_100000210202 [0,2,0,0,0,0|1,0,0]=3 15197 B12R1.544 CCOc1ccc(c(c1F)F)N 7a_100015204651_100000210202 [0,2,0,0,0,0|1,0,0]=3 15198 B12R1.544 CCOc1ccc(c(c1F)F)O 271570a_203496583355_100010177744 [0,2,0,0,0,0|0,0,0]=2 15199 B12R1.544 CCOc1ccc(c(c1N)C)Br 34a_100013039247_100000210202 [0,2,0,0,0,0|1,0,0]=3 15200 B12R1.544 CCOc1ccc(c(c1N)C)Br 7a_100013039247_100000210202 [0,2,0,0,0,0|1,0,0]=3 15201 B12R1.544 CCOc1ncc(c(c1Br)C)Cl 34a_200010175591_100000210202 [0,2,0,0,0,0|2,0,0]=4 15202 B12R1.544 CCOc1ncc(c(c1C)C)Br 34a_200011099879_100000210202 [0,2,0,0,0,0|2,0,0]=4 15203 B12R1.544 CCOc1ncc(c(c1Cl)Cl)Cl 34a_200010273840_100000210202 [0,2,0,0,0,0|2,0,0]=4 15204 B12R1.544 CCSc1ccc(c(c1C)C)Br 62a_100000210202_200010185626 [0,2,0,0,0,0|1,1,0]=4 15205 B12R1.544 CCSc1ccc(c(c1C)C)Br 62a_200010185626_100000210202 [0,2,0,0,0,0|1,1,0]=4 15206 B12R1.544 CCSc1ccc(c(c1C)C)F 62a_100000210202_100009816033 [0,2,0,0,0,0|1,1,0]=4 15207 B12R1.544 CCSc1ccc(c(c1C)C)F 62a_100009816033_100000210202 [0,2,0,0,0,0|1,1,0]=4 15208 B12R1.544 CCSc1ccc(c(c1C)C)N 62a_100000210202_100009816967 [0,2,0,0,0,0|1,1,0]=4 15209 B12R1.544 CCSc1ccc(c(c1C)C)N 62a_100009816967_100000210202 [0,2,0,0,0,0|1,1,0]=4 15210 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100000210202_100012353674 [0,2,0,0,0,0|0,1,0]=3 15211 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100012353674_100000210202 [0,2,0,0,0,0|0,1,0]=3 15212 B12R1.544 CCSc1ccc(c(c1C)Cl)Br 62a_100000210202_200010212245 [0,2,0,0,0,0|1,1,0]=4 15213 B12R1.544 CCSc1ccc(c(c1C)Cl)Br 62a_200010212245_100000210202 [0,2,0,0,0,0|1,1,0]=4 15214 B12R1.544 CCSc1ccc(c(c1C)F)Br 62a_100000210202_100010208201 [0,2,0,0,0,0|1,1,0]=4 15215 B12R1.544 CCSc1ccc(c(c1C)F)Br 62a_100010208201_100000210202 [0,2,0,0,0,0|1,1,0]=4 15216 B12R1.544 CCSc1ccc(c(c1C)F)F 62a_100000210202_100009815991 [0,2,0,0,0,0|1,1,0]=4 15217 B12R1.544 CCSc1ccc(c(c1C)F)F 62a_100009815991_100000210202 [0,2,0,0,0,0|1,1,0]=4 15218 B12R1.544 CCSc1ccc(c(c1C)F)N 62a_100000210202_100000722916 [0,2,0,0,0,0|1,1,0]=4 15219 B12R1.544 CCSc1ccc(c(c1C)F)N 62a_100000722916_100000210202 [0,2,0,0,0,0|1,1,0]=4 15220 B12R1.544 CCSc1ccc(c(c1C)N)C 62a_100000210202_200010074581 [0,2,0,0,0,0|1,1,0]=4 15221 B12R1.544 CCSc1ccc(c(c1C)N)C 62a_200010074581_100000210202 [0,2,0,0,0,0|1,1,0]=4 15222 B12R1.544 CCSc1ccc(c(c1C)N)F 62a_100000210202_100010588651 [0,2,0,0,0,0|1,1,0]=4 15223 B12R1.544 CCSc1ccc(c(c1C)N)F 62a_100010588651_100000210202 [0,2,0,0,0,0|1,1,0]=4 15224 B12R1.544 CCSc1ccc(c(c1C)N)N 62a_100010009725_100000210202 [0,2,0,0,0,0|1,1,0]=4 15225 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100000210202_100013039247 [0,2,0,0,0,0|0,1,0]=3 15226 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100013039247_100000210202 [0,2,0,0,0,0|0,1,0]=3 15227 B12R1.544 CCSc1ccc(c(c1Cl)C)Br 62a_100000210202_100055076181 [0,2,0,0,0,0|1,1,0]=4 15228 B12R1.544 CCSc1ccc(c(c1Cl)C)Br 62a_100055076181_100000210202 [0,2,0,0,0,0|1,1,0]=4 15229 B12R1.544 CCSc1ccc(c(c1Cl)C)Cl 62a_100000210202_100010730154 [0,2,0,0,0,0|1,1,0]=4 15230 B12R1.544 CCSc1ccc(c(c1Cl)C)Cl 62a_100010730154_100000210202 [0,2,0,0,0,0|1,1,0]=4 15231 B12R1.544 CCSc1ccc(c(c1Cl)Cl)Br 62a_100000210202_200012356690 [0,2,0,0,0,0|1,1,0]=4 15232 B12R1.544 CCSc1ccc(c(c1Cl)Cl)Br 62a_200012356690_100000210202 [0,2,0,0,0,0|1,1,0]=4 15233 B12R1.544 CCSc1ccc(c(c1F)Br)F 62a_100000210202_100010167943 [0,2,0,0,0,0|1,1,0]=4 15234 B12R1.544 CCSc1ccc(c(c1F)Br)F 62a_100010167943_100000210202 [0,2,0,0,0,0|1,1,0]=4 15235 B12R1.544 CCSc1ccc(c(c1F)Br)N 62a_100000210202_100015781493 [0,2,0,0,0,0|1,1,0]=4 15236 B12R1.544 CCSc1ccc(c(c1F)Br)N 62a_100015781493_100000210202 [0,2,0,0,0,0|1,1,0]=4 15237 B12R1.544 CCSc1ccc(c(c1F)C)C 62a_100000210202_200015555822 [0,2,0,0,0,0|1,1,0]=4 15238 B12R1.544 CCSc1ccc(c(c1F)C)C 62a_200015555822_100000210202 [0,2,0,0,0,0|1,1,0]=4 15239 B12R1.544 CCSc1ccc(c(c1F)C)F 62a_100000210202_100009815987 [0,2,0,0,0,0|1,1,0]=4 15240 B12R1.544 CCSc1ccc(c(c1F)C)F 62a_100009815987_100000210202 [0,2,0,0,0,0|1,1,0]=4 15241 B12R1.544 CCSc1ccc(c(c1F)C)N 62a_100000210202_100010208198 [0,2,0,0,0,0|1,1,0]=4 15242 B12R1.544 CCSc1ccc(c(c1F)C)N 62a_100010208198_100000210202 [0,2,0,0,0,0|1,1,0]=4 15243 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100000210202_100010390934 [0,2,0,0,0,0|0,1,0]=3 15244 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100010390934_100000210202 [0,2,0,0,0,0|0,1,0]=3 15245 B12R1.544 CCSc1ccc(c(c1F)Cl)Br 62a_100000210202_100010212236 [0,2,0,0,0,0|1,1,0]=4 15246 B12R1.544 CCSc1ccc(c(c1F)Cl)Br 62a_100010212236_100000210202 [0,2,0,0,0,0|1,1,0]=4 15247 B12R1.544 CCSc1ccc(c(c1F)Cl)F 62a_100000210202_200000038702 [0,2,0,0,0,0|1,1,0]=4 15248 B12R1.544 CCSc1ccc(c(c1F)Cl)F 62a_200000038702_100000210202 [0,2,0,0,0,0|1,1,0]=4 15249 B12R1.544 CCSc1ccc(c(c1F)F)Br 62a_100000210202_100010212264 [0,2,0,0,0,0|1,1,0]=4 15250 B12R1.544 CCSc1ccc(c(c1F)F)Br 62a_100010212264_100000210202 [0,2,0,0,0,0|1,1,0]=4 15251 B12R1.544 CCSc1ccc(c(c1F)F)C 62a_100000210202_100012766498 [0,2,0,0,0,0|1,1,0]=4 15252 B12R1.544 CCSc1ccc(c(c1F)F)C 62a_100012766498_100000210202 [0,2,0,0,0,0|1,1,0]=4 15253 B12R1.544 CCSc1ccc(c(c1F)F)F 62a_100000210202_100000750562 [0,2,0,0,0,0|1,1,0]=4 15254 B12R1.544 CCSc1ccc(c(c1F)F)F 62a_100000750562_100000210202 [0,2,0,0,0,0|1,1,0]=4 15255 B12R1.544 CCSc1ccc(c(c1F)F)N 62a_100000210202_100010200256 [0,2,0,0,0,0|1,1,0]=4 15256 B12R1.544 CCSc1ccc(c(c1F)F)N 62a_100010200256_100000210202 [0,2,0,0,0,0|1,1,0]=4 15257 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100000210202_100011830415 [0,2,0,0,0,0|0,1,0]=3 15258 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100011830415_100000210202 [0,2,0,0,0,0|0,1,0]=3 15259 B12R1.544 CCSc1ccc(c(c1F)N)F 62a_100000210202_100025793129 [0,2,0,0,0,0|1,1,0]=4 15260 B12R1.544 CCSc1ccc(c(c1F)N)F 62a_100025793129_100000210202 [0,2,0,0,0,0|1,1,0]=4 15261 B12R1.544 CCSc1ccc(c(c1F)N)N 62a_100009814308_100000210202 [0,2,0,0,0,0|1,1,0]=4 15262 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_100000210202_200010782288 [0,2,0,0,0,0|1,1,0]=4 15263 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210202 [0,2,0,0,0,0|1,1,0]=4 15264 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100000210202_100010167067 [0,2,0,0,0,0|1,1,0]=4 15265 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100010167067_100000210202 [0,2,0,0,0,0|1,1,0]=4 15266 B12R1.544 CCSc1ccc(c(c1N)C)F 62a_100000210202_100011009917 [0,2,0,0,0,0|1,1,0]=4 15267 B12R1.544 CCSc1ccc(c(c1N)C)F 62a_100011009917_100000210202 [0,2,0,0,0,0|1,1,0]=4 15268 B12R1.544 CCSc1ccc(c(c1N)F)F 62a_100000210202_100010008850 [0,2,0,0,0,0|1,1,0]=4 15269 B12R1.544 CCSc1ccc(c(c1N)F)F 62a_100010008850_100000210202 [0,2,0,0,0,0|1,1,0]=4 15270 B12R1.544 CCSc1ccc(c(c1N)N)F 62a_100011102919_100000210202 [0,2,0,0,0,0|1,1,0]=4 15271 B12R1.544 CCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210202 [0,2,0,0,0,0|1,1,0]=4 15272 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_100000210202_200010391124 [0,2,0,0,0,0|1,1,0]=4 15273 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_200010391124_100000210202 [0,2,0,0,0,0|1,1,0]=4 15274 B12R1.544 CCSc1ccc(c(c1O)F)C 62a_100000210202_100000722096 [0,2,0,0,0,0|1,1,0]=4 15275 B12R1.544 CCSc1ccc(c(c1O)F)C 62a_100000722096_100000210202 [0,2,0,0,0,0|1,1,0]=4 15276 B12R1.544 CCSc1ccc(c(c1O)F)F 62a_100000210202_100010243909 [0,2,0,0,0,0|1,1,0]=4 15277 B12R1.544 CCSc1ccc(c(c1O)F)F 62a_100010243909_100000210202 [0,2,0,0,0,0|1,1,0]=4 15278 B12R1.544 CCSc1cnc(c(c1C)C)O 62a_100000210202_200011099879 [0,2,0,0,0,0|1,1,0]=4 15279 B12R1.544 CCSc1cnc(c(c1C)C)O 62a_200011099879_100000210202 [0,2,0,0,0,0|1,1,0]=4 15280 B12R1.544 Cc1c(ccc(c1C)NCF)O 34a_200011216674_100015361967 [0,2,0,0,0,0|2,0,0]=4 15281 B12R1.544 Cc1c(ccc(c1C)NCF)O 7a_200011216674_100015361967 [0,2,0,0,0,0|2,0,0]=4 15282 B12R1.544 Cc1c(ccc(c1C)OCF)Br 34a_100012353674_100015361967 [0,2,0,0,0,0|2,0,0]=4 15283 B12R1.544 Cc1c(ccc(c1C)OCF)Br 7a_100012353674_100015361967 [0,2,0,0,0,0|2,0,0]=4 15284 B12R1.544 Cc1c(ccc(c1C)OCF)F 34a_100009847123_100015361967 [0,2,0,0,0,0|2,0,0]=4 15285 B12R1.544 Cc1c(ccc(c1C)OCF)F 7a_100009847123_100015361967 [0,2,0,0,0,0|2,0,0]=4 15286 B12R1.544 Cc1c(ccc(c1C)OCF)I 34a_100011356951_100015361967 [0,2,0,0,0,0|2,0,0]=4 15287 B12R1.544 Cc1c(ccc(c1C)OCF)I 7a_100011356951_100015361967 [0,2,0,0,0,0|2,0,0]=4 15288 B12R1.544 Cc1c(ccc(c1C)OCF)N 34a_200011216674_100015361967 [0,2,0,0,0,0|2,0,0]=4 15289 B12R1.544 Cc1c(ccc(c1C)OCF)N 7a_200011216674_100015361967 [0,2,0,0,0,0|2,0,0]=4 15290 B12R1.544 Cc1c(ccc(c1C)SCF)O 62a_100012353674_100015361967 [0,2,0,0,0,0|1,1,0]=4 15291 B12R1.544 Cc1c(ccc(c1C)SCF)O 62a_100015361967_100012353674 [0,2,0,0,0,0|1,1,0]=4 15292 B12R1.544 Cc1c(ccc(c1Cl)OCF)Br 34a_100021574527_100015361967 [0,2,0,0,0,0|2,0,0]=4 15293 B12R1.544 Cc1c(ccc(c1Cl)OCF)Br 7a_100021574527_100015361967 [0,2,0,0,0,0|2,0,0]=4 15294 B12R1.544 Cc1c(ccc(c1F)Br)OCF 34a_100010390934_100015361967 [0,2,0,0,0,0|2,0,0]=4 15295 B12R1.544 Cc1c(ccc(c1F)Br)OCF 7a_100010390934_100015361967 [0,2,0,0,0,0|2,0,0]=4 15296 B12R1.544 Cc1c(ccc(c1F)N)OCF 34a_200000126710_100015361967 [0,2,0,0,0,0|2,0,0]=4 15297 B12R1.544 Cc1c(ccc(c1F)N)OCF 7a_200000126710_100015361967 [0,2,0,0,0,0|2,0,0]=4 15298 B12R1.544 Cc1c(ccc(c1F)NCF)O 34a_200000126710_100015361967 [0,2,0,0,0,0|2,0,0]=4 15299 B12R1.544 Cc1c(ccc(c1F)NCF)O 7a_200000126710_100015361967 [0,2,0,0,0,0|2,0,0]=4 15300 B12R1.544 Cc1c(ccc(c1F)SCF)O 62a_100010390934_100015361967 [0,2,0,0,0,0|1,1,0]=4 15301 B12R1.544 Cc1c(ccc(c1F)SCF)O 62a_100015361967_100010390934 [0,2,0,0,0,0|1,1,0]=4 15302 B12R1.544 Cc1c(ccc(c1N)O)SCF 62a_100013039247_100015361967 [0,2,0,0,0,0|1,1,0]=4 15303 B12R1.544 Cc1c(ccc(c1N)O)SCF 62a_100015361967_100013039247 [0,2,0,0,0,0|1,1,0]=4 15304 B12R1.544 Cc1c(ccc(c1N)OCF)Br 34a_100013039247_100015361967 [0,2,0,0,0,0|2,0,0]=4 15305 B12R1.544 Cc1c(ccc(c1N)OCF)Br 7a_100013039247_100015361967 [0,2,0,0,0,0|2,0,0]=4 15306 B12R1.544 Cc1ccc(c(c1Br)C)OCF 34a_100010659238_100015361967 [0,2,0,0,0,0|2,0,0]=4 15307 B12R1.544 Cc1ccc(c(c1Br)C)OCF 7a_100010659238_100015361967 [0,2,0,0,0,0|2,0,0]=4 15308 B12R1.544 Cc1ccc(c(c1F)F)OCF 34a_100000036877_100015361967 [0,2,0,0,0,0|2,0,0]=4 15309 B12R1.544 Cc1ccc(c(c1F)F)OCF 7a_100000036877_100015361967 [0,2,0,0,0,0|2,0,0]=4 15310 B12R1.544 FCOc1ccc(c(c1Cl)Cl)Br 34a_100011988769_100015361967 [0,2,0,0,0,0|2,0,0]=4 15311 B12R1.544 FCOc1ccc(c(c1Cl)Cl)Br 7a_100011988769_100015361967 [0,2,0,0,0,0|2,0,0]=4 15312 B12R1.544 FCOc1ccc(c(c1Cl)Cl)Cl 34a_200011215298_100015361967 [0,2,0,0,0,0|2,0,0]=4 15313 B12R1.544 FCOc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_100015361967 [0,2,0,0,0,0|2,0,0]=4 15314 B12R1.544 FCOc1ccc(c(c1Cl)F)Br 34a_100010245746_100015361967 [0,2,0,0,0,0|2,0,0]=4 15315 B12R1.544 FCOc1ccc(c(c1Cl)F)Br 7a_100010245746_100015361967 [0,2,0,0,0,0|2,0,0]=4 15316 B12R1.544 FCOc1ccc(c(c1F)F)Br 34a_100011830415_100015361967 [0,2,0,0,0,0|2,0,0]=4 15317 B12R1.544 FCOc1ccc(c(c1F)F)Br 7a_100011830415_100015361967 [0,2,0,0,0,0|2,0,0]=4 15318 B12R1.544 FCOc1ccc(c(c1F)F)F 34a_100000230025_100015361967 [0,2,0,0,0,0|2,0,0]=4 15319 B12R1.544 FCOc1ccc(c(c1F)F)F 7a_100000230025_100015361967 [0,2,0,0,0,0|2,0,0]=4 15320 B12R1.544 FCOc1ccc(c(c1F)F)I 34a_200011356956_100015361967 [0,2,0,0,0,0|2,0,0]=4 15321 B12R1.544 FCOc1ccc(c(c1F)F)I 7a_200011356956_100015361967 [0,2,0,0,0,0|2,0,0]=4 15322 B12R1.544 Nc1c(ccc(c1Cl)OCF)Cl 34a_100016988457_100015361967 [0,2,0,0,0,0|2,0,0]=4 15323 B12R1.544 Nc1c(ccc(c1Cl)OCF)Cl 7a_100016988457_100015361967 [0,2,0,0,0,0|2,0,0]=4 15324 B12R1.544 Nc1ccc(c(c1Cl)Cl)OCF 34a_100012017499_100015361967 [0,2,0,0,0,0|2,0,0]=4 15325 B12R1.544 Nc1ccc(c(c1Cl)Cl)OCF 7a_100012017499_100015361967 [0,2,0,0,0,0|2,0,0]=4 15326 B12R1.544 Nc1ccc(c(c1F)Cl)OCF 34a_200000098347_100015361967 [0,2,0,0,0,0|2,0,0]=4 15327 B12R1.544 Nc1ccc(c(c1F)Cl)OCF 7a_200000098347_100015361967 [0,2,0,0,0,0|2,0,0]=4 15328 B12R1.544 Nc1ccc(c(c1F)F)OCF 34a_100015204651_100015361967 [0,2,0,0,0,0|2,0,0]=4 15329 B12R1.544 Nc1ccc(c(c1F)F)OCF 7a_100015204651_100015361967 [0,2,0,0,0,0|2,0,0]=4 15330 B12R1.544 Oc1ccc(c(c1Cl)Cl)NCF 34a_100012017499_100015361967 [0,2,0,0,0,0|2,0,0]=4 15331 B12R1.544 Oc1ccc(c(c1Cl)Cl)NCF 7a_100012017499_100015361967 [0,2,0,0,0,0|2,0,0]=4 15332 B12R1.544 Oc1ccc(c(c1Cl)F)NCF 34a_200000098347_100015361967 [0,2,0,0,0,0|2,0,0]=4 15333 B12R1.544 Oc1ccc(c(c1Cl)F)NCF 7a_200000098347_100015361967 [0,2,0,0,0,0|2,0,0]=4 15334 B12R1.544 Oc1ccc(c(c1F)F)NCF 34a_100015204651_100015361967 [0,2,0,0,0,0|2,0,0]=4 15335 B12R1.544 Oc1ccc(c(c1F)F)NCF 7a_100015204651_100015361967 [0,2,0,0,0,0|2,0,0]=4 15336 B12R1.544 Oc1ccc(c(c1F)F)SCF 62a_100011830415_100015361967 [0,2,0,0,0,0|1,1,0]=4 15337 B12R1.544 Oc1ccc(c(c1F)F)SCF 62a_100015361967_100011830415 [0,2,0,0,0,0|1,1,0]=4 15338 B12R1.1095 CC=Cc1c(cc(cc1C)O)C 271570a_100016259895_100000243743 [0,2,0,0,0,0|1,0,1]=4 15339 B12R1.1095 CC=Cc1c(cc(cc1F)O)F 271570a_100016259895_100010219129 [0,2,0,0,0,0|1,0,1]=4 15340 B12R1.1095 CC=Cc1c(cc(cc1O)O)O 271570a_100016259895_200010341185 [0,2,0,0,0,0|1,0,1]=4 15341 B12R1.1095 CCNc1c(cc(cc1Br)Br)C 34a_100012047207_100000210202 [0,2,0,0,0,0|2,0,0]=4 15342 B12R1.1095 CCNc1c(cc(cc1Br)Br)C 7a_100012047207_100000210202 [0,2,0,0,0,0|2,0,0]=4 15343 B12R1.1095 CCNc1c(cc(cc1Br)Br)Cl 34a_100011216035_100000210202 [0,2,0,0,0,0|2,0,0]=4 15344 B12R1.1095 CCNc1c(cc(cc1Br)Br)F 34a_100011215609_100000210202 [0,2,0,0,0,0|2,0,0]=4 15345 B12R1.1095 CCNc1c(cc(cc1Br)C)Br 34a_100000184052_100000210202 [0,2,0,0,0,0|2,0,0]=4 15346 B12R1.1095 CCNc1c(cc(cc1Br)C)C 34a_100000688863_100000210202 [0,2,0,0,0,0|2,0,0]=4 15347 B12R1.1095 CCNc1c(cc(cc1Br)C)Cl 34a_100012339639_100000210202 [0,2,0,0,0,0|2,0,0]=4 15348 B12R1.1095 CCNc1c(cc(cc1Br)C)F 34a_100012353694_100000210202 [0,2,0,0,0,0|2,0,0]=4 15349 B12R1.1095 CCNc1c(cc(cc1Br)Cl)Br 34a_100000724118_100000210202 [0,2,0,0,0,0|2,0,0]=4 15350 B12R1.1095 CCNc1c(cc(cc1Br)Cl)C 34a_100012353696_100000210202 [0,2,0,0,0,0|2,0,0]=4 15351 B12R1.1095 CCNc1c(cc(cc1Br)Cl)C 7a_100012353696_100000210202 [0,2,0,0,0,0|2,0,0]=4 15352 B12R1.1095 CCNc1c(cc(cc1Br)Cl)Cl 34a_100011218119_100000210202 [0,2,0,0,0,0|2,0,0]=4 15353 B12R1.1095 CCNc1c(cc(cc1Br)Cl)F 34a_100011217455_100000210202 [0,2,0,0,0,0|2,0,0]=4 15354 B12R1.1095 CCNc1c(cc(cc1Br)F)Br 34a_100000211720_100000210202 [0,2,0,0,0,0|2,0,0]=4 15355 B12R1.1095 CCNc1c(cc(cc1Br)F)C 34a_100011216670_100000210202 [0,2,0,0,0,0|2,0,0]=4 15356 B12R1.1095 CCNc1c(cc(cc1Br)F)C 7a_100011216670_100000210202 [0,2,0,0,0,0|2,0,0]=4 15357 B12R1.1095 CCNc1c(cc(cc1Br)F)Cl 34a_100000694656_100000210202 [0,2,0,0,0,0|2,0,0]=4 15358 B12R1.1095 CCNc1c(cc(cc1Br)F)F 34a_100000211602_100000210202 [0,2,0,0,0,0|2,0,0]=4 15359 B12R1.1095 CCNc1c(cc(cc1C)Br)C 34a_100000737279_100000210202 [0,2,0,0,0,0|2,0,0]=4 15360 B12R1.1095 CCNc1c(cc(cc1C)Br)C 7a_100000737279_100000210202 [0,2,0,0,0,0|2,0,0]=4 15361 B12R1.1095 CCNc1c(cc(cc1C)C)C 34a_100000210045_100000210202 [0,2,0,0,0,0|2,0,0]=4 15362 B12R1.1095 CCNc1c(cc(cc1C)C)C 7a_100000210045_100000210202 [0,2,0,0,0,0|2,0,0]=4 15363 B12R1.1095 CCNc1c(cc(cc1C)Cl)C 34a_100000692879_100000210202 [0,2,0,0,0,0|2,0,0]=4 15364 B12R1.1095 CCNc1c(cc(cc1C)Cl)C 7a_100000692879_100000210202 [0,2,0,0,0,0|2,0,0]=4 15365 B12R1.1095 CCNc1c(cc(cc1C)F)C 34a_100011290887_100000210202 [0,2,0,0,0,0|2,0,0]=4 15366 B12R1.1095 CCNc1c(cc(cc1C)F)C 7a_100011290887_100000210202 [0,2,0,0,0,0|2,0,0]=4 15367 B12R1.1095 CCNc1c(cc(cc1C)I)C 7a_100011356821_100000210202 [0,2,0,0,0,0|2,0,0]=4 15368 B12R1.1095 CCNc1c(cc(cc1C)O)C 34a_100011934200_100000210202 [0,2,0,0,0,0|1,0,0]=3 15369 B12R1.1095 CCNc1c(cc(cc1Cl)Br)C 34a_100000741131_100000210202 [0,2,0,0,0,0|2,0,0]=4 15370 B12R1.1095 CCNc1c(cc(cc1Cl)Br)C 7a_100000741131_100000210202 [0,2,0,0,0,0|2,0,0]=4 15371 B12R1.1095 CCNc1c(cc(cc1Cl)Br)Cl 34a_100000211608_100000210202 [0,2,0,0,0,0|2,0,0]=4 15372 B12R1.1095 CCNc1c(cc(cc1Cl)Br)F 34a_100000725741_100000210202 [0,2,0,0,0,0|2,0,0]=4 15373 B12R1.1095 CCNc1c(cc(cc1Cl)Br)F 7a_100000725741_100000210202 [0,2,0,0,0,0|2,0,0]=4 15374 B12R1.1095 CCNc1c(cc(cc1Cl)C)C 34a_100000211461_100000210202 [0,2,0,0,0,0|2,0,0]=4 15375 B12R1.1095 CCNc1c(cc(cc1Cl)C)C 7a_100000211461_100000210202 [0,2,0,0,0,0|2,0,0]=4 15376 B12R1.1095 CCNc1c(cc(cc1Cl)C)Cl 34a_100011996032_100000210202 [0,2,0,0,0,0|2,0,0]=4 15377 B12R1.1095 CCNc1c(cc(cc1Cl)C)O 34a_100015906060_100000210202 [0,2,0,0,0,0|2,0,0]=4 15378 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)C 34a_100011215104_100000210202 [0,2,0,0,0,0|2,0,0]=4 15379 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)C 7a_100011215104_100000210202 [0,2,0,0,0,0|2,0,0]=4 15380 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)Cl 34a_100000210601_100000210202 [0,2,0,0,0,0|2,0,0]=4 15381 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)F 34a_100000688862_100000210202 [0,2,0,0,0,0|2,0,0]=4 15382 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)F 7a_100000688862_100000210202 [0,2,0,0,0,0|2,0,0]=4 15383 B12R1.1095 CCNc1c(cc(cc1Cl)F)C 34a_100000725997_100000210202 [0,2,0,0,0,0|2,0,0]=4 15384 B12R1.1095 CCNc1c(cc(cc1Cl)F)C 7a_100000725997_100000210202 [0,2,0,0,0,0|2,0,0]=4 15385 B12R1.1095 CCNc1c(cc(cc1Cl)F)Cl 34a_100000688861_100000210202 [0,2,0,0,0,0|2,0,0]=4 15386 B12R1.1095 CCNc1c(cc(cc1Cl)F)F 34a_100000688773_100000210202 [0,2,0,0,0,0|2,0,0]=4 15387 B12R1.1095 CCNc1c(cc(cc1F)Br)C 34a_100000709789_100000210202 [0,2,0,0,0,0|2,0,0]=4 15388 B12R1.1095 CCNc1c(cc(cc1F)Br)C 7a_100000709789_100000210202 [0,2,0,0,0,0|2,0,0]=4 15389 B12R1.1095 CCNc1c(cc(cc1F)Br)F 34a_100000758902_100000210202 [0,2,0,0,0,0|2,0,0]=4 15390 B12R1.1095 CCNc1c(cc(cc1F)Br)F 7a_100000758902_100000210202 [0,2,0,0,0,0|2,0,0]=4 15391 B12R1.1095 CCNc1c(cc(cc1F)Br)O 34a_100015475841_100000210202 [0,2,0,0,0,0|2,0,0]=4 15392 B12R1.1095 CCNc1c(cc(cc1F)Cl)C 34a_100012017672_100000210202 [0,2,0,0,0,0|2,0,0]=4 15393 B12R1.1095 CCNc1c(cc(cc1F)Cl)C 7a_100012017672_100000210202 [0,2,0,0,0,0|2,0,0]=4 15394 B12R1.1095 CCNc1c(cc(cc1F)Cl)F 34a_100000695146_100000210202 [0,2,0,0,0,0|2,0,0]=4 15395 B12R1.1095 CCNc1c(cc(cc1F)Cl)F 7a_100000695146_100000210202 [0,2,0,0,0,0|2,0,0]=4 15396 B12R1.1095 CCNc1c(cc(cc1F)Cl)O 34a_100010883250_100000210202 [0,2,0,0,0,0|2,0,0]=4 15397 B12R1.1095 CCNc1c(cc(cc1F)Cl)O 7a_100010883250_100000210202 [0,2,0,0,0,0|2,0,0]=4 15398 B12R1.1095 CCNc1c(cc(cc1F)F)F 34a_100000760425_100000210202 [0,2,0,0,0,0|2,0,0]=4 15399 B12R1.1095 CCNc1c(cc(cc1F)F)O 34a_100011217947_100000210202 [0,2,0,0,0,0|2,0,0]=4 15400 B12R1.1095 CCNc1c(cc(cc1F)F)O 7a_100011217947_100000210202 [0,2,0,0,0,0|2,0,0]=4 15401 B12R1.1095 CCNc1c(cc(cc1F)I)F 34a_100012353610_100000210202 [0,2,0,0,0,0|2,0,0]=4 15402 B12R1.1095 CCNc1c(cc(cc1F)O)F 34a_100000036573_100000210202 [0,2,0,0,0,0|1,0,0]=3 15403 B12R1.1095 CCNc1c(cc(cc1I)Br)C 7a_200000690823_100000210202 [0,2,0,0,0,0|2,0,0]=4 15404 B12R1.1095 CCNc1c(cc(cc1I)Cl)C 7a_100012344046_100000210202 [0,2,0,0,0,0|2,0,0]=4 15405 B12R1.1095 CCNc1c(cc(cc1I)F)F 34a_100102885649_100000210202 [0,2,0,0,0,0|2,0,0]=4 15406 B12R1.1095 CCNc1c(cc(cc1O)Br)C 34a_100010371313_100000210202 [0,2,0,0,0,0|2,0,0]=4 15407 B12R1.1095 CCNc1c(cc(cc1O)Br)C 7a_100010371313_100000210202 [0,2,0,0,0,0|2,0,0]=4 15408 B12R1.1095 CCOc1c(cc(cc1Br)Br)Br 34a_100000210219_100000210202 [0,2,0,0,0,0|1,0,0]=3 15409 B12R1.1095 CCOc1c(cc(cc1Br)Br)Br 7a_100000210219_100000210202 [0,2,0,0,0,0|1,0,0]=3 15410 B12R1.1095 CCOc1c(cc(cc1Br)Br)C 34a_100000186369_100000210202 [0,2,0,0,0,0|1,0,0]=3 15411 B12R1.1095 CCOc1c(cc(cc1Br)Br)C 7a_100000186369_100000210202 [0,2,0,0,0,0|1,0,0]=3 15412 B12R1.1095 CCOc1c(cc(cc1Br)Br)Cl 34a_100012337755_100000210202 [0,2,0,0,0,0|1,0,0]=3 15413 B12R1.1095 CCOc1c(cc(cc1Br)Br)Cl 7a_100012337755_100000210202 [0,2,0,0,0,0|1,0,0]=3 15414 B12R1.1095 CCOc1c(cc(cc1Br)Br)F 34a_100011216695_100000210202 [0,2,0,0,0,0|1,0,0]=3 15415 B12R1.1095 CCOc1c(cc(cc1Br)Br)F 7a_100011216695_100000210202 [0,2,0,0,0,0|1,0,0]=3 15416 B12R1.1095 CCOc1c(cc(cc1Br)Br)N 34a_100010781877_100000210202 [0,2,0,0,0,0|1,0,0]=3 15417 B12R1.1095 CCOc1c(cc(cc1Br)Br)N 7a_100010781877_100000210202 [0,2,0,0,0,0|1,0,0]=3 15418 B12R1.1095 CCOc1c(cc(cc1Br)C)Br 34a_100000203795_100000210202 [0,2,0,0,0,0|1,0,0]=3 15419 B12R1.1095 CCOc1c(cc(cc1Br)C)Br 7a_100000203795_100000210202 [0,2,0,0,0,0|1,0,0]=3 15420 B12R1.1095 CCOc1c(cc(cc1Br)C)C 34a_100011934984_100000210202 [0,2,0,0,0,0|1,0,0]=3 15421 B12R1.1095 CCOc1c(cc(cc1Br)C)C 7a_100011934984_100000210202 [0,2,0,0,0,0|1,0,0]=3 15422 B12R1.1095 CCOc1c(cc(cc1Br)C)F 34a_200010713133_100000210202 [0,2,0,0,0,0|1,0,0]=3 15423 B12R1.1095 CCOc1c(cc(cc1Br)C)F 7a_200010713133_100000210202 [0,2,0,0,0,0|1,0,0]=3 15424 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Br 34a_100012337757_100000210202 [0,2,0,0,0,0|1,0,0]=3 15425 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Br 7a_100012337757_100000210202 [0,2,0,0,0,0|1,0,0]=3 15426 B12R1.1095 CCOc1c(cc(cc1Br)Cl)C 34a_100012337756_100000210202 [0,2,0,0,0,0|1,0,0]=3 15427 B12R1.1095 CCOc1c(cc(cc1Br)Cl)C 7a_100012337756_100000210202 [0,2,0,0,0,0|1,0,0]=3 15428 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100000210202 [0,2,0,0,0,0|1,0,0]=3 15429 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100000210202 [0,2,0,0,0,0|1,0,0]=3 15430 B12R1.1095 CCOc1c(cc(cc1Br)Cl)F 34a_100011830412_100000210202 [0,2,0,0,0,0|1,0,0]=3 15431 B12R1.1095 CCOc1c(cc(cc1Br)Cl)F 7a_100011830412_100000210202 [0,2,0,0,0,0|1,0,0]=3 15432 B12R1.1095 CCOc1c(cc(cc1Br)Cl)N 34a_106741647128_100000210202 [0,2,0,0,0,0|1,0,0]=3 15433 B12R1.1095 CCOc1c(cc(cc1Br)Cl)N 7a_106741647128_100000210202 [0,2,0,0,0,0|1,0,0]=3 15434 B12R1.1095 CCOc1c(cc(cc1Br)F)Br 34a_100011215434_100000210202 [0,2,0,0,0,0|1,0,0]=3 15435 B12R1.1095 CCOc1c(cc(cc1Br)F)Br 7a_100011215434_100000210202 [0,2,0,0,0,0|1,0,0]=3 15436 B12R1.1095 CCOc1c(cc(cc1Br)F)Cl 34a_100011830411_100000210202 [0,2,0,0,0,0|1,0,0]=3 15437 B12R1.1095 CCOc1c(cc(cc1Br)F)Cl 7a_100011830411_100000210202 [0,2,0,0,0,0|1,0,0]=3 15438 B12R1.1095 CCOc1c(cc(cc1Br)F)F 34a_100000688693_100000210202 [0,2,0,0,0,0|1,0,0]=3 15439 B12R1.1095 CCOc1c(cc(cc1Br)F)F 7a_100000688693_100000210202 [0,2,0,0,0,0|1,0,0]=3 15440 B12R1.1095 CCOc1c(cc(cc1Br)F)N 34a_200011217456_100000210202 [0,2,0,0,0,0|1,0,0]=3 15441 B12R1.1095 CCOc1c(cc(cc1Br)F)N 7a_200011217456_100000210202 [0,2,0,0,0,0|1,0,0]=3 15442 B12R1.1095 CCOc1c(cc(cc1Br)I)C 34a_100010982682_100000210202 [0,2,0,0,0,0|1,0,0]=3 15443 B12R1.1095 CCOc1c(cc(cc1Br)I)C 7a_100010982682_100000210202 [0,2,0,0,0,0|1,0,0]=3 15444 B12R1.1095 CCOc1c(cc(cc1Br)N)Br 34a_200000186426_100000210202 [0,2,0,0,0,0|1,0,0]=3 15445 B12R1.1095 CCOc1c(cc(cc1Br)N)C 34a_100010064301_100000210202 [0,2,0,0,0,0|1,0,0]=3 15446 B12R1.1095 CCOc1c(cc(cc1Br)N)C 7a_100010064301_100000210202 [0,2,0,0,0,0|1,0,0]=3 15447 B12R1.1095 CCOc1c(cc(cc1C)Br)C 34a_100000187306_100000210202 [0,2,0,0,0,0|1,0,0]=3 15448 B12R1.1095 CCOc1c(cc(cc1C)Br)C 7a_100000187306_100000210202 [0,2,0,0,0,0|1,0,0]=3 15449 B12R1.1095 CCOc1c(cc(cc1C)C)C 34a_100000212074_100000210202 [0,2,0,0,0,0|1,0,0]=3 15450 B12R1.1095 CCOc1c(cc(cc1C)C)C 7a_100000212074_100000210202 [0,2,0,0,0,0|1,0,0]=3 15451 B12R1.1095 CCOc1c(cc(cc1C)Cl)C 34a_100000211519_100000210202 [0,2,0,0,0,0|1,0,0]=3 15452 B12R1.1095 CCOc1c(cc(cc1C)Cl)C 7a_100000211519_100000210202 [0,2,0,0,0,0|1,0,0]=3 15453 B12R1.1095 CCOc1c(cc(cc1C)F)C 34a_100000081862_100000210202 [0,2,0,0,0,0|1,0,0]=3 15454 B12R1.1095 CCOc1c(cc(cc1C)F)C 7a_100000081862_100000210202 [0,2,0,0,0,0|1,0,0]=3 15455 B12R1.1095 CCOc1c(cc(cc1C)I)C 34a_100011216129_100000210202 [0,2,0,0,0,0|1,0,0]=3 15456 B12R1.1095 CCOc1c(cc(cc1C)I)C 7a_100011216129_100000210202 [0,2,0,0,0,0|1,0,0]=3 15457 B12R1.1095 CCOc1c(cc(cc1C)N)C 34a_100000703291_100000210202 [0,2,0,0,0,0|1,0,0]=3 15458 B12R1.1095 CCOc1c(cc(cc1C)N)C 7a_100000703291_100000210202 [0,2,0,0,0,0|1,0,0]=3 15459 B12R1.1095 CCOc1c(cc(cc1Cl)Br)C 34a_100000211485_100000210202 [0,2,0,0,0,0|1,0,0]=3 15460 B12R1.1095 CCOc1c(cc(cc1Cl)Br)C 7a_100000211485_100000210202 [0,2,0,0,0,0|1,0,0]=3 15461 B12R1.1095 CCOc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100000210202 [0,2,0,0,0,0|1,0,0]=3 15462 B12R1.1095 CCOc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100000210202 [0,2,0,0,0,0|1,0,0]=3 15463 B12R1.1095 CCOc1c(cc(cc1Cl)Br)F 34a_100011216646_100000210202 [0,2,0,0,0,0|1,0,0]=3 15464 B12R1.1095 CCOc1c(cc(cc1Cl)Br)F 7a_100011216646_100000210202 [0,2,0,0,0,0|1,0,0]=3 15465 B12R1.1095 CCOc1c(cc(cc1Cl)Br)N 34a_100000694353_100000210202 [0,2,0,0,0,0|1,0,0]=3 15466 B12R1.1095 CCOc1c(cc(cc1Cl)Br)N 7a_100000694353_100000210202 [0,2,0,0,0,0|1,0,0]=3 15467 B12R1.1095 CCOc1c(cc(cc1Cl)C)Cl 34a_100000034925_100000210202 [0,2,0,0,0,0|1,0,0]=3 15468 B12R1.1095 CCOc1c(cc(cc1Cl)C)Cl 7a_100000034925_100000210202 [0,2,0,0,0,0|1,0,0]=3 15469 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)C 34a_100011218458_100000210202 [0,2,0,0,0,0|1,0,0]=3 15470 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)C 7a_100011218458_100000210202 [0,2,0,0,0,0|1,0,0]=3 15471 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100000210202 [0,2,0,0,0,0|1,0,0]=3 15472 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100000210202 [0,2,0,0,0,0|1,0,0]=3 15473 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)N 34a_100000695819_100000210202 [0,2,0,0,0,0|1,0,0]=3 15474 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)N 7a_100000695819_100000210202 [0,2,0,0,0,0|1,0,0]=3 15475 B12R1.1095 CCOc1c(cc(cc1Cl)F)Cl 34a_100011217724_100000210202 [0,2,0,0,0,0|1,0,0]=3 15476 B12R1.1095 CCOc1c(cc(cc1Cl)F)Cl 7a_100011217724_100000210202 [0,2,0,0,0,0|1,0,0]=3 15477 B12R1.1095 CCOc1c(cc(cc1Cl)F)F 34a_100011935252_100000210202 [0,2,0,0,0,0|1,0,0]=3 15478 B12R1.1095 CCOc1c(cc(cc1Cl)F)F 7a_100011935252_100000210202 [0,2,0,0,0,0|1,0,0]=3 15479 B12R1.1095 CCOc1c(cc(cc1Cl)F)O 271570a_203496583355_100135264980 [0,2,0,0,0,0|1,0,0]=3 15480 B12R1.1095 CCOc1c(cc(cc1Cl)I)C 34a_200015900153_100000210202 [0,2,0,0,0,0|1,0,0]=3 15481 B12R1.1095 CCOc1c(cc(cc1Cl)I)C 7a_200015900153_100000210202 [0,2,0,0,0,0|1,0,0]=3 15482 B12R1.1095 CCOc1c(cc(cc1Cl)I)Cl 7a_100012339652_100000210202 [0,2,0,0,0,0|1,0,0]=3 15483 B12R1.1095 CCOc1c(cc(cc1Cl)N)Cl 34a_100000695418_100000210202 [0,2,0,0,0,0|1,0,0]=3 15484 B12R1.1095 CCOc1c(cc(cc1Cl)N)Cl 7a_100000695418_100000210202 [0,2,0,0,0,0|1,0,0]=3 15485 B12R1.1095 CCOc1c(cc(cc1F)Br)F 34a_100011216917_100000210202 [0,2,0,0,0,0|1,0,0]=3 15486 B12R1.1095 CCOc1c(cc(cc1F)Br)F 7a_100011216917_100000210202 [0,2,0,0,0,0|1,0,0]=3 15487 B12R1.1095 CCOc1c(cc(cc1F)Br)N 34a_100011217383_100000210202 [0,2,0,0,0,0|1,0,0]=3 15488 B12R1.1095 CCOc1c(cc(cc1F)Br)N 7a_100011217383_100000210202 [0,2,0,0,0,0|1,0,0]=3 15489 B12R1.1095 CCOc1c(cc(cc1F)Cl)F 34a_100011830429_100000210202 [0,2,0,0,0,0|1,0,0]=3 15490 B12R1.1095 CCOc1c(cc(cc1F)Cl)F 7a_100011830429_100000210202 [0,2,0,0,0,0|1,0,0]=3 15491 B12R1.1095 CCOc1c(cc(cc1F)F)F 34a_100011218396_100000210202 [0,2,0,0,0,0|1,0,0]=3 15492 B12R1.1095 CCOc1c(cc(cc1F)F)F 7a_100011218396_100000210202 [0,2,0,0,0,0|1,0,0]=3 15493 B12R1.1095 CCOc1c(cc(cc1F)F)N 34a_100015205836_100000210202 [0,2,0,0,0,0|1,0,0]=3 15494 B12R1.1095 CCOc1c(cc(cc1F)F)N 7a_100015205836_100000210202 [0,2,0,0,0,0|1,0,0]=3 15495 B12R1.1095 CCOc1c(cc(cc1F)I)F 34a_200011830255_100000210202 [0,2,0,0,0,0|1,0,0]=3 15496 B12R1.1095 CCOc1c(cc(cc1F)I)F 7a_200011830255_100000210202 [0,2,0,0,0,0|1,0,0]=3 15497 B12R1.1095 CCOc1c(cc(cc1F)N)F 34a_100016987357_100000210202 [0,2,0,0,0,0|1,0,0]=3 15498 B12R1.1095 CCOc1c(cc(cc1F)N)F 7a_100016987357_100000210202 [0,2,0,0,0,0|1,0,0]=3 15499 B12R1.1095 CCOc1c(cc(cc1F)O)F 271570a_203496583355_200010078527 [0,2,0,0,0,0|0,0,0]=2 15500 B12R1.1095 CCOc1c(cc(cc1I)Br)F 34a_100013354677_100000210202 [0,2,0,0,0,0|1,0,0]=3 15501 B12R1.1095 CCOc1c(cc(cc1I)Br)F 7a_100013354677_100000210202 [0,2,0,0,0,0|1,0,0]=3 15502 B12R1.1095 CCOc1c(cc(cc1I)Br)I 7a_100009997433_100000210202 [0,2,0,0,0,0|1,0,0]=3 15503 B12R1.1095 CCOc1c(cc(cc1I)Br)N 7a_100016071998_100000210202 [0,2,0,0,0,0|1,0,0]=3 15504 B12R1.1095 CCOc1c(cc(cc1I)C)F 34a_200135191068_100000210202 [0,2,0,0,0,0|1,0,0]=3 15505 B12R1.1095 CCOc1c(cc(cc1I)C)F 7a_200135191068_100000210202 [0,2,0,0,0,0|1,0,0]=3 15506 B12R1.1095 CCOc1c(cc(cc1I)Cl)C 34a_100012343667_100000210202 [0,2,0,0,0,0|1,0,0]=3 15507 B12R1.1095 CCOc1c(cc(cc1I)Cl)C 7a_100012343667_100000210202 [0,2,0,0,0,0|1,0,0]=3 15508 B12R1.1095 CCOc1c(cc(cc1I)Cl)Cl 34a_200012339341_100000210202 [0,2,0,0,0,0|1,0,0]=3 15509 B12R1.1095 CCOc1c(cc(cc1I)Cl)Cl 7a_200012339341_100000210202 [0,2,0,0,0,0|1,0,0]=3 15510 B12R1.1095 CCOc1c(cc(cc1I)Cl)I 7a_100000730656_100000210202 [0,2,0,0,0,0|1,0,0]=3 15511 B12R1.1095 CCOc1c(cc(cc1I)F)Br 34a_200013085147_100000210202 [0,2,0,0,0,0|1,0,0]=3 15512 B12R1.1095 CCOc1c(cc(cc1I)F)Br 7a_200013085147_100000210202 [0,2,0,0,0,0|1,0,0]=3 15513 B12R1.1095 CCOc1c(cc(cc1I)F)F 34a_200013204775_100000210202 [0,2,0,0,0,0|1,0,0]=3 15514 B12R1.1095 CCOc1c(cc(cc1I)F)F 7a_200013204775_100000210202 [0,2,0,0,0,0|1,0,0]=3 15515 B12R1.1095 CCOc1c(cc(cc1I)I)Cl 7a_100009997439_100000210202 [0,2,0,0,0,0|1,0,0]=3 15516 B12R1.1095 CCOc1c(cc(cc1I)I)I 7a_100000210296_100000210202 [0,2,0,0,0,0|1,0,0]=3 15517 B12R1.1095 CCOc1c(cc(cc1N)Br)C 34a_100011825904_100000210202 [0,2,0,0,0,0|1,0,0]=3 15518 B12R1.1095 CCOc1c(cc(cc1N)Br)C 7a_100011825904_100000210202 [0,2,0,0,0,0|1,0,0]=3 15519 B12R1.1095 CCOc1c(cc(cc1N)C)C 34a_100011216242_100000210202 [0,2,0,0,0,0|1,0,0]=3 15520 B12R1.1095 CCOc1c(cc(cc1N)C)C 7a_100011216242_100000210202 [0,2,0,0,0,0|1,0,0]=3 15521 B12R1.1095 CCOc1c(cc(cc1N)F)C 34a_100000130126_100000210202 [0,2,0,0,0,0|1,0,0]=3 15522 B12R1.1095 CCOc1c(cc(cc1N)F)C 7a_100000130126_100000210202 [0,2,0,0,0,0|1,0,0]=3 15523 B12R1.1095 CCOc1c(cc(cc1O)F)N 271570a_203496583355_100011190658 [0,2,0,0,0,0|1,0,0]=3 15524 B12R1.1095 CCOc1c(cc(nc1Br)C)Br 34a_200010207325_100000210202 [0,2,0,0,0,0|2,0,0]=4 15525 B12R1.1095 CCOc1c(cc(nc1Br)C)Br 7a_200010207325_100000210202 [0,2,0,0,0,0|2,0,0]=4 15526 B12R1.1095 CCOc1c(cc(nc1Br)F)Br 34a_200015805819_100000210202 [0,2,0,0,0,0|2,0,0]=4 15527 B12R1.1095 CCOc1c(cc(nc1Br)F)Br 7a_200015805819_100000210202 [0,2,0,0,0,0|2,0,0]=4 15528 B12R1.1095 CCOc1c(cc(nc1C)Br)Br 34a_200010233669_100000210202 [0,2,0,0,0,0|2,0,0]=4 15529 B12R1.1095 CCOc1c(cc(nc1C)Br)Br 7a_200010233669_100000210202 [0,2,0,0,0,0|2,0,0]=4 15530 B12R1.1095 CCOc1c(cc(nc1F)Br)Br 34a_200010191512_100000210202 [0,2,0,0,0,0|2,0,0]=4 15531 B12R1.1095 CCOc1c(cc(nc1F)Br)Br 7a_200010191512_100000210202 [0,2,0,0,0,0|2,0,0]=4 15532 B12R1.1095 CCSc1c(cc(cc1Br)Br)Br 62a_100000210202_100011263223 [0,2,0,0,0,0|1,1,0]=4 15533 B12R1.1095 CCSc1c(cc(cc1Br)Br)Br 62a_100011263223_100000210202 [0,2,0,0,0,0|1,1,0]=4 15534 B12R1.1095 CCSc1c(cc(cc1Br)Br)C 62a_100000210202_200010208242 [0,2,0,0,0,0|1,1,0]=4 15535 B12R1.1095 CCSc1c(cc(cc1Br)Br)C 62a_200010208242_100000210202 [0,2,0,0,0,0|1,1,0]=4 15536 B12R1.1095 CCSc1c(cc(cc1Br)Br)F 62a_100000210202_100000708766 [0,2,0,0,0,0|1,1,0]=4 15537 B12R1.1095 CCSc1c(cc(cc1Br)Br)F 62a_100000708766_100000210202 [0,2,0,0,0,0|1,1,0]=4 15538 B12R1.1095 CCSc1c(cc(cc1Br)C)Br 62a_100000210202_200011219743 [0,2,0,0,0,0|1,1,0]=4 15539 B12R1.1095 CCSc1c(cc(cc1Br)C)Br 62a_200011219743_100000210202 [0,2,0,0,0,0|1,1,0]=4 15540 B12R1.1095 CCSc1c(cc(cc1Br)C)C 62a_100000210202_200012353697 [0,2,0,0,0,0|1,1,0]=4 15541 B12R1.1095 CCSc1c(cc(cc1Br)C)C 62a_200012353697_100000210202 [0,2,0,0,0,0|1,1,0]=4 15542 B12R1.1095 CCSc1c(cc(cc1Br)C)F 62a_100000210202_100010208195 [0,2,0,0,0,0|1,1,0]=4 15543 B12R1.1095 CCSc1c(cc(cc1Br)C)F 62a_100010208195_100000210202 [0,2,0,0,0,0|1,1,0]=4 15544 B12R1.1095 CCSc1c(cc(cc1Br)Cl)Cl 62a_100000210202_200009992027 [0,2,0,0,0,0|1,1,0]=4 15545 B12R1.1095 CCSc1c(cc(cc1Br)Cl)Cl 62a_200009992027_100000210202 [0,2,0,0,0,0|1,1,0]=4 15546 B12R1.1095 CCSc1c(cc(cc1Br)Cl)F 62a_100000210202_100009993495 [0,2,0,0,0,0|1,1,0]=4 15547 B12R1.1095 CCSc1c(cc(cc1Br)Cl)F 62a_100009993495_100000210202 [0,2,0,0,0,0|1,1,0]=4 15548 B12R1.1095 CCSc1c(cc(cc1Br)Cl)N 62a_100000210202_100011155807 [0,2,0,0,0,0|1,1,0]=4 15549 B12R1.1095 CCSc1c(cc(cc1Br)Cl)N 62a_100011155807_100000210202 [0,2,0,0,0,0|1,1,0]=4 15550 B12R1.1095 CCSc1c(cc(cc1Br)F)Br 62a_100000210202_100009813983 [0,2,0,0,0,0|1,1,0]=4 15551 B12R1.1095 CCSc1c(cc(cc1Br)F)Br 62a_100009813983_100000210202 [0,2,0,0,0,0|1,1,0]=4 15552 B12R1.1095 CCSc1c(cc(cc1Br)F)C 62a_100000210202_100010208209 [0,2,0,0,0,0|1,1,0]=4 15553 B12R1.1095 CCSc1c(cc(cc1Br)F)C 62a_100010208209_100000210202 [0,2,0,0,0,0|1,1,0]=4 15554 B12R1.1095 CCSc1c(cc(cc1Br)F)Cl 62a_100000210202_100012356682 [0,2,0,0,0,0|1,1,0]=4 15555 B12R1.1095 CCSc1c(cc(cc1Br)F)Cl 62a_100012356682_100000210202 [0,2,0,0,0,0|1,1,0]=4 15556 B12R1.1095 CCSc1c(cc(cc1Br)F)F 62a_100000210202_100000720994 [0,2,0,0,0,0|1,1,0]=4 15557 B12R1.1095 CCSc1c(cc(cc1Br)F)F 62a_100000720994_100000210202 [0,2,0,0,0,0|1,1,0]=4 15558 B12R1.1095 CCSc1c(cc(cc1Br)F)N 62a_100000210202_200010740111 [0,2,0,0,0,0|1,1,0]=4 15559 B12R1.1095 CCSc1c(cc(cc1Br)F)N 62a_200010740111_100000210202 [0,2,0,0,0,0|1,1,0]=4 15560 B12R1.1095 CCSc1c(cc(cc1C)Br)C 62a_100000210202_100009814048 [0,2,0,0,0,0|1,1,0]=4 15561 B12R1.1095 CCSc1c(cc(cc1C)Br)C 62a_100009814048_100000210202 [0,2,0,0,0,0|1,1,0]=4 15562 B12R1.1095 CCSc1c(cc(cc1C)C)C 62a_100000210202_100011204320 [0,2,0,0,0,0|1,1,0]=4 15563 B12R1.1095 CCSc1c(cc(cc1C)C)C 62a_100011204320_100000210202 [0,2,0,0,0,0|1,1,0]=4 15564 B12R1.1095 CCSc1c(cc(cc1C)Cl)C 62a_100000210202_100010244930 [0,2,0,0,0,0|1,1,0]=4 15565 B12R1.1095 CCSc1c(cc(cc1C)Cl)C 62a_100010244930_100000210202 [0,2,0,0,0,0|1,1,0]=4 15566 B12R1.1095 CCSc1c(cc(cc1C)F)C 62a_100000210202_100012356666 [0,2,0,0,0,0|1,1,0]=4 15567 B12R1.1095 CCSc1c(cc(cc1C)F)C 62a_100012356666_100000210202 [0,2,0,0,0,0|1,1,0]=4 15568 B12R1.1095 CCSc1c(cc(cc1C)N)C 62a_100000210202_100000215964 [0,2,0,0,0,0|1,1,0]=4 15569 B12R1.1095 CCSc1c(cc(cc1C)N)C 62a_100000215964_100000210202 [0,2,0,0,0,0|1,1,0]=4 15570 B12R1.1095 CCSc1c(cc(cc1C)O)C 62a_100000210202_100000243743 [0,2,0,0,0,0|0,1,0]=3 15571 B12R1.1095 CCSc1c(cc(cc1C)O)C 62a_100000243743_100000210202 [0,2,0,0,0,0|0,1,0]=3 15572 B12R1.1095 CCSc1c(cc(cc1Cl)Br)Cl 62a_100000210202_200011263224 [0,2,0,0,0,0|1,1,0]=4 15573 B12R1.1095 CCSc1c(cc(cc1Cl)Br)Cl 62a_200011263224_100000210202 [0,2,0,0,0,0|1,1,0]=4 15574 B12R1.1095 CCSc1c(cc(cc1Cl)Br)F 62a_100000210202_100010212234 [0,2,0,0,0,0|1,1,0]=4 15575 B12R1.1095 CCSc1c(cc(cc1Cl)Br)F 62a_100010212234_100000210202 [0,2,0,0,0,0|1,1,0]=4 15576 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)C 62a_100000210202_200000035511 [0,2,0,0,0,0|1,1,0]=4 15577 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)C 62a_200000035511_100000210202 [0,2,0,0,0,0|1,1,0]=4 15578 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)Cl 62a_100000210202_200011216440 [0,2,0,0,0,0|1,1,0]=4 15579 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)Cl 62a_200011216440_100000210202 [0,2,0,0,0,0|1,1,0]=4 15580 B12R1.1095 CCSc1c(cc(cc1Cl)F)C 62a_100000210202_100010079234 [0,2,0,0,0,0|1,1,0]=4 15581 B12R1.1095 CCSc1c(cc(cc1Cl)F)C 62a_100010079234_100000210202 [0,2,0,0,0,0|1,1,0]=4 15582 B12R1.1095 CCSc1c(cc(cc1Cl)F)Cl 62a_100000210202_100010175091 [0,2,0,0,0,0|1,1,0]=4 15583 B12R1.1095 CCSc1c(cc(cc1Cl)F)Cl 62a_100010175091_100000210202 [0,2,0,0,0,0|1,1,0]=4 15584 B12R1.1095 CCSc1c(cc(cc1Cl)N)F 62a_100000210202_100014833993 [0,2,0,0,0,0|1,1,0]=4 15585 B12R1.1095 CCSc1c(cc(cc1Cl)N)F 62a_100014833993_100000210202 [0,2,0,0,0,0|1,1,0]=4 15586 B12R1.1095 CCSc1c(cc(cc1F)Br)F 62a_100000210202_100009813614 [0,2,0,0,0,0|1,1,0]=4 15587 B12R1.1095 CCSc1c(cc(cc1F)Br)F 62a_100009813614_100000210202 [0,2,0,0,0,0|1,1,0]=4 15588 B12R1.1095 CCSc1c(cc(cc1F)C)F 62a_100000210202_100015306127 [0,2,0,0,0,0|1,1,0]=4 15589 B12R1.1095 CCSc1c(cc(cc1F)C)F 62a_100015306127_100000210202 [0,2,0,0,0,0|1,1,0]=4 15590 B12R1.1095 CCSc1c(cc(cc1F)C)N 62a_100000210202_100021129147 [0,2,0,0,0,0|1,1,0]=4 15591 B12R1.1095 CCSc1c(cc(cc1F)C)N 62a_100021129147_100000210202 [0,2,0,0,0,0|1,1,0]=4 15592 B12R1.1095 CCSc1c(cc(cc1F)Cl)N 62a_100000210202_200021297760 [0,2,0,0,0,0|1,1,0]=4 15593 B12R1.1095 CCSc1c(cc(cc1F)Cl)N 62a_200021297760_100000210202 [0,2,0,0,0,0|1,1,0]=4 15594 B12R1.1095 CCSc1c(cc(cc1F)F)C 62a_100000210202_100015332101 [0,2,0,0,0,0|1,1,0]=4 15595 B12R1.1095 CCSc1c(cc(cc1F)F)C 62a_100015332101_100000210202 [0,2,0,0,0,0|1,1,0]=4 15596 B12R1.1095 CCSc1c(cc(cc1F)F)F 62a_100000210202_100000243675 [0,2,0,0,0,0|1,1,0]=4 15597 B12R1.1095 CCSc1c(cc(cc1F)F)F 62a_100000243675_100000210202 [0,2,0,0,0,0|1,1,0]=4 15598 B12R1.1095 CCSc1c(cc(cc1F)F)N 62a_100000210202_100000716482 [0,2,0,0,0,0|1,1,0]=4 15599 B12R1.1095 CCSc1c(cc(cc1F)F)N 62a_100000716482_100000210202 [0,2,0,0,0,0|1,1,0]=4 15600 B12R1.1095 CCSc1c(cc(cc1F)F)O 62a_100000210202_100009815984 [0,2,0,0,0,0|1,1,0]=4 15601 B12R1.1095 CCSc1c(cc(cc1F)F)O 62a_100009815984_100000210202 [0,2,0,0,0,0|1,1,0]=4 15602 B12R1.1095 CCSc1c(cc(cc1F)N)C 62a_100000210202_100010115923 [0,2,0,0,0,0|1,1,0]=4 15603 B12R1.1095 CCSc1c(cc(cc1F)N)C 62a_100010115923_100000210202 [0,2,0,0,0,0|1,1,0]=4 15604 B12R1.1095 CCSc1c(cc(cc1F)N)F 62a_100000057532_100000210202 [0,2,0,0,0,0|1,1,0]=4 15605 B12R1.1095 CCSc1c(cc(cc1F)N)F 62a_100000210202_100000057532 [0,2,0,0,0,0|1,1,0]=4 15606 B12R1.1095 CCSc1c(cc(cc1F)O)F 62a_100000210202_100009816007 [0,2,0,0,0,0|0,1,0]=3 15607 B12R1.1095 CCSc1c(cc(cc1F)O)F 62a_100009816007_100000210202 [0,2,0,0,0,0|0,1,0]=3 15608 B12R1.1095 CCSc1c(cc(cc1N)Cl)C 62a_100000210202_100000698757 [0,2,0,0,0,0|1,1,0]=4 15609 B12R1.1095 CCSc1c(cc(cc1N)Cl)C 62a_100000698757_100000210202 [0,2,0,0,0,0|1,1,0]=4 15610 B12R1.1095 CCSc1c(cc(cc1O)C)C 62a_100000210202_100010342985 [0,2,0,0,0,0|1,1,0]=4 15611 B12R1.1095 CCSc1c(cc(cc1O)C)C 62a_100010342985_100000210202 [0,2,0,0,0,0|1,1,0]=4 15612 B12R1.1095 CCSc1c(cc(cc1O)Cl)C 62a_100000210202_100010254216 [0,2,0,0,0,0|1,1,0]=4 15613 B12R1.1095 CCSc1c(cc(cc1O)Cl)C 62a_100010254216_100000210202 [0,2,0,0,0,0|1,1,0]=4 15614 B12R1.1095 CCSc1c(cc(cc1O)O)O 62a_100000210202_200010341185 [0,2,0,0,0,0|0,1,0]=3 15615 B12R1.1095 CNCc1c(cc(cc1C)O)C 207a_100102657272_100011827661 [0,2,0,0,0,0|2,0,0]=4 15616 B12R1.1095 CNCc1c(cc(cc1F)O)F 207a_100102657272_100000061967 [0,2,0,0,0,0|2,0,0]=4 15617 B12R1.1095 COCc1c(cc(cc1F)O)F 271570a_203496583355_202126162168 [0,2,0,0,0,0|2,0,0]=4 15618 B12R1.1095 Cc1cc(c(c(c1)Br)OCF)Br 34a_100000203795_100015361967 [0,2,0,0,0,0|2,0,0]=4 15619 B12R1.1095 Cc1cc(c(c(c1)Br)OCF)Br 7a_100000203795_100015361967 [0,2,0,0,0,0|2,0,0]=4 15620 B12R1.1095 Cc1cc(c(c(c1)Br)OCF)C 34a_100011934984_100015361967 [0,2,0,0,0,0|2,0,0]=4 15621 B12R1.1095 Cc1cc(c(c(c1)Br)OCF)C 7a_100011934984_100015361967 [0,2,0,0,0,0|2,0,0]=4 15622 B12R1.1095 Cc1cc(c(c(c1)Br)OCF)F 34a_200010713133_100015361967 [0,2,0,0,0,0|2,0,0]=4 15623 B12R1.1095 Cc1cc(c(c(c1)Br)OCF)F 7a_200010713133_100015361967 [0,2,0,0,0,0|2,0,0]=4 15624 B12R1.1095 Cc1cc(c(c(c1)C)OCF)C 34a_100000212074_100015361967 [0,2,0,0,0,0|2,0,0]=4 15625 B12R1.1095 Cc1cc(c(c(c1)C)OCF)C 7a_100000212074_100015361967 [0,2,0,0,0,0|2,0,0]=4 15626 B12R1.1095 Cc1cc(c(c(c1)Cl)OCF)Cl 34a_100000034925_100015361967 [0,2,0,0,0,0|2,0,0]=4 15627 B12R1.1095 Cc1cc(c(c(c1)Cl)OCF)Cl 7a_100000034925_100015361967 [0,2,0,0,0,0|2,0,0]=4 15628 B12R1.1095 Cc1cc(c(c(c1)I)OCF)F 34a_200135191068_100015361967 [0,2,0,0,0,0|2,0,0]=4 15629 B12R1.1095 Cc1cc(c(c(c1)I)OCF)F 7a_200135191068_100015361967 [0,2,0,0,0,0|2,0,0]=4 15630 B12R1.1095 Cc1cc(c(c(c1)N)OCF)C 34a_100011216242_100015361967 [0,2,0,0,0,0|2,0,0]=4 15631 B12R1.1095 Cc1cc(c(c(c1)N)OCF)C 7a_100011216242_100015361967 [0,2,0,0,0,0|2,0,0]=4 15632 B12R1.1095 Cc1cc(cc(c1NCF)C)O 34a_100011934200_100015361967 [0,2,0,0,0,0|2,0,0]=4 15633 B12R1.1095 Cc1cc(cc(c1OCF)Br)Br 34a_100000186369_100015361967 [0,2,0,0,0,0|2,0,0]=4 15634 B12R1.1095 Cc1cc(cc(c1OCF)Br)Br 7a_100000186369_100015361967 [0,2,0,0,0,0|2,0,0]=4 15635 B12R1.1095 Cc1cc(cc(c1OCF)Br)Cl 34a_100012337756_100015361967 [0,2,0,0,0,0|2,0,0]=4 15636 B12R1.1095 Cc1cc(cc(c1OCF)Br)Cl 7a_100012337756_100015361967 [0,2,0,0,0,0|2,0,0]=4 15637 B12R1.1095 Cc1cc(cc(c1OCF)Br)I 34a_100010982682_100015361967 [0,2,0,0,0,0|2,0,0]=4 15638 B12R1.1095 Cc1cc(cc(c1OCF)Br)I 7a_100010982682_100015361967 [0,2,0,0,0,0|2,0,0]=4 15639 B12R1.1095 Cc1cc(cc(c1OCF)Br)N 34a_100010064301_100015361967 [0,2,0,0,0,0|2,0,0]=4 15640 B12R1.1095 Cc1cc(cc(c1OCF)Br)N 7a_100010064301_100015361967 [0,2,0,0,0,0|2,0,0]=4 15641 B12R1.1095 Cc1cc(cc(c1OCF)C)Br 34a_100000187306_100015361967 [0,2,0,0,0,0|2,0,0]=4 15642 B12R1.1095 Cc1cc(cc(c1OCF)C)Br 7a_100000187306_100015361967 [0,2,0,0,0,0|2,0,0]=4 15643 B12R1.1095 Cc1cc(cc(c1OCF)C)Cl 34a_100000211519_100015361967 [0,2,0,0,0,0|2,0,0]=4 15644 B12R1.1095 Cc1cc(cc(c1OCF)C)Cl 7a_100000211519_100015361967 [0,2,0,0,0,0|2,0,0]=4 15645 B12R1.1095 Cc1cc(cc(c1OCF)C)F 34a_100000081862_100015361967 [0,2,0,0,0,0|2,0,0]=4 15646 B12R1.1095 Cc1cc(cc(c1OCF)C)F 7a_100000081862_100015361967 [0,2,0,0,0,0|2,0,0]=4 15647 B12R1.1095 Cc1cc(cc(c1OCF)C)I 34a_100011216129_100015361967 [0,2,0,0,0,0|2,0,0]=4 15648 B12R1.1095 Cc1cc(cc(c1OCF)C)I 7a_100011216129_100015361967 [0,2,0,0,0,0|2,0,0]=4 15649 B12R1.1095 Cc1cc(cc(c1OCF)C)N 34a_100000703291_100015361967 [0,2,0,0,0,0|2,0,0]=4 15650 B12R1.1095 Cc1cc(cc(c1OCF)C)N 7a_100000703291_100015361967 [0,2,0,0,0,0|2,0,0]=4 15651 B12R1.1095 Cc1cc(cc(c1OCF)Cl)Br 34a_100000211485_100015361967 [0,2,0,0,0,0|2,0,0]=4 15652 B12R1.1095 Cc1cc(cc(c1OCF)Cl)Br 7a_100000211485_100015361967 [0,2,0,0,0,0|2,0,0]=4 15653 B12R1.1095 Cc1cc(cc(c1OCF)Cl)Cl 34a_100011218458_100015361967 [0,2,0,0,0,0|2,0,0]=4 15654 B12R1.1095 Cc1cc(cc(c1OCF)Cl)Cl 7a_100011218458_100015361967 [0,2,0,0,0,0|2,0,0]=4 15655 B12R1.1095 Cc1cc(cc(c1OCF)Cl)I 34a_200015900153_100015361967 [0,2,0,0,0,0|2,0,0]=4 15656 B12R1.1095 Cc1cc(cc(c1OCF)Cl)I 7a_200015900153_100015361967 [0,2,0,0,0,0|2,0,0]=4 15657 B12R1.1095 Cc1cc(cc(c1OCF)I)Cl 34a_100012343667_100015361967 [0,2,0,0,0,0|2,0,0]=4 15658 B12R1.1095 Cc1cc(cc(c1OCF)I)Cl 7a_100012343667_100015361967 [0,2,0,0,0,0|2,0,0]=4 15659 B12R1.1095 Cc1cc(cc(c1OCF)N)Br 34a_100011825904_100015361967 [0,2,0,0,0,0|2,0,0]=4 15660 B12R1.1095 Cc1cc(cc(c1OCF)N)Br 7a_100011825904_100015361967 [0,2,0,0,0,0|2,0,0]=4 15661 B12R1.1095 Cc1cc(cc(c1OCF)N)F 34a_100000130126_100015361967 [0,2,0,0,0,0|2,0,0]=4 15662 B12R1.1095 Cc1cc(cc(c1OCF)N)F 7a_100000130126_100015361967 [0,2,0,0,0,0|2,0,0]=4 15663 B12R1.1095 Cc1cc(cc(c1SCF)C)O 62a_100000243743_100015361967 [0,2,0,0,0,0|1,1,0]=4 15664 B12R1.1095 Cc1cc(cc(c1SCF)C)O 62a_100015361967_100000243743 [0,2,0,0,0,0|1,1,0]=4 15665 B12R1.1095 FCOc1c(cc(cc1Br)Br)Br 34a_100000210219_100015361967 [0,2,0,0,0,0|2,0,0]=4 15666 B12R1.1095 FCOc1c(cc(cc1Br)Br)Br 7a_100000210219_100015361967 [0,2,0,0,0,0|2,0,0]=4 15667 B12R1.1095 FCOc1c(cc(cc1Br)Br)Cl 34a_100012337755_100015361967 [0,2,0,0,0,0|2,0,0]=4 15668 B12R1.1095 FCOc1c(cc(cc1Br)Br)Cl 7a_100012337755_100015361967 [0,2,0,0,0,0|2,0,0]=4 15669 B12R1.1095 FCOc1c(cc(cc1Br)Br)F 34a_100011216695_100015361967 [0,2,0,0,0,0|2,0,0]=4 15670 B12R1.1095 FCOc1c(cc(cc1Br)Br)F 7a_100011216695_100015361967 [0,2,0,0,0,0|2,0,0]=4 15671 B12R1.1095 FCOc1c(cc(cc1Br)Cl)Br 34a_100012337757_100015361967 [0,2,0,0,0,0|2,0,0]=4 15672 B12R1.1095 FCOc1c(cc(cc1Br)Cl)Br 7a_100012337757_100015361967 [0,2,0,0,0,0|2,0,0]=4 15673 B12R1.1095 FCOc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100015361967 [0,2,0,0,0,0|2,0,0]=4 15674 B12R1.1095 FCOc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100015361967 [0,2,0,0,0,0|2,0,0]=4 15675 B12R1.1095 FCOc1c(cc(cc1Br)Cl)F 34a_100011830412_100015361967 [0,2,0,0,0,0|2,0,0]=4 15676 B12R1.1095 FCOc1c(cc(cc1Br)Cl)F 7a_100011830412_100015361967 [0,2,0,0,0,0|2,0,0]=4 15677 B12R1.1095 FCOc1c(cc(cc1Br)F)Br 34a_100011215434_100015361967 [0,2,0,0,0,0|2,0,0]=4 15678 B12R1.1095 FCOc1c(cc(cc1Br)F)Br 7a_100011215434_100015361967 [0,2,0,0,0,0|2,0,0]=4 15679 B12R1.1095 FCOc1c(cc(cc1Br)F)Cl 34a_100011830411_100015361967 [0,2,0,0,0,0|2,0,0]=4 15680 B12R1.1095 FCOc1c(cc(cc1Br)F)Cl 7a_100011830411_100015361967 [0,2,0,0,0,0|2,0,0]=4 15681 B12R1.1095 FCOc1c(cc(cc1Br)F)F 34a_100000688693_100015361967 [0,2,0,0,0,0|2,0,0]=4 15682 B12R1.1095 FCOc1c(cc(cc1Br)F)F 7a_100000688693_100015361967 [0,2,0,0,0,0|2,0,0]=4 15683 B12R1.1095 FCOc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100015361967 [0,2,0,0,0,0|2,0,0]=4 15684 B12R1.1095 FCOc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100015361967 [0,2,0,0,0,0|2,0,0]=4 15685 B12R1.1095 FCOc1c(cc(cc1Cl)Br)F 34a_100011216646_100015361967 [0,2,0,0,0,0|2,0,0]=4 15686 B12R1.1095 FCOc1c(cc(cc1Cl)Br)F 7a_100011216646_100015361967 [0,2,0,0,0,0|2,0,0]=4 15687 B12R1.1095 FCOc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100015361967 [0,2,0,0,0,0|2,0,0]=4 15688 B12R1.1095 FCOc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100015361967 [0,2,0,0,0,0|2,0,0]=4 15689 B12R1.1095 FCOc1c(cc(cc1Cl)F)Cl 34a_100011217724_100015361967 [0,2,0,0,0,0|2,0,0]=4 15690 B12R1.1095 FCOc1c(cc(cc1Cl)F)Cl 7a_100011217724_100015361967 [0,2,0,0,0,0|2,0,0]=4 15691 B12R1.1095 FCOc1c(cc(cc1Cl)F)F 34a_100011935252_100015361967 [0,2,0,0,0,0|2,0,0]=4 15692 B12R1.1095 FCOc1c(cc(cc1Cl)F)F 7a_100011935252_100015361967 [0,2,0,0,0,0|2,0,0]=4 15693 B12R1.1095 FCOc1c(cc(cc1Cl)I)Cl 7a_100012339652_100015361967 [0,2,0,0,0,0|2,0,0]=4 15694 B12R1.1095 FCOc1c(cc(cc1F)Br)F 34a_100011216917_100015361967 [0,2,0,0,0,0|2,0,0]=4 15695 B12R1.1095 FCOc1c(cc(cc1F)Br)F 7a_100011216917_100015361967 [0,2,0,0,0,0|2,0,0]=4 15696 B12R1.1095 FCOc1c(cc(cc1F)Cl)F 34a_100011830429_100015361967 [0,2,0,0,0,0|2,0,0]=4 15697 B12R1.1095 FCOc1c(cc(cc1F)Cl)F 7a_100011830429_100015361967 [0,2,0,0,0,0|2,0,0]=4 15698 B12R1.1095 FCOc1c(cc(cc1F)F)F 34a_100011218396_100015361967 [0,2,0,0,0,0|2,0,0]=4 15699 B12R1.1095 FCOc1c(cc(cc1F)F)F 7a_100011218396_100015361967 [0,2,0,0,0,0|2,0,0]=4 15700 B12R1.1095 FCOc1c(cc(cc1F)I)F 34a_200011830255_100015361967 [0,2,0,0,0,0|2,0,0]=4 15701 B12R1.1095 FCOc1c(cc(cc1F)I)F 7a_200011830255_100015361967 [0,2,0,0,0,0|2,0,0]=4 15702 B12R1.1095 FCOc1c(cc(cc1I)Br)F 34a_100013354677_100015361967 [0,2,0,0,0,0|2,0,0]=4 15703 B12R1.1095 FCOc1c(cc(cc1I)Br)F 7a_100013354677_100015361967 [0,2,0,0,0,0|2,0,0]=4 15704 B12R1.1095 FCOc1c(cc(cc1I)Br)I 7a_100009997433_100015361967 [0,2,0,0,0,0|2,0,0]=4 15705 B12R1.1095 FCOc1c(cc(cc1I)Cl)Cl 34a_200012339341_100015361967 [0,2,0,0,0,0|2,0,0]=4 15706 B12R1.1095 FCOc1c(cc(cc1I)Cl)Cl 7a_200012339341_100015361967 [0,2,0,0,0,0|2,0,0]=4 15707 B12R1.1095 FCOc1c(cc(cc1I)Cl)I 7a_100000730656_100015361967 [0,2,0,0,0,0|2,0,0]=4 15708 B12R1.1095 FCOc1c(cc(cc1I)F)Br 34a_200013085147_100015361967 [0,2,0,0,0,0|2,0,0]=4 15709 B12R1.1095 FCOc1c(cc(cc1I)F)Br 7a_200013085147_100015361967 [0,2,0,0,0,0|2,0,0]=4 15710 B12R1.1095 FCOc1c(cc(cc1I)F)F 34a_200013204775_100015361967 [0,2,0,0,0,0|2,0,0]=4 15711 B12R1.1095 FCOc1c(cc(cc1I)F)F 7a_200013204775_100015361967 [0,2,0,0,0,0|2,0,0]=4 15712 B12R1.1095 FCOc1c(cc(cc1I)I)Cl 7a_100009997439_100015361967 [0,2,0,0,0,0|2,0,0]=4 15713 B12R1.1095 FCOc1c(cc(cc1I)I)I 7a_100000210296_100015361967 [0,2,0,0,0,0|2,0,0]=4 15714 B12R1.1095 Nc1cc(c(c(c1)Br)OCF)Br 34a_200000186426_100015361967 [0,2,0,0,0,0|2,0,0]=4 15715 B12R1.1095 Nc1cc(c(c(c1)Cl)OCF)Cl 34a_100000695418_100015361967 [0,2,0,0,0,0|2,0,0]=4 15716 B12R1.1095 Nc1cc(c(c(c1)Cl)OCF)Cl 7a_100000695418_100015361967 [0,2,0,0,0,0|2,0,0]=4 15717 B12R1.1095 Nc1cc(c(c(c1)F)OCF)F 34a_100016987357_100015361967 [0,2,0,0,0,0|2,0,0]=4 15718 B12R1.1095 Nc1cc(c(c(c1)F)OCF)F 7a_100016987357_100015361967 [0,2,0,0,0,0|2,0,0]=4 15719 B12R1.1095 Nc1cc(cc(c1OCF)Br)Br 34a_100010781877_100015361967 [0,2,0,0,0,0|2,0,0]=4 15720 B12R1.1095 Nc1cc(cc(c1OCF)Br)Br 7a_100010781877_100015361967 [0,2,0,0,0,0|2,0,0]=4 15721 B12R1.1095 Nc1cc(cc(c1OCF)Br)Cl 34a_106741647128_100015361967 [0,2,0,0,0,0|2,0,0]=4 15722 B12R1.1095 Nc1cc(cc(c1OCF)Br)Cl 7a_106741647128_100015361967 [0,2,0,0,0,0|2,0,0]=4 15723 B12R1.1095 Nc1cc(cc(c1OCF)Br)F 34a_200011217456_100015361967 [0,2,0,0,0,0|2,0,0]=4 15724 B12R1.1095 Nc1cc(cc(c1OCF)Br)F 7a_200011217456_100015361967 [0,2,0,0,0,0|2,0,0]=4 15725 B12R1.1095 Nc1cc(cc(c1OCF)Cl)Br 34a_100000694353_100015361967 [0,2,0,0,0,0|2,0,0]=4 15726 B12R1.1095 Nc1cc(cc(c1OCF)Cl)Br 7a_100000694353_100015361967 [0,2,0,0,0,0|2,0,0]=4 15727 B12R1.1095 Nc1cc(cc(c1OCF)Cl)Cl 34a_100000695819_100015361967 [0,2,0,0,0,0|2,0,0]=4 15728 B12R1.1095 Nc1cc(cc(c1OCF)Cl)Cl 7a_100000695819_100015361967 [0,2,0,0,0,0|2,0,0]=4 15729 B12R1.1095 Nc1cc(cc(c1OCF)F)Br 34a_100011217383_100015361967 [0,2,0,0,0,0|2,0,0]=4 15730 B12R1.1095 Nc1cc(cc(c1OCF)F)Br 7a_100011217383_100015361967 [0,2,0,0,0,0|2,0,0]=4 15731 B12R1.1095 Nc1cc(cc(c1OCF)F)F 34a_100015205836_100015361967 [0,2,0,0,0,0|2,0,0]=4 15732 B12R1.1095 Nc1cc(cc(c1OCF)F)F 7a_100015205836_100015361967 [0,2,0,0,0,0|2,0,0]=4 15733 B12R1.1095 Nc1cc(cc(c1OCF)I)Br 7a_100016071998_100015361967 [0,2,0,0,0,0|2,0,0]=4 15734 B12R1.1095 Oc1cc(c(c(c1)F)NCF)F 34a_100000036573_100015361967 [0,2,0,0,0,0|2,0,0]=4 15735 B12R1.1095 Oc1cc(c(c(c1)F)SCF)F 62a_100009816007_100015361967 [0,2,0,0,0,0|1,1,0]=4 15736 B12R1.1095 Oc1cc(c(c(c1)F)SCF)F 62a_100015361967_100009816007 [0,2,0,0,0,0|1,1,0]=4 15737 B12R1.1095 Oc1cc(c(c(c1)O)SCF)O 62a_100015361967_200010341185 [0,2,0,0,0,0|1,1,0]=4 15738 B12R1.1123 CC=Cc1cc(c(cc1C)O)C 271570a_100016259895_100000698207 [0,2,0,0,0,0|1,0,1]=4 15739 B12R1.1123 CC=Cc1cc(c(cc1C)O)F 271570a_100016259895_100012355673 [0,2,0,0,0,0|1,0,1]=4 15740 B12R1.1123 CC=Cc1cc(c(cc1C)O)N 271570a_100016259895_200010235796 [0,2,0,0,0,0|1,0,1]=4 15741 B12R1.1123 CC=Cc1cc(c(cc1Cl)O)N 271570a_100016259895_100011011175 [0,2,0,0,0,0|1,0,1]=4 15742 B12R1.1123 CC=Cc1cc(c(cc1F)O)F 271570a_100016259895_100011830439 [0,2,0,0,0,0|1,0,1]=4 15743 B12R1.1123 CC=Cc1cc(c(cc1F)O)N 271570a_100016259895_100012359894 [0,2,0,0,0,0|1,0,1]=4 15744 B12R1.1123 CCNc1cc(c(cc1Br)Br)Br 34a_100009998182_100000210202 [0,2,0,0,0,0|2,0,0]=4 15745 B12R1.1123 CCNc1cc(c(cc1Br)Br)Br 7a_100009998182_100000210202 [0,2,0,0,0,0|2,0,0]=4 15746 B12R1.1123 CCNc1cc(c(cc1Br)Br)C 34a_100009995518_100000210202 [0,2,0,0,0,0|2,0,0]=4 15747 B12R1.1123 CCNc1cc(c(cc1Br)Br)C 7a_100009995518_100000210202 [0,2,0,0,0,0|2,0,0]=4 15748 B12R1.1123 CCNc1cc(c(cc1Br)Br)F 34a_100010212202_100000210202 [0,2,0,0,0,0|2,0,0]=4 15749 B12R1.1123 CCNc1cc(c(cc1Br)Br)F 7a_100010212202_100000210202 [0,2,0,0,0,0|2,0,0]=4 15750 B12R1.1123 CCNc1cc(c(cc1Br)C)Br 34a_100012348304_100000210202 [0,2,0,0,0,0|2,0,0]=4 15751 B12R1.1123 CCNc1cc(c(cc1Br)C)Br 7a_100012348304_100000210202 [0,2,0,0,0,0|2,0,0]=4 15752 B12R1.1123 CCNc1cc(c(cc1Br)C)C 34a_100012337760_100000210202 [0,2,0,0,0,0|2,0,0]=4 15753 B12R1.1123 CCNc1cc(c(cc1Br)C)C 7a_100012337760_100000210202 [0,2,0,0,0,0|2,0,0]=4 15754 B12R1.1123 CCNc1cc(c(cc1Br)C)Cl 34a_100000702286_100000210202 [0,2,0,0,0,0|2,0,0]=4 15755 B12R1.1123 CCNc1cc(c(cc1Br)C)Cl 7a_100000702286_100000210202 [0,2,0,0,0,0|2,0,0]=4 15756 B12R1.1123 CCNc1cc(c(cc1Br)C)F 34a_100011218008_100000210202 [0,2,0,0,0,0|2,0,0]=4 15757 B12R1.1123 CCNc1cc(c(cc1Br)C)F 7a_100011218008_100000210202 [0,2,0,0,0,0|2,0,0]=4 15758 B12R1.1123 CCNc1cc(c(cc1Br)Cl)F 34a_100010254744_100000210202 [0,2,0,0,0,0|2,0,0]=4 15759 B12R1.1123 CCNc1cc(c(cc1Br)Cl)F 7a_100010254744_100000210202 [0,2,0,0,0,0|2,0,0]=4 15760 B12R1.1123 CCNc1cc(c(cc1Br)F)Br 34a_100010131408_100000210202 [0,2,0,0,0,0|2,0,0]=4 15761 B12R1.1123 CCNc1cc(c(cc1Br)F)Br 7a_100010131408_100000210202 [0,2,0,0,0,0|2,0,0]=4 15762 B12R1.1123 CCNc1cc(c(cc1Br)F)C 34a_100010233353_100000210202 [0,2,0,0,0,0|2,0,0]=4 15763 B12R1.1123 CCNc1cc(c(cc1Br)F)C 7a_100010233353_100000210202 [0,2,0,0,0,0|2,0,0]=4 15764 B12R1.1123 CCNc1cc(c(cc1Br)F)Cl 34a_100009817155_100000210202 [0,2,0,0,0,0|2,0,0]=4 15765 B12R1.1123 CCNc1cc(c(cc1Br)F)Cl 7a_100009817155_100000210202 [0,2,0,0,0,0|2,0,0]=4 15766 B12R1.1123 CCNc1cc(c(cc1Br)F)F 34a_100000690790_100000210202 [0,2,0,0,0,0|2,0,0]=4 15767 B12R1.1123 CCNc1cc(c(cc1Br)F)F 7a_100000690790_100000210202 [0,2,0,0,0,0|2,0,0]=4 15768 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000210202 [0,2,0,0,0,0|1,0,0]=3 15769 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000210202 [0,2,0,0,0,0|1,0,0]=3 15770 B12R1.1123 CCNc1cc(c(cc1C)Br)C 2230a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 15771 B12R1.1123 CCNc1cc(c(cc1C)Br)C 34a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 15772 B12R1.1123 CCNc1cc(c(cc1C)Br)C 7a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 15773 B12R1.1123 CCNc1cc(c(cc1C)Br)Cl 2230a_100012353740_100000210202 [0,2,0,0,0,0|2,0,0]=4 15774 B12R1.1123 CCNc1cc(c(cc1C)Br)Cl 34a_100012353740_100000210202 [0,2,0,0,0,0|2,0,0]=4 15775 B12R1.1123 CCNc1cc(c(cc1C)Br)Cl 7a_100012353740_100000210202 [0,2,0,0,0,0|2,0,0]=4 15776 B12R1.1123 CCNc1cc(c(cc1C)Br)F 2230a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 15777 B12R1.1123 CCNc1cc(c(cc1C)Br)F 34a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 15778 B12R1.1123 CCNc1cc(c(cc1C)Br)F 7a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 15779 B12R1.1123 CCNc1cc(c(cc1C)C)Br 2230a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 15780 B12R1.1123 CCNc1cc(c(cc1C)C)Br 34a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 15781 B12R1.1123 CCNc1cc(c(cc1C)C)Br 7a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 15782 B12R1.1123 CCNc1cc(c(cc1C)C)C 2230a_100011217141_100000210202 [0,2,0,0,0,0|2,0,0]=4 15783 B12R1.1123 CCNc1cc(c(cc1C)C)C 34a_100011217141_100000210202 [0,2,0,0,0,0|2,0,0]=4 15784 B12R1.1123 CCNc1cc(c(cc1C)C)C 7a_100011217141_100000210202 [0,2,0,0,0,0|2,0,0]=4 15785 B12R1.1123 CCNc1cc(c(cc1C)Cl)Br 2230a_100010244688_100000210202 [0,2,0,0,0,0|2,0,0]=4 15786 B12R1.1123 CCNc1cc(c(cc1C)Cl)Br 34a_100010244688_100000210202 [0,2,0,0,0,0|2,0,0]=4 15787 B12R1.1123 CCNc1cc(c(cc1C)Cl)Br 7a_100010244688_100000210202 [0,2,0,0,0,0|2,0,0]=4 15788 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 2230a_100011830454_100000210202 [0,2,0,0,0,0|2,0,0]=4 15789 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 34a_100011830454_100000210202 [0,2,0,0,0,0|2,0,0]=4 15790 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 7a_100011830454_100000210202 [0,2,0,0,0,0|2,0,0]=4 15791 B12R1.1123 CCNc1cc(c(cc1C)Cl)Cl 34a_100012017293_100000210202 [0,2,0,0,0,0|2,0,0]=4 15792 B12R1.1123 CCNc1cc(c(cc1C)Cl)Cl 7a_100012017293_100000210202 [0,2,0,0,0,0|2,0,0]=4 15793 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000210202 [0,2,0,0,0,0|2,0,0]=4 15794 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000210202 [0,2,0,0,0,0|2,0,0]=4 15795 B12R1.1123 CCNc1cc(c(cc1C)F)Br 2230a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 15796 B12R1.1123 CCNc1cc(c(cc1C)F)Br 34a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 15797 B12R1.1123 CCNc1cc(c(cc1C)F)Br 7a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 15798 B12R1.1123 CCNc1cc(c(cc1C)F)Cl 2230a_100012017673_100000210202 [0,2,0,0,0,0|2,0,0]=4 15799 B12R1.1123 CCNc1cc(c(cc1C)F)Cl 34a_100012017673_100000210202 [0,2,0,0,0,0|2,0,0]=4 15800 B12R1.1123 CCNc1cc(c(cc1C)F)Cl 7a_100012017673_100000210202 [0,2,0,0,0,0|2,0,0]=4 15801 B12R1.1123 CCNc1cc(c(cc1C)F)F 2230a_100011830416_100000210202 [0,2,0,0,0,0|2,0,0]=4 15802 B12R1.1123 CCNc1cc(c(cc1C)F)F 34a_100011830416_100000210202 [0,2,0,0,0,0|2,0,0]=4 15803 B12R1.1123 CCNc1cc(c(cc1C)F)F 7a_100011830416_100000210202 [0,2,0,0,0,0|2,0,0]=4 15804 B12R1.1123 CCNc1cc(c(cc1C)I)F 34a_100010291052_100000210202 [0,2,0,0,0,0|2,0,0]=4 15805 B12R1.1123 CCNc1cc(c(cc1C)I)F 7a_100010291052_100000210202 [0,2,0,0,0,0|2,0,0]=4 15806 B12R1.1123 CCNc1cc(c(cc1C)O)C 34a_100000720036_100000210202 [0,2,0,0,0,0|1,0,0]=3 15807 B12R1.1123 CCNc1cc(c(cc1C)O)C 7a_100000720036_100000210202 [0,2,0,0,0,0|1,0,0]=3 15808 B12R1.1123 CCNc1cc(c(cc1Cl)Br)Cl 34a_100000246133_100000210202 [0,2,0,0,0,0|2,0,0]=4 15809 B12R1.1123 CCNc1cc(c(cc1Cl)Br)Cl 7a_100000246133_100000210202 [0,2,0,0,0,0|2,0,0]=4 15810 B12R1.1123 CCNc1cc(c(cc1Cl)Br)F 34a_100000688864_100000210202 [0,2,0,0,0,0|2,0,0]=4 15811 B12R1.1123 CCNc1cc(c(cc1Cl)Br)F 7a_100000688864_100000210202 [0,2,0,0,0,0|2,0,0]=4 15812 B12R1.1123 CCNc1cc(c(cc1Cl)C)C 34a_100012183282_100000210202 [0,2,0,0,0,0|2,0,0]=4 15813 B12R1.1123 CCNc1cc(c(cc1Cl)C)C 7a_100012183282_100000210202 [0,2,0,0,0,0|2,0,0]=4 15814 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000210202 [0,2,0,0,0,0|2,0,0]=4 15815 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000210202 [0,2,0,0,0,0|2,0,0]=4 15816 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Br 34a_200012360370_100000210202 [0,2,0,0,0,0|2,0,0]=4 15817 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Br 7a_200012360370_100000210202 [0,2,0,0,0,0|2,0,0]=4 15818 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)C 34a_100012000392_100000210202 [0,2,0,0,0,0|2,0,0]=4 15819 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)C 7a_100012000392_100000210202 [0,2,0,0,0,0|2,0,0]=4 15820 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Cl 34a_100000211015_100000210202 [0,2,0,0,0,0|2,0,0]=4 15821 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Cl 7a_100000211015_100000210202 [0,2,0,0,0,0|2,0,0]=4 15822 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)F 34a_100012017157_100000210202 [0,2,0,0,0,0|2,0,0]=4 15823 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)F 7a_100012017157_100000210202 [0,2,0,0,0,0|2,0,0]=4 15824 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)I 7a_100016224655_100000210202 [0,2,0,0,0,0|2,0,0]=4 15825 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000210202 [0,2,0,0,0,0|2,0,0]=4 15826 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000210202 [0,2,0,0,0,0|2,0,0]=4 15827 B12R1.1123 CCNc1cc(c(cc1Cl)F)Br 34a_100000685351_100000210202 [0,2,0,0,0,0|2,0,0]=4 15828 B12R1.1123 CCNc1cc(c(cc1Cl)F)Br 7a_100000685351_100000210202 [0,2,0,0,0,0|2,0,0]=4 15829 B12R1.1123 CCNc1cc(c(cc1Cl)F)C 34a_100000729549_100000210202 [0,2,0,0,0,0|2,0,0]=4 15830 B12R1.1123 CCNc1cc(c(cc1Cl)F)C 7a_100000729549_100000210202 [0,2,0,0,0,0|2,0,0]=4 15831 B12R1.1123 CCNc1cc(c(cc1Cl)F)Cl 34a_100000085081_100000210202 [0,2,0,0,0,0|2,0,0]=4 15832 B12R1.1123 CCNc1cc(c(cc1Cl)F)Cl 7a_100000085081_100000210202 [0,2,0,0,0,0|2,0,0]=4 15833 B12R1.1123 CCNc1cc(c(cc1Cl)F)F 34a_100000766337_100000210202 [0,2,0,0,0,0|2,0,0]=4 15834 B12R1.1123 CCNc1cc(c(cc1Cl)F)F 7a_100000766337_100000210202 [0,2,0,0,0,0|2,0,0]=4 15835 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000210202 [0,2,0,0,0,0|1,0,0]=3 15836 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000210202 [0,2,0,0,0,0|1,0,0]=3 15837 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000210202 [0,2,0,0,0,0|1,0,0]=3 15838 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000210202 [0,2,0,0,0,0|1,0,0]=3 15839 B12R1.1123 CCNc1cc(c(cc1F)Br)Br 34a_200010212207_100000210202 [0,2,0,0,0,0|2,0,0]=4 15840 B12R1.1123 CCNc1cc(c(cc1F)Br)Br 7a_200010212207_100000210202 [0,2,0,0,0,0|2,0,0]=4 15841 B12R1.1123 CCNc1cc(c(cc1F)Br)C 2230a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 15842 B12R1.1123 CCNc1cc(c(cc1F)Br)C 34a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 15843 B12R1.1123 CCNc1cc(c(cc1F)Br)C 7a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 15844 B12R1.1123 CCNc1cc(c(cc1F)Br)Cl 34a_100012356688_100000210202 [0,2,0,0,0,0|2,0,0]=4 15845 B12R1.1123 CCNc1cc(c(cc1F)Br)Cl 7a_100012356688_100000210202 [0,2,0,0,0,0|2,0,0]=4 15846 B12R1.1123 CCNc1cc(c(cc1F)Br)F 2230a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 15847 B12R1.1123 CCNc1cc(c(cc1F)Br)F 34a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 15848 B12R1.1123 CCNc1cc(c(cc1F)Br)F 7a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 15849 B12R1.1123 CCNc1cc(c(cc1F)C)Br 2230a_100010239588_100000210202 [0,2,0,0,0,0|2,0,0]=4 15850 B12R1.1123 CCNc1cc(c(cc1F)C)Br 34a_100010239588_100000210202 [0,2,0,0,0,0|2,0,0]=4 15851 B12R1.1123 CCNc1cc(c(cc1F)C)Br 7a_100010239588_100000210202 [0,2,0,0,0,0|2,0,0]=4 15852 B12R1.1123 CCNc1cc(c(cc1F)C)F 2230a_100012002673_100000210202 [0,2,0,0,0,0|2,0,0]=4 15853 B12R1.1123 CCNc1cc(c(cc1F)C)F 34a_100012002673_100000210202 [0,2,0,0,0,0|2,0,0]=4 15854 B12R1.1123 CCNc1cc(c(cc1F)C)F 7a_100012002673_100000210202 [0,2,0,0,0,0|2,0,0]=4 15855 B12R1.1123 CCNc1cc(c(cc1F)C)I 34a_100011014115_100000210202 [0,2,0,0,0,0|2,0,0]=4 15856 B12R1.1123 CCNc1cc(c(cc1F)C)I 7a_100011014115_100000210202 [0,2,0,0,0,0|2,0,0]=4 15857 B12R1.1123 CCNc1cc(c(cc1F)C)O 34a_100000117193_100000210202 [0,2,0,0,0,0|2,0,0]=4 15858 B12R1.1123 CCNc1cc(c(cc1F)C)O 7a_100000117193_100000210202 [0,2,0,0,0,0|2,0,0]=4 15859 B12R1.1123 CCNc1cc(c(cc1F)Cl)Br 34a_100013023876_100000210202 [0,2,0,0,0,0|2,0,0]=4 15860 B12R1.1123 CCNc1cc(c(cc1F)Cl)Br 7a_100013023876_100000210202 [0,2,0,0,0,0|2,0,0]=4 15861 B12R1.1123 CCNc1cc(c(cc1F)Cl)C 34a_100000091823_100000210202 [0,2,0,0,0,0|2,0,0]=4 15862 B12R1.1123 CCNc1cc(c(cc1F)Cl)C 7a_100000091823_100000210202 [0,2,0,0,0,0|2,0,0]=4 15863 B12R1.1123 CCNc1cc(c(cc1F)Cl)Cl 34a_100000724578_100000210202 [0,2,0,0,0,0|2,0,0]=4 15864 B12R1.1123 CCNc1cc(c(cc1F)Cl)Cl 7a_100000724578_100000210202 [0,2,0,0,0,0|2,0,0]=4 15865 B12R1.1123 CCNc1cc(c(cc1F)Cl)F 34a_100011998097_100000210202 [0,2,0,0,0,0|2,0,0]=4 15866 B12R1.1123 CCNc1cc(c(cc1F)Cl)F 7a_100011998097_100000210202 [0,2,0,0,0,0|2,0,0]=4 15867 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000210202 [0,2,0,0,0,0|2,0,0]=4 15868 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000210202 [0,2,0,0,0,0|2,0,0]=4 15869 B12R1.1123 CCNc1cc(c(cc1F)F)Br 2230a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 15870 B12R1.1123 CCNc1cc(c(cc1F)F)Br 34a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 15871 B12R1.1123 CCNc1cc(c(cc1F)F)Br 7a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 15872 B12R1.1123 CCNc1cc(c(cc1F)F)Cl 2230a_100011998096_100000210202 [0,2,0,0,0,0|2,0,0]=4 15873 B12R1.1123 CCNc1cc(c(cc1F)F)Cl 34a_100011998096_100000210202 [0,2,0,0,0,0|2,0,0]=4 15874 B12R1.1123 CCNc1cc(c(cc1F)F)Cl 7a_100011998096_100000210202 [0,2,0,0,0,0|2,0,0]=4 15875 B12R1.1123 CCNc1cc(c(cc1F)F)F 2230a_100000750162_100000210202 [0,2,0,0,0,0|2,0,0]=4 15876 B12R1.1123 CCNc1cc(c(cc1F)F)F 34a_100000750162_100000210202 [0,2,0,0,0,0|2,0,0]=4 15877 B12R1.1123 CCNc1cc(c(cc1F)F)F 7a_100000750162_100000210202 [0,2,0,0,0,0|2,0,0]=4 15878 B12R1.1123 CCNc1cc(c(cc1F)F)O 34a_100011219470_100000210202 [0,2,0,0,0,0|2,0,0]=4 15879 B12R1.1123 CCNc1cc(c(cc1F)F)O 7a_100011219470_100000210202 [0,2,0,0,0,0|2,0,0]=4 15880 B12R1.1123 CCNc1cc(c(cc1F)I)F 34a_100010185194_100000210202 [0,2,0,0,0,0|2,0,0]=4 15881 B12R1.1123 CCNc1cc(c(cc1F)I)F 7a_100010185194_100000210202 [0,2,0,0,0,0|2,0,0]=4 15882 B12R1.1123 CCNc1cc(c(cc1F)O)F 34a_100020635945_100000210202 [0,2,0,0,0,0|1,0,0]=3 15883 B12R1.1123 CCNc1cc(c(cc1F)O)F 7a_100020635945_100000210202 [0,2,0,0,0,0|1,0,0]=3 15884 B12R1.1123 CCNc1cc(c(cc1I)Br)F 34a_100010888672_100000210202 [0,2,0,0,0,0|2,0,0]=4 15885 B12R1.1123 CCNc1cc(c(cc1I)Br)F 7a_100010888672_100000210202 [0,2,0,0,0,0|2,0,0]=4 15886 B12R1.1123 CCNc1cc(c(cc1I)C)Br 34a_200015600912_100000210202 [0,2,0,0,0,0|2,0,0]=4 15887 B12R1.1123 CCNc1cc(c(cc1I)C)Br 7a_200015600912_100000210202 [0,2,0,0,0,0|2,0,0]=4 15888 B12R1.1123 CCNc1cc(c(cc1I)C)C 34a_100012353678_100000210202 [0,2,0,0,0,0|2,0,0]=4 15889 B12R1.1123 CCNc1cc(c(cc1I)C)C 7a_100012353678_100000210202 [0,2,0,0,0,0|2,0,0]=4 15890 B12R1.1123 CCNc1cc(c(cc1I)Cl)Cl 7a_200011093942_100000210202 [0,2,0,0,0,0|2,0,0]=4 15891 B12R1.1123 CCNc1cc(c(cc1I)Cl)F 34a_100010892166_100000210202 [0,2,0,0,0,0|2,0,0]=4 15892 B12R1.1123 CCNc1cc(c(cc1I)Cl)F 7a_100010892166_100000210202 [0,2,0,0,0,0|2,0,0]=4 15893 B12R1.1123 CCNc1cc(c(cc1I)F)Br 34a_200021016574_100000210202 [0,2,0,0,0,0|2,0,0]=4 15894 B12R1.1123 CCNc1cc(c(cc1I)F)Br 7a_200021016574_100000210202 [0,2,0,0,0,0|2,0,0]=4 15895 B12R1.1123 CCNc1cc(c(cc1I)F)C 34a_100010238302_100000210202 [0,2,0,0,0,0|2,0,0]=4 15896 B12R1.1123 CCNc1cc(c(cc1I)F)C 7a_100010238302_100000210202 [0,2,0,0,0,0|2,0,0]=4 15897 B12R1.1123 CCNc1cc(c(cc1I)F)Cl 34a_200010992381_100000210202 [0,2,0,0,0,0|2,0,0]=4 15898 B12R1.1123 CCNc1cc(c(cc1I)F)Cl 7a_200010992381_100000210202 [0,2,0,0,0,0|2,0,0]=4 15899 B12R1.1123 CCNc1cc(c(cc1I)F)F 34a_100000765032_100000210202 [0,2,0,0,0,0|2,0,0]=4 15900 B12R1.1123 CCNc1cc(c(cc1I)F)F 7a_100000765032_100000210202 [0,2,0,0,0,0|2,0,0]=4 15901 B12R1.1123 CCNc1cc(c(cc1O)Br)Br 7a_200010781931_100000210202 [0,2,0,0,0,0|2,0,0]=4 15902 B12R1.1123 CCNc1cc(c(cc1O)Br)C 34a_200010107346_100000210202 [0,2,0,0,0,0|2,0,0]=4 15903 B12R1.1123 CCNc1cc(c(cc1O)Br)F 34a_100013038943_100000210202 [0,2,0,0,0,0|2,0,0]=4 15904 B12R1.1123 CCNc1cc(c(cc1O)Br)F 7a_100013038943_100000210202 [0,2,0,0,0,0|2,0,0]=4 15905 B12R1.1123 CCNc1cc(c(cc1O)C)Br 34a_200010235796_100000210202 [0,2,0,0,0,0|2,0,0]=4 15906 B12R1.1123 CCNc1cc(c(cc1O)C)Br 7a_200010235796_100000210202 [0,2,0,0,0,0|2,0,0]=4 15907 B12R1.1123 CCNc1cc(c(cc1O)C)C 34a_100133014134_100000210202 [0,2,0,0,0,0|2,0,0]=4 15908 B12R1.1123 CCNc1cc(c(cc1O)C)C 7a_100133014134_100000210202 [0,2,0,0,0,0|2,0,0]=4 15909 B12R1.1123 CCNc1cc(c(cc1O)C)Cl 34a_100000091707_100000210202 [0,2,0,0,0,0|2,0,0]=4 15910 B12R1.1123 CCNc1cc(c(cc1O)Cl)Br 34a_100013488937_100000210202 [0,2,0,0,0,0|2,0,0]=4 15911 B12R1.1123 CCNc1cc(c(cc1O)Cl)Br 7a_100013488937_100000210202 [0,2,0,0,0,0|2,0,0]=4 15912 B12R1.1123 CCNc1cc(c(cc1O)Cl)Cl 34a_100000696747_100000210202 [0,2,0,0,0,0|2,0,0]=4 15913 B12R1.1123 CCNc1cc(c(cc1O)Cl)Cl 7a_100000696747_100000210202 [0,2,0,0,0,0|2,0,0]=4 15914 B12R1.1123 CCNc1cc(c(cc1O)F)Br 34a_100012359894_100000210202 [0,2,0,0,0,0|2,0,0]=4 15915 B12R1.1123 CCNc1cc(c(cc1O)F)Br 7a_100012359894_100000210202 [0,2,0,0,0,0|2,0,0]=4 15916 B12R1.1123 CCNc1cc(c(cc1O)F)C 34a_100012022779_100000210202 [0,2,0,0,0,0|2,0,0]=4 15917 B12R1.1123 CCNc1cc(c(cc1O)F)C 7a_100012022779_100000210202 [0,2,0,0,0,0|2,0,0]=4 15918 B12R1.1123 CCNc1cc(c(cc1O)F)F 2230a_106722365970_100000210202 [0,2,0,0,0,0|2,0,0]=4 15919 B12R1.1123 CCNc1cc(c(cc1O)F)F 34a_106722365970_100000210202 [0,2,0,0,0,0|2,0,0]=4 15920 B12R1.1123 CCNc1cc(c(cc1O)F)F 7a_106722365970_100000210202 [0,2,0,0,0,0|2,0,0]=4 15921 B12R1.1123 CCOc1cc(c(cc1Br)C)C 34a_100009814663_100000210202 [0,2,0,0,0,0|1,0,0]=3 15922 B12R1.1123 CCOc1cc(c(cc1Br)C)C 7a_100009814663_100000210202 [0,2,0,0,0,0|1,0,0]=3 15923 B12R1.1123 CCOc1cc(c(cc1Br)Cl)C 34a_100022700756_100000210202 [0,2,0,0,0,0|1,0,0]=3 15924 B12R1.1123 CCOc1cc(c(cc1Br)Cl)C 7a_100022700756_100000210202 [0,2,0,0,0,0|1,0,0]=3 15925 B12R1.1123 CCOc1cc(c(cc1Br)F)F 34a_100009813768_100000210202 [0,2,0,0,0,0|1,0,0]=3 15926 B12R1.1123 CCOc1cc(c(cc1Br)F)F 7a_100009813768_100000210202 [0,2,0,0,0,0|1,0,0]=3 15927 B12R1.1123 CCOc1cc(c(cc1Br)N)Br 34a_100011080774_100000210202 [0,2,0,0,0,0|1,0,0]=3 15928 B12R1.1123 CCOc1cc(c(cc1Br)N)Br 7a_100011080774_100000210202 [0,2,0,0,0,0|1,0,0]=3 15929 B12R1.1123 CCOc1cc(c(cc1C)Br)C 34a_100000698207_100000210202 [0,2,0,0,0,0|1,0,0]=3 15930 B12R1.1123 CCOc1cc(c(cc1C)Br)C 7a_100000698207_100000210202 [0,2,0,0,0,0|1,0,0]=3 15931 B12R1.1123 CCOc1cc(c(cc1C)C)C 34a_200000047129_100000210202 [0,2,0,0,0,0|1,0,0]=3 15932 B12R1.1123 CCOc1cc(c(cc1C)C)C 7a_200000047129_100000210202 [0,2,0,0,0,0|1,0,0]=3 15933 B12R1.1123 CCOc1cc(c(cc1C)Cl)N 34a_100000092876_100000210202 [0,2,0,0,0,0|1,0,0]=3 15934 B12R1.1123 CCOc1cc(c(cc1C)Cl)N 7a_100000092876_100000210202 [0,2,0,0,0,0|1,0,0]=3 15935 B12R1.1123 CCOc1cc(c(cc1C)F)Br 34a_100014242602_100000210202 [0,2,0,0,0,0|1,0,0]=3 15936 B12R1.1123 CCOc1cc(c(cc1C)F)Br 7a_100014242602_100000210202 [0,2,0,0,0,0|1,0,0]=3 15937 B12R1.1123 CCOc1cc(c(cc1C)F)C 34a_100010674473_100000210202 [0,2,0,0,0,0|1,0,0]=3 15938 B12R1.1123 CCOc1cc(c(cc1C)F)C 7a_100010674473_100000210202 [0,2,0,0,0,0|1,0,0]=3 15939 B12R1.1123 CCOc1cc(c(cc1C)F)F 34a_100000728840_100000210202 [0,2,0,0,0,0|1,0,0]=3 15940 B12R1.1123 CCOc1cc(c(cc1C)F)F 7a_100000728840_100000210202 [0,2,0,0,0,0|1,0,0]=3 15941 B12R1.1123 CCOc1cc(c(cc1C)F)I 34a_100010080512_100000210202 [0,2,0,0,0,0|1,0,0]=3 15942 B12R1.1123 CCOc1cc(c(cc1C)F)I 7a_100010080512_100000210202 [0,2,0,0,0,0|1,0,0]=3 15943 B12R1.1123 CCOc1cc(c(cc1C)F)N 34a_100000117193_100000210202 [0,2,0,0,0,0|1,0,0]=3 15944 B12R1.1123 CCOc1cc(c(cc1C)F)N 7a_100000117193_100000210202 [0,2,0,0,0,0|1,0,0]=3 15945 B12R1.1123 CCOc1cc(c(cc1C)I)C 34a_200011215153_100000210202 [0,2,0,0,0,0|1,0,0]=3 15946 B12R1.1123 CCOc1cc(c(cc1C)I)C 7a_200011215153_100000210202 [0,2,0,0,0,0|1,0,0]=3 15947 B12R1.1123 CCOc1cc(c(cc1C)N)C 34a_100000720036_100000210202 [0,2,0,0,0,0|1,0,0]=3 15948 B12R1.1123 CCOc1cc(c(cc1C)N)C 7a_100000720036_100000210202 [0,2,0,0,0,0|1,0,0]=3 15949 B12R1.1123 CCOc1cc(c(cc1Cl)Br)C 34a_200012350488_100000210202 [0,2,0,0,0,0|1,0,0]=3 15950 B12R1.1123 CCOc1cc(c(cc1Cl)Br)C 7a_200012350488_100000210202 [0,2,0,0,0,0|1,0,0]=3 15951 B12R1.1123 CCOc1cc(c(cc1Cl)Br)Cl 34a_100000719705_100000210202 [0,2,0,0,0,0|1,0,0]=3 15952 B12R1.1123 CCOc1cc(c(cc1Cl)Br)Cl 7a_100000719705_100000210202 [0,2,0,0,0,0|1,0,0]=3 15953 B12R1.1123 CCOc1cc(c(cc1Cl)Br)F 34a_100000726166_100000210202 [0,2,0,0,0,0|1,0,0]=3 15954 B12R1.1123 CCOc1cc(c(cc1Cl)Br)F 7a_100000726166_100000210202 [0,2,0,0,0,0|1,0,0]=3 15955 B12R1.1123 CCOc1cc(c(cc1Cl)Br)I 34a_100021297947_100000210202 [0,2,0,0,0,0|1,0,0]=3 15956 B12R1.1123 CCOc1cc(c(cc1Cl)Br)I 7a_100021297947_100000210202 [0,2,0,0,0,0|1,0,0]=3 15957 B12R1.1123 CCOc1cc(c(cc1Cl)C)C 34a_100000031796_100000210202 [0,2,0,0,0,0|1,0,0]=3 15958 B12R1.1123 CCOc1cc(c(cc1Cl)C)C 7a_100000031796_100000210202 [0,2,0,0,0,0|1,0,0]=3 15959 B12R1.1123 CCOc1cc(c(cc1Cl)C)N 34a_100009961766_100000210202 [0,2,0,0,0,0|1,0,0]=3 15960 B12R1.1123 CCOc1cc(c(cc1Cl)C)N 7a_100009961766_100000210202 [0,2,0,0,0,0|1,0,0]=3 15961 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Br 34a_100010203734_100000210202 [0,2,0,0,0,0|1,0,0]=3 15962 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Br 7a_100010203734_100000210202 [0,2,0,0,0,0|1,0,0]=3 15963 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)C 34a_100012002691_100000210202 [0,2,0,0,0,0|1,0,0]=3 15964 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)C 7a_100012002691_100000210202 [0,2,0,0,0,0|1,0,0]=3 15965 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Cl 34a_100000211312_100000210202 [0,2,0,0,0,0|1,0,0]=3 15966 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Cl 7a_100000211312_100000210202 [0,2,0,0,0,0|1,0,0]=3 15967 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)N 34a_100000037174_100000210202 [0,2,0,0,0,0|1,0,0]=3 15968 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)N 7a_100000037174_100000210202 [0,2,0,0,0,0|1,0,0]=3 15969 B12R1.1123 CCOc1cc(c(cc1Cl)F)Br 34a_100010189047_100000210202 [0,2,0,0,0,0|1,0,0]=3 15970 B12R1.1123 CCOc1cc(c(cc1Cl)F)Br 7a_100010189047_100000210202 [0,2,0,0,0,0|1,0,0]=3 15971 B12R1.1123 CCOc1cc(c(cc1Cl)F)F 34a_100009848785_100000210202 [0,2,0,0,0,0|1,0,0]=3 15972 B12R1.1123 CCOc1cc(c(cc1Cl)F)F 7a_100009848785_100000210202 [0,2,0,0,0,0|1,0,0]=3 15973 B12R1.1123 CCOc1cc(c(cc1Cl)F)I 34a_100010735246_100000210202 [0,2,0,0,0,0|1,0,0]=3 15974 B12R1.1123 CCOc1cc(c(cc1Cl)F)I 7a_100010735246_100000210202 [0,2,0,0,0,0|1,0,0]=3 15975 B12R1.1123 CCOc1cc(c(cc1Cl)F)N 34a_100000042052_100000210202 [0,2,0,0,0,0|1,0,0]=3 15976 B12R1.1123 CCOc1cc(c(cc1Cl)F)N 7a_100000042052_100000210202 [0,2,0,0,0,0|1,0,0]=3 15977 B12R1.1123 CCOc1cc(c(cc1Cl)N)Cl 34a_100012000071_100000210202 [0,2,0,0,0,0|1,0,0]=3 15978 B12R1.1123 CCOc1cc(c(cc1Cl)N)Cl 7a_100012000071_100000210202 [0,2,0,0,0,0|1,0,0]=3 15979 B12R1.1123 CCOc1cc(c(cc1F)Br)C 34a_100012355673_100000210202 [0,2,0,0,0,0|1,0,0]=3 15980 B12R1.1123 CCOc1cc(c(cc1F)Br)C 7a_100012355673_100000210202 [0,2,0,0,0,0|1,0,0]=3 15981 B12R1.1123 CCOc1cc(c(cc1F)Br)F 34a_100011830439_100000210202 [0,2,0,0,0,0|1,0,0]=3 15982 B12R1.1123 CCOc1cc(c(cc1F)Br)F 7a_100011830439_100000210202 [0,2,0,0,0,0|1,0,0]=3 15983 B12R1.1123 CCOc1cc(c(cc1F)C)Br 34a_100010068922_100000210202 [0,2,0,0,0,0|1,0,0]=3 15984 B12R1.1123 CCOc1cc(c(cc1F)C)Br 7a_100010068922_100000210202 [0,2,0,0,0,0|1,0,0]=3 15985 B12R1.1123 CCOc1cc(c(cc1F)F)Br 34a_100012457948_100000210202 [0,2,0,0,0,0|1,0,0]=3 15986 B12R1.1123 CCOc1cc(c(cc1F)F)Br 7a_100012457948_100000210202 [0,2,0,0,0,0|1,0,0]=3 15987 B12R1.1123 CCOc1cc(c(cc1F)F)F 34a_100000237555_100000210202 [0,2,0,0,0,0|1,0,0]=3 15988 B12R1.1123 CCOc1cc(c(cc1F)F)F 7a_100000237555_100000210202 [0,2,0,0,0,0|1,0,0]=3 15989 B12R1.1123 CCOc1cc(c(cc1F)F)I 34a_100015789030_100000210202 [0,2,0,0,0,0|1,0,0]=3 15990 B12R1.1123 CCOc1cc(c(cc1F)F)I 7a_100015789030_100000210202 [0,2,0,0,0,0|1,0,0]=3 15991 B12R1.1123 CCOc1cc(c(cc1F)F)N 34a_100011219470_100000210202 [0,2,0,0,0,0|1,0,0]=3 15992 B12R1.1123 CCOc1cc(c(cc1F)F)N 7a_100011219470_100000210202 [0,2,0,0,0,0|1,0,0]=3 15993 B12R1.1123 CCOc1cc(c(cc1F)N)Cl 34a_100009886023_100000210202 [0,2,0,0,0,0|1,0,0]=3 15994 B12R1.1123 CCOc1cc(c(cc1F)N)Cl 7a_100009886023_100000210202 [0,2,0,0,0,0|1,0,0]=3 15995 B12R1.1123 CCOc1cc(c(cc1F)N)F 34a_100020635945_100000210202 [0,2,0,0,0,0|1,0,0]=3 15996 B12R1.1123 CCOc1cc(c(cc1F)N)F 7a_100020635945_100000210202 [0,2,0,0,0,0|1,0,0]=3 15997 B12R1.1123 CCOc1cc(c(cc1I)F)F 34a_100010749349_100000210202 [0,2,0,0,0,0|1,0,0]=3 15998 B12R1.1123 CCOc1cc(c(cc1I)F)F 7a_100010749349_100000210202 [0,2,0,0,0,0|1,0,0]=3 15999 B12R1.1123 CCOc1cc(c(cc1N)Br)Br 34a_200010781931_100000210202 [0,2,0,0,0,0|1,0,0]=3 16000 B12R1.1123 CCOc1cc(c(cc1N)Br)Br 7a_200010781931_100000210202 [0,2,0,0,0,0|1,0,0]=3 16001 B12R1.1123 CCOc1cc(c(cc1N)Br)C 34a_200010235796_100000210202 [0,2,0,0,0,0|1,0,0]=3 16002 B12R1.1123 CCOc1cc(c(cc1N)Br)C 7a_200010235796_100000210202 [0,2,0,0,0,0|1,0,0]=3 16003 B12R1.1123 CCOc1cc(c(cc1N)Br)Cl 34a_100013488937_100000210202 [0,2,0,0,0,0|1,0,0]=3 16004 B12R1.1123 CCOc1cc(c(cc1N)Br)Cl 7a_100013488937_100000210202 [0,2,0,0,0,0|1,0,0]=3 16005 B12R1.1123 CCOc1cc(c(cc1N)Br)F 34a_100012359894_100000210202 [0,2,0,0,0,0|1,0,0]=3 16006 B12R1.1123 CCOc1cc(c(cc1N)Br)F 7a_100012359894_100000210202 [0,2,0,0,0,0|1,0,0]=3 16007 B12R1.1123 CCOc1cc(c(cc1N)C)Br 34a_200010107346_100000210202 [0,2,0,0,0,0|1,0,0]=3 16008 B12R1.1123 CCOc1cc(c(cc1N)C)Br 7a_200010107346_100000210202 [0,2,0,0,0,0|1,0,0]=3 16009 B12R1.1123 CCOc1cc(c(cc1N)C)C 34a_100133014134_100000210202 [0,2,0,0,0,0|1,0,0]=3 16010 B12R1.1123 CCOc1cc(c(cc1N)C)C 7a_100133014134_100000210202 [0,2,0,0,0,0|1,0,0]=3 16011 B12R1.1123 CCOc1cc(c(cc1N)C)F 34a_100012022779_100000210202 [0,2,0,0,0,0|1,0,0]=3 16012 B12R1.1123 CCOc1cc(c(cc1N)C)F 7a_100012022779_100000210202 [0,2,0,0,0,0|1,0,0]=3 16013 B12R1.1123 CCOc1cc(c(cc1N)Cl)C 34a_100000091707_100000210202 [0,2,0,0,0,0|1,0,0]=3 16014 B12R1.1123 CCOc1cc(c(cc1N)Cl)C 7a_100000091707_100000210202 [0,2,0,0,0,0|1,0,0]=3 16015 B12R1.1123 CCOc1cc(c(cc1N)Cl)Cl 34a_100000696747_100000210202 [0,2,0,0,0,0|1,0,0]=3 16016 B12R1.1123 CCOc1cc(c(cc1N)Cl)Cl 7a_100000696747_100000210202 [0,2,0,0,0,0|1,0,0]=3 16017 B12R1.1123 CCOc1cc(c(cc1N)F)Br 34a_100013038943_100000210202 [0,2,0,0,0,0|1,0,0]=3 16018 B12R1.1123 CCOc1cc(c(cc1N)F)Br 7a_100013038943_100000210202 [0,2,0,0,0,0|1,0,0]=3 16019 B12R1.1123 CCOc1cc(c(cc1N)F)F 34a_100011217416_100000210202 [0,2,0,0,0,0|1,0,0]=3 16020 B12R1.1123 CCOc1cc(c(cc1N)F)F 7a_100011217416_100000210202 [0,2,0,0,0,0|1,0,0]=3 16021 B12R1.1123 CCOc1cc(c(cc1N)I)Cl 34a_100011011175_100000210202 [0,2,0,0,0,0|1,0,0]=3 16022 B12R1.1123 CCOc1cc(c(cc1N)I)Cl 7a_100011011175_100000210202 [0,2,0,0,0,0|1,0,0]=3 16023 B12R1.1123 CCOc1cc(c(nc1N)Cl)Br 34a_100010136811_100000210202 [0,2,0,0,0,0|2,0,0]=4 16024 B12R1.1123 CCOc1cc(c(nc1N)Cl)Br 7a_100010136811_100000210202 [0,2,0,0,0,0|2,0,0]=4 16025 B12R1.1123 CCOc1nc(c(cc1Br)Cl)C 34a_200010749519_100000210202 [0,2,0,0,0,0|2,0,0]=4 16026 B12R1.1123 CCOc1nc(c(cc1Cl)Cl)Cl 34a_100011933978_100000210202 [0,2,0,0,0,0|2,0,0]=4 16027 B12R1.1123 CCOc1nc(c(cc1F)F)F 34a_100011934363_100000210202 [0,2,0,0,0,0|2,0,0]=4 16028 B12R1.1123 CCSc1cc(c(cc1Br)Br)Br 62a_100000210202_100010151546 [0,2,0,0,0,0|1,1,0]=4 16029 B12R1.1123 CCSc1cc(c(cc1Br)Br)Br 62a_100010151546_100000210202 [0,2,0,0,0,0|1,1,0]=4 16030 B12R1.1123 CCSc1cc(c(cc1Br)Br)F 62a_100000210202_200010212206 [0,2,0,0,0,0|1,1,0]=4 16031 B12R1.1123 CCSc1cc(c(cc1Br)Br)F 62a_200010212206_100000210202 [0,2,0,0,0,0|1,1,0]=4 16032 B12R1.1123 CCSc1cc(c(cc1Br)C)Br 62a_100000210202_100012929169 [0,2,0,0,0,0|1,1,0]=4 16033 B12R1.1123 CCSc1cc(c(cc1Br)C)Br 62a_100012929169_100000210202 [0,2,0,0,0,0|1,1,0]=4 16034 B12R1.1123 CCSc1cc(c(cc1Br)C)F 62a_100000210202_200009814774 [0,2,0,0,0,0|1,1,0]=4 16035 B12R1.1123 CCSc1cc(c(cc1Br)C)F 62a_200009814774_100000210202 [0,2,0,0,0,0|1,1,0]=4 16036 B12R1.1123 CCSc1cc(c(cc1Br)Cl)F 62a_100000210202_100010254745 [0,2,0,0,0,0|1,1,0]=4 16037 B12R1.1123 CCSc1cc(c(cc1Br)Cl)F 62a_100010254745_100000210202 [0,2,0,0,0,0|1,1,0]=4 16038 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100000210202_100021297947 [0,2,0,0,0,0|1,1,0]=4 16039 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000210202 [0,2,0,0,0,0|1,1,0]=4 16040 B12R1.1123 CCSc1cc(c(cc1Br)F)C 62a_100000210202_200009814773 [0,2,0,0,0,0|1,1,0]=4 16041 B12R1.1123 CCSc1cc(c(cc1Br)F)C 62a_200009814773_100000210202 [0,2,0,0,0,0|1,1,0]=4 16042 B12R1.1123 CCSc1cc(c(cc1Br)F)F 62a_100000210202_100010259568 [0,2,0,0,0,0|1,1,0]=4 16043 B12R1.1123 CCSc1cc(c(cc1Br)F)F 62a_100010259568_100000210202 [0,2,0,0,0,0|1,1,0]=4 16044 B12R1.1123 CCSc1cc(c(cc1C)Br)C 62a_100000210202_100011356911 [0,2,0,0,0,0|1,1,0]=4 16045 B12R1.1123 CCSc1cc(c(cc1C)Br)C 62a_100011356911_100000210202 [0,2,0,0,0,0|1,1,0]=4 16046 B12R1.1123 CCSc1cc(c(cc1C)Br)Cl 62a_100000210202_200009814780 [0,2,0,0,0,0|1,1,0]=4 16047 B12R1.1123 CCSc1cc(c(cc1C)Br)Cl 62a_200009814780_100000210202 [0,2,0,0,0,0|1,1,0]=4 16048 B12R1.1123 CCSc1cc(c(cc1C)Br)F 62a_100000210202_100011356895 [0,2,0,0,0,0|1,1,0]=4 16049 B12R1.1123 CCSc1cc(c(cc1C)Br)F 62a_100011356895_100000210202 [0,2,0,0,0,0|1,1,0]=4 16050 B12R1.1123 CCSc1cc(c(cc1C)C)C 62a_100000210202_100000759388 [0,2,0,0,0,0|1,1,0]=4 16051 B12R1.1123 CCSc1cc(c(cc1C)C)C 62a_100000759388_100000210202 [0,2,0,0,0,0|1,1,0]=4 16052 B12R1.1123 CCSc1cc(c(cc1C)C)N 62a_100000210202_100000703630 [0,2,0,0,0,0|1,1,0]=4 16053 B12R1.1123 CCSc1cc(c(cc1C)C)N 62a_100000703630_100000210202 [0,2,0,0,0,0|1,1,0]=4 16054 B12R1.1123 CCSc1cc(c(cc1C)Cl)C 62a_100000210202_100012357408 [0,2,0,0,0,0|1,1,0]=4 16055 B12R1.1123 CCSc1cc(c(cc1C)Cl)C 62a_100012357408_100000210202 [0,2,0,0,0,0|1,1,0]=4 16056 B12R1.1123 CCSc1cc(c(cc1C)F)Br 62a_100000210202_100011216669 [0,2,0,0,0,0|1,1,0]=4 16057 B12R1.1123 CCSc1cc(c(cc1C)F)Br 62a_100011216669_100000210202 [0,2,0,0,0,0|1,1,0]=4 16058 B12R1.1123 CCSc1cc(c(cc1C)F)C 62a_100000210202_100010212296 [0,2,0,0,0,0|1,1,0]=4 16059 B12R1.1123 CCSc1cc(c(cc1C)F)C 62a_100010212296_100000210202 [0,2,0,0,0,0|1,1,0]=4 16060 B12R1.1123 CCSc1cc(c(cc1C)F)F 62a_100000210202_100009815990 [0,2,0,0,0,0|1,1,0]=4 16061 B12R1.1123 CCSc1cc(c(cc1C)F)F 62a_100009815990_100000210202 [0,2,0,0,0,0|1,1,0]=4 16062 B12R1.1123 CCSc1cc(c(cc1C)F)N 62a_100000210202_100011014115 [0,2,0,0,0,0|1,1,0]=4 16063 B12R1.1123 CCSc1cc(c(cc1C)F)N 62a_100011014115_100000210202 [0,2,0,0,0,0|1,1,0]=4 16064 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100000210202_100010068922 [0,2,0,0,0,0|1,1,0]=4 16065 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100010068922_100000210202 [0,2,0,0,0,0|1,1,0]=4 16066 B12R1.1123 CCSc1cc(c(cc1C)N)C 62a_100000210202_100011934712 [0,2,0,0,0,0|1,1,0]=4 16067 B12R1.1123 CCSc1cc(c(cc1C)N)C 62a_100011934712_100000210202 [0,2,0,0,0,0|1,1,0]=4 16068 B12R1.1123 CCSc1cc(c(cc1C)N)F 62a_100000210202_100000691575 [0,2,0,0,0,0|1,1,0]=4 16069 B12R1.1123 CCSc1cc(c(cc1C)N)F 62a_100000691575_100000210202 [0,2,0,0,0,0|1,1,0]=4 16070 B12R1.1123 CCSc1cc(c(cc1C)N)N 62a_100000210202_100010080480 [0,2,0,0,0,0|1,1,0]=4 16071 B12R1.1123 CCSc1cc(c(cc1C)N)N 62a_100010080480_100000210202 [0,2,0,0,0,0|1,1,0]=4 16072 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_100000210202_200010107346 [0,2,0,0,0,0|1,1,0]=4 16073 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_200010107346_100000210202 [0,2,0,0,0,0|1,1,0]=4 16074 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000210202_100000698207 [0,2,0,0,0,0|0,1,0]=3 16075 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000698207_100000210202 [0,2,0,0,0,0|0,1,0]=3 16076 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100000210202_100012355673 [0,2,0,0,0,0|0,1,0]=3 16077 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100012355673_100000210202 [0,2,0,0,0,0|0,1,0]=3 16078 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_100000210202_200010235796 [0,2,0,0,0,0|0,1,0]=3 16079 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_200010235796_100000210202 [0,2,0,0,0,0|0,1,0]=3 16080 B12R1.1123 CCSc1cc(c(cc1Cl)Br)C 62a_100000210202_100010259621 [0,2,0,0,0,0|1,1,0]=4 16081 B12R1.1123 CCSc1cc(c(cc1Cl)Br)C 62a_100010259621_100000210202 [0,2,0,0,0,0|1,1,0]=4 16082 B12R1.1123 CCSc1cc(c(cc1Cl)Br)Cl 62a_100000210202_200010244590 [0,2,0,0,0,0|1,1,0]=4 16083 B12R1.1123 CCSc1cc(c(cc1Cl)Br)Cl 62a_200010244590_100000210202 [0,2,0,0,0,0|1,1,0]=4 16084 B12R1.1123 CCSc1cc(c(cc1Cl)Br)F 62a_100000210202_100010212230 [0,2,0,0,0,0|1,1,0]=4 16085 B12R1.1123 CCSc1cc(c(cc1Cl)Br)F 62a_100010212230_100000210202 [0,2,0,0,0,0|1,1,0]=4 16086 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)Cl 62a_100000210202_200011216203 [0,2,0,0,0,0|1,1,0]=4 16087 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)Cl 62a_200011216203_100000210202 [0,2,0,0,0,0|1,1,0]=4 16088 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)N 62a_100000210202_100016224655 [0,2,0,0,0,0|1,1,0]=4 16089 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)N 62a_100016224655_100000210202 [0,2,0,0,0,0|1,1,0]=4 16090 B12R1.1123 CCSc1cc(c(cc1Cl)F)F 62a_100000210202_100012349977 [0,2,0,0,0,0|1,1,0]=4 16091 B12R1.1123 CCSc1cc(c(cc1Cl)F)F 62a_100012349977_100000210202 [0,2,0,0,0,0|1,1,0]=4 16092 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100000210202_100011011175 [0,2,0,0,0,0|0,1,0]=3 16093 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000210202 [0,2,0,0,0,0|0,1,0]=3 16094 B12R1.1123 CCSc1cc(c(cc1F)Br)Br 62a_100000210202_200010212210 [0,2,0,0,0,0|1,1,0]=4 16095 B12R1.1123 CCSc1cc(c(cc1F)Br)Br 62a_200010212210_100000210202 [0,2,0,0,0,0|1,1,0]=4 16096 B12R1.1123 CCSc1cc(c(cc1F)Br)C 62a_100000210202_200009814772 [0,2,0,0,0,0|1,1,0]=4 16097 B12R1.1123 CCSc1cc(c(cc1F)Br)C 62a_200009814772_100000210202 [0,2,0,0,0,0|1,1,0]=4 16098 B12R1.1123 CCSc1cc(c(cc1F)Br)F 62a_100000210202_100011356857 [0,2,0,0,0,0|1,1,0]=4 16099 B12R1.1123 CCSc1cc(c(cc1F)Br)F 62a_100011356857_100000210202 [0,2,0,0,0,0|1,1,0]=4 16100 B12R1.1123 CCSc1cc(c(cc1F)C)Br 62a_100000210202_100011068846 [0,2,0,0,0,0|1,1,0]=4 16101 B12R1.1123 CCSc1cc(c(cc1F)C)Br 62a_100011068846_100000210202 [0,2,0,0,0,0|1,1,0]=4 16102 B12R1.1123 CCSc1cc(c(cc1F)C)C 62a_100000210202_100010197417 [0,2,0,0,0,0|1,1,0]=4 16103 B12R1.1123 CCSc1cc(c(cc1F)C)C 62a_100010197417_100000210202 [0,2,0,0,0,0|1,1,0]=4 16104 B12R1.1123 CCSc1cc(c(cc1F)C)F 62a_100000210202_100011219510 [0,2,0,0,0,0|1,1,0]=4 16105 B12R1.1123 CCSc1cc(c(cc1F)C)F 62a_100011219510_100000210202 [0,2,0,0,0,0|1,1,0]=4 16106 B12R1.1123 CCSc1cc(c(cc1F)C)N 62a_100000210202_100000717900 [0,2,0,0,0,0|1,1,0]=4 16107 B12R1.1123 CCSc1cc(c(cc1F)C)N 62a_100000717900_100000210202 [0,2,0,0,0,0|1,1,0]=4 16108 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100000210202_100014242602 [0,2,0,0,0,0|1,1,0]=4 16109 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100014242602_100000210202 [0,2,0,0,0,0|1,1,0]=4 16110 B12R1.1123 CCSc1cc(c(cc1F)Cl)F 62a_100000210202_100010142863 [0,2,0,0,0,0|1,1,0]=4 16111 B12R1.1123 CCSc1cc(c(cc1F)Cl)F 62a_100010142863_100000210202 [0,2,0,0,0,0|1,1,0]=4 16112 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100000210202_100010735246 [0,2,0,0,0,0|1,1,0]=4 16113 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000210202 [0,2,0,0,0,0|1,1,0]=4 16114 B12R1.1123 CCSc1cc(c(cc1F)F)Br 62a_100000210202_100011356914 [0,2,0,0,0,0|1,1,0]=4 16115 B12R1.1123 CCSc1cc(c(cc1F)F)Br 62a_100011356914_100000210202 [0,2,0,0,0,0|1,1,0]=4 16116 B12R1.1123 CCSc1cc(c(cc1F)F)C 62a_100000210202_100000692463 [0,2,0,0,0,0|1,1,0]=4 16117 B12R1.1123 CCSc1cc(c(cc1F)F)C 62a_100000692463_100000210202 [0,2,0,0,0,0|1,1,0]=4 16118 B12R1.1123 CCSc1cc(c(cc1F)F)F 62a_100000210202_100011756838 [0,2,0,0,0,0|1,1,0]=4 16119 B12R1.1123 CCSc1cc(c(cc1F)F)F 62a_100011756838_100000210202 [0,2,0,0,0,0|1,1,0]=4 16120 B12R1.1123 CCSc1cc(c(cc1F)F)N 62a_100000210202_100000700208 [0,2,0,0,0,0|1,1,0]=4 16121 B12R1.1123 CCSc1cc(c(cc1F)F)N 62a_100000700208_100000210202 [0,2,0,0,0,0|1,1,0]=4 16122 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100000210202_100012457948 [0,2,0,0,0,0|1,1,0]=4 16123 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100012457948_100000210202 [0,2,0,0,0,0|1,1,0]=4 16124 B12R1.1123 CCSc1cc(c(cc1F)N)C 62a_100000210202_100000695870 [0,2,0,0,0,0|1,1,0]=4 16125 B12R1.1123 CCSc1cc(c(cc1F)N)C 62a_100000695870_100000210202 [0,2,0,0,0,0|1,1,0]=4 16126 B12R1.1123 CCSc1cc(c(cc1F)N)F 62a_100000210202_100000690247 [0,2,0,0,0,0|1,1,0]=4 16127 B12R1.1123 CCSc1cc(c(cc1F)N)F 62a_100000690247_100000210202 [0,2,0,0,0,0|1,1,0]=4 16128 B12R1.1123 CCSc1cc(c(cc1F)N)N 62a_100000210202_100000766667 [0,2,0,0,0,0|1,1,0]=4 16129 B12R1.1123 CCSc1cc(c(cc1F)N)N 62a_100000766667_100000210202 [0,2,0,0,0,0|1,1,0]=4 16130 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100000210202_100013038943 [0,2,0,0,0,0|1,1,0]=4 16131 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100013038943_100000210202 [0,2,0,0,0,0|1,1,0]=4 16132 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100000210202_100011830439 [0,2,0,0,0,0|0,1,0]=3 16133 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100011830439_100000210202 [0,2,0,0,0,0|0,1,0]=3 16134 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100000210202_100012359894 [0,2,0,0,0,0|0,1,0]=3 16135 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100012359894_100000210202 [0,2,0,0,0,0|0,1,0]=3 16136 B12R1.1123 CCSc1cc(c(cc1N)Br)C 62a_100000210202_200015600912 [0,2,0,0,0,0|1,1,0]=4 16137 B12R1.1123 CCSc1cc(c(cc1N)Br)C 62a_200015600912_100000210202 [0,2,0,0,0,0|1,1,0]=4 16138 B12R1.1123 CCSc1cc(c(cc1N)Br)F 62a_100000210202_200021016574 [0,2,0,0,0,0|1,1,0]=4 16139 B12R1.1123 CCSc1cc(c(cc1N)Br)F 62a_200021016574_100000210202 [0,2,0,0,0,0|1,1,0]=4 16140 B12R1.1123 CCSc1cc(c(cc1N)C)C 62a_100000210202_100012337760 [0,2,0,0,0,0|1,1,0]=4 16141 B12R1.1123 CCSc1cc(c(cc1N)C)C 62a_100012337760_100000210202 [0,2,0,0,0,0|1,1,0]=4 16142 B12R1.1123 CCSc1cc(c(cc1N)C)F 62a_100000210202_100010233353 [0,2,0,0,0,0|1,1,0]=4 16143 B12R1.1123 CCSc1cc(c(cc1N)C)F 62a_100010233353_100000210202 [0,2,0,0,0,0|1,1,0]=4 16144 B12R1.1123 CCSc1cc(c(cc1N)Cl)Cl 62a_100000210202_200011093942 [0,2,0,0,0,0|1,1,0]=4 16145 B12R1.1123 CCSc1cc(c(cc1N)Cl)Cl 62a_200011093942_100000210202 [0,2,0,0,0,0|1,1,0]=4 16146 B12R1.1123 CCSc1cc(c(cc1N)Cl)F 62a_100000210202_200010992381 [0,2,0,0,0,0|1,1,0]=4 16147 B12R1.1123 CCSc1cc(c(cc1N)Cl)F 62a_200010992381_100000210202 [0,2,0,0,0,0|1,1,0]=4 16148 B12R1.1123 CCSc1cc(c(cc1N)F)Br 62a_100000210202_100010888672 [0,2,0,0,0,0|1,1,0]=4 16149 B12R1.1123 CCSc1cc(c(cc1N)F)Br 62a_100010888672_100000210202 [0,2,0,0,0,0|1,1,0]=4 16150 B12R1.1123 CCSc1cc(c(cc1N)F)C 62a_100000210202_100011218008 [0,2,0,0,0,0|1,1,0]=4 16151 B12R1.1123 CCSc1cc(c(cc1N)F)C 62a_100011218008_100000210202 [0,2,0,0,0,0|1,1,0]=4 16152 B12R1.1123 CCSc1cc(c(cc1N)F)Cl 62a_100000210202_100010892166 [0,2,0,0,0,0|1,1,0]=4 16153 B12R1.1123 CCSc1cc(c(cc1N)F)Cl 62a_100010892166_100000210202 [0,2,0,0,0,0|1,1,0]=4 16154 B12R1.1123 CCSc1cc(c(cc1N)F)F 62a_100000210202_100000765032 [0,2,0,0,0,0|1,1,0]=4 16155 B12R1.1123 CCSc1cc(c(cc1N)F)F 62a_100000765032_100000210202 [0,2,0,0,0,0|1,1,0]=4 16156 B12R1.1123 CCSc1cc(c(cc1N)N)C 62a_100000210202_200013038441 [0,2,0,0,0,0|1,1,0]=4 16157 B12R1.1123 CCSc1cc(c(cc1N)N)C 62a_200013038441_100000210202 [0,2,0,0,0,0|1,1,0]=4 16158 B12R1.1123 CCSc1cc(c(cc1N)N)F 62a_100000210202_200010115645 [0,2,0,0,0,0|1,1,0]=4 16159 B12R1.1123 CCSc1cc(c(cc1N)N)F 62a_200010115645_100000210202 [0,2,0,0,0,0|1,1,0]=4 16160 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100000210202_100009814663 [0,2,0,0,0,0|1,1,0]=4 16161 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100009814663_100000210202 [0,2,0,0,0,0|1,1,0]=4 16162 B12R1.1123 CCSc1cc(c(cc1O)F)F 62a_100000210202_100009813768 [0,2,0,0,0,0|1,1,0]=4 16163 B12R1.1123 CCSc1cc(c(cc1O)F)F 62a_100009813768_100000210202 [0,2,0,0,0,0|1,1,0]=4 16164 B12R1.1123 Cc1cc(c(cc1Br)C)OCF 34a_100000698207_100015361967 [0,2,0,0,0,0|2,0,0]=4 16165 B12R1.1123 Cc1cc(c(cc1Br)C)OCF 7a_100000698207_100015361967 [0,2,0,0,0,0|2,0,0]=4 16166 B12R1.1123 Cc1cc(c(cc1Br)Cl)OCF 34a_200012350488_100015361967 [0,2,0,0,0,0|2,0,0]=4 16167 B12R1.1123 Cc1cc(c(cc1Br)Cl)OCF 7a_200012350488_100015361967 [0,2,0,0,0,0|2,0,0]=4 16168 B12R1.1123 Cc1cc(c(cc1Br)F)OCF 34a_100012355673_100015361967 [0,2,0,0,0,0|2,0,0]=4 16169 B12R1.1123 Cc1cc(c(cc1Br)F)OCF 7a_100012355673_100015361967 [0,2,0,0,0,0|2,0,0]=4 16170 B12R1.1123 Cc1cc(c(cc1Br)N)OCF 34a_200010235796_100015361967 [0,2,0,0,0,0|2,0,0]=4 16171 B12R1.1123 Cc1cc(c(cc1Br)N)OCF 7a_200010235796_100015361967 [0,2,0,0,0,0|2,0,0]=4 16172 B12R1.1123 Cc1cc(c(cc1Br)OCF)F 34a_100010068922_100015361967 [0,2,0,0,0,0|2,0,0]=4 16173 B12R1.1123 Cc1cc(c(cc1Br)OCF)F 7a_100010068922_100015361967 [0,2,0,0,0,0|2,0,0]=4 16174 B12R1.1123 Cc1cc(c(cc1Br)OCF)N 34a_200010107346_100015361967 [0,2,0,0,0,0|2,0,0]=4 16175 B12R1.1123 Cc1cc(c(cc1Br)OCF)N 7a_200010107346_100015361967 [0,2,0,0,0,0|2,0,0]=4 16176 B12R1.1123 Cc1cc(c(cc1C)OCF)Br 34a_100009814663_100015361967 [0,2,0,0,0,0|2,0,0]=4 16177 B12R1.1123 Cc1cc(c(cc1C)OCF)Br 7a_100009814663_100015361967 [0,2,0,0,0,0|2,0,0]=4 16178 B12R1.1123 Cc1cc(c(cc1C)OCF)C 34a_200000047129_100015361967 [0,2,0,0,0,0|2,0,0]=4 16179 B12R1.1123 Cc1cc(c(cc1C)OCF)C 7a_200000047129_100015361967 [0,2,0,0,0,0|2,0,0]=4 16180 B12R1.1123 Cc1cc(c(cc1C)OCF)Cl 34a_100000031796_100015361967 [0,2,0,0,0,0|2,0,0]=4 16181 B12R1.1123 Cc1cc(c(cc1C)OCF)Cl 7a_100000031796_100015361967 [0,2,0,0,0,0|2,0,0]=4 16182 B12R1.1123 Cc1cc(c(cc1C)OCF)N 34a_100133014134_100015361967 [0,2,0,0,0,0|2,0,0]=4 16183 B12R1.1123 Cc1cc(c(cc1C)OCF)N 7a_100133014134_100015361967 [0,2,0,0,0,0|2,0,0]=4 16184 B12R1.1123 Cc1cc(c(cc1Cl)Br)OCF 34a_100022700756_100015361967 [0,2,0,0,0,0|2,0,0]=4 16185 B12R1.1123 Cc1cc(c(cc1Cl)Br)OCF 7a_100022700756_100015361967 [0,2,0,0,0,0|2,0,0]=4 16186 B12R1.1123 Cc1cc(c(cc1Cl)Cl)OCF 34a_100012002691_100015361967 [0,2,0,0,0,0|2,0,0]=4 16187 B12R1.1123 Cc1cc(c(cc1Cl)Cl)OCF 7a_100012002691_100015361967 [0,2,0,0,0,0|2,0,0]=4 16188 B12R1.1123 Cc1cc(c(cc1Cl)N)OCF 34a_100000091707_100015361967 [0,2,0,0,0,0|2,0,0]=4 16189 B12R1.1123 Cc1cc(c(cc1Cl)N)OCF 7a_100000091707_100015361967 [0,2,0,0,0,0|2,0,0]=4 16190 B12R1.1123 Cc1cc(c(cc1F)C)OCF 34a_100010674473_100015361967 [0,2,0,0,0,0|2,0,0]=4 16191 B12R1.1123 Cc1cc(c(cc1F)C)OCF 7a_100010674473_100015361967 [0,2,0,0,0,0|2,0,0]=4 16192 B12R1.1123 Cc1cc(c(cc1F)OCF)N 34a_100012022779_100015361967 [0,2,0,0,0,0|2,0,0]=4 16193 B12R1.1123 Cc1cc(c(cc1F)OCF)N 7a_100012022779_100015361967 [0,2,0,0,0,0|2,0,0]=4 16194 B12R1.1123 Cc1cc(c(cc1I)C)OCF 34a_200011215153_100015361967 [0,2,0,0,0,0|2,0,0]=4 16195 B12R1.1123 Cc1cc(c(cc1I)C)OCF 7a_200011215153_100015361967 [0,2,0,0,0,0|2,0,0]=4 16196 B12R1.1123 Cc1cc(c(cc1N)C)OCF 34a_100000720036_100015361967 [0,2,0,0,0,0|2,0,0]=4 16197 B12R1.1123 Cc1cc(c(cc1N)C)OCF 7a_100000720036_100015361967 [0,2,0,0,0,0|2,0,0]=4 16198 B12R1.1123 Cc1cc(c(cc1N)OCF)Cl 34a_100009961766_100015361967 [0,2,0,0,0,0|2,0,0]=4 16199 B12R1.1123 Cc1cc(c(cc1N)OCF)Cl 7a_100009961766_100015361967 [0,2,0,0,0,0|2,0,0]=4 16200 B12R1.1123 Cc1cc(c(cc1O)C)NCF 34a_100000720036_100015361967 [0,2,0,0,0,0|2,0,0]=4 16201 B12R1.1123 Cc1cc(c(cc1O)C)NCF 7a_100000720036_100015361967 [0,2,0,0,0,0|2,0,0]=4 16202 B12R1.1123 Cc1cc(c(cc1O)C)SCF 62a_100000698207_100015361967 [0,2,0,0,0,0|1,1,0]=4 16203 B12R1.1123 Cc1cc(c(cc1O)C)SCF 62a_100015361967_100000698207 [0,2,0,0,0,0|1,1,0]=4 16204 B12R1.1123 Cc1cc(c(cc1OCF)Br)F 34a_100014242602_100015361967 [0,2,0,0,0,0|2,0,0]=4 16205 B12R1.1123 Cc1cc(c(cc1OCF)Br)F 7a_100014242602_100015361967 [0,2,0,0,0,0|2,0,0]=4 16206 B12R1.1123 Cc1cc(c(cc1OCF)F)F 34a_100000728840_100015361967 [0,2,0,0,0,0|2,0,0]=4 16207 B12R1.1123 Cc1cc(c(cc1OCF)F)F 7a_100000728840_100015361967 [0,2,0,0,0,0|2,0,0]=4 16208 B12R1.1123 Cc1cc(c(cc1OCF)I)F 34a_100010080512_100015361967 [0,2,0,0,0,0|2,0,0]=4 16209 B12R1.1123 Cc1cc(c(cc1OCF)I)F 7a_100010080512_100015361967 [0,2,0,0,0,0|2,0,0]=4 16210 B12R1.1123 Cc1cc(c(cc1OCF)N)Cl 34a_100000092876_100015361967 [0,2,0,0,0,0|2,0,0]=4 16211 B12R1.1123 Cc1cc(c(cc1OCF)N)Cl 7a_100000092876_100015361967 [0,2,0,0,0,0|2,0,0]=4 16212 B12R1.1123 Cc1cc(c(cc1OCF)N)F 34a_100000117193_100015361967 [0,2,0,0,0,0|2,0,0]=4 16213 B12R1.1123 Cc1cc(c(cc1OCF)N)F 7a_100000117193_100015361967 [0,2,0,0,0,0|2,0,0]=4 16214 B12R1.1123 Cc1cc(c(cc1SCF)F)O 62a_100012355673_100015361967 [0,2,0,0,0,0|1,1,0]=4 16215 B12R1.1123 Cc1cc(c(cc1SCF)F)O 62a_100015361967_100012355673 [0,2,0,0,0,0|1,1,0]=4 16216 B12R1.1123 Cc1cc(c(cc1SCF)N)O 62a_100015361967_200010235796 [0,2,0,0,0,0|1,1,0]=4 16217 B12R1.1123 Cc1cc(c(cc1SCF)N)O 62a_200010235796_100015361967 [0,2,0,0,0,0|1,1,0]=4 16218 B12R1.1123 FCOc1cc(c(cc1Br)F)F 34a_100009813768_100015361967 [0,2,0,0,0,0|2,0,0]=4 16219 B12R1.1123 FCOc1cc(c(cc1Br)F)F 7a_100009813768_100015361967 [0,2,0,0,0,0|2,0,0]=4 16220 B12R1.1123 FCOc1cc(c(cc1Cl)Br)Cl 34a_100000719705_100015361967 [0,2,0,0,0,0|2,0,0]=4 16221 B12R1.1123 FCOc1cc(c(cc1Cl)Br)Cl 7a_100000719705_100015361967 [0,2,0,0,0,0|2,0,0]=4 16222 B12R1.1123 FCOc1cc(c(cc1Cl)Br)F 34a_100000726166_100015361967 [0,2,0,0,0,0|2,0,0]=4 16223 B12R1.1123 FCOc1cc(c(cc1Cl)Br)F 7a_100000726166_100015361967 [0,2,0,0,0,0|2,0,0]=4 16224 B12R1.1123 FCOc1cc(c(cc1Cl)Br)I 34a_100021297947_100015361967 [0,2,0,0,0,0|2,0,0]=4 16225 B12R1.1123 FCOc1cc(c(cc1Cl)Br)I 7a_100021297947_100015361967 [0,2,0,0,0,0|2,0,0]=4 16226 B12R1.1123 FCOc1cc(c(cc1Cl)Cl)Br 34a_100010203734_100015361967 [0,2,0,0,0,0|2,0,0]=4 16227 B12R1.1123 FCOc1cc(c(cc1Cl)Cl)Br 7a_100010203734_100015361967 [0,2,0,0,0,0|2,0,0]=4 16228 B12R1.1123 FCOc1cc(c(cc1Cl)Cl)Cl 34a_100000211312_100015361967 [0,2,0,0,0,0|2,0,0]=4 16229 B12R1.1123 FCOc1cc(c(cc1Cl)Cl)Cl 7a_100000211312_100015361967 [0,2,0,0,0,0|2,0,0]=4 16230 B12R1.1123 FCOc1cc(c(cc1Cl)F)Br 34a_100010189047_100015361967 [0,2,0,0,0,0|2,0,0]=4 16231 B12R1.1123 FCOc1cc(c(cc1Cl)F)Br 7a_100010189047_100015361967 [0,2,0,0,0,0|2,0,0]=4 16232 B12R1.1123 FCOc1cc(c(cc1Cl)F)F 34a_100009848785_100015361967 [0,2,0,0,0,0|2,0,0]=4 16233 B12R1.1123 FCOc1cc(c(cc1Cl)F)F 7a_100009848785_100015361967 [0,2,0,0,0,0|2,0,0]=4 16234 B12R1.1123 FCOc1cc(c(cc1Cl)F)I 34a_100010735246_100015361967 [0,2,0,0,0,0|2,0,0]=4 16235 B12R1.1123 FCOc1cc(c(cc1Cl)F)I 7a_100010735246_100015361967 [0,2,0,0,0,0|2,0,0]=4 16236 B12R1.1123 FCOc1cc(c(cc1F)Br)F 34a_100011830439_100015361967 [0,2,0,0,0,0|2,0,0]=4 16237 B12R1.1123 FCOc1cc(c(cc1F)Br)F 7a_100011830439_100015361967 [0,2,0,0,0,0|2,0,0]=4 16238 B12R1.1123 FCOc1cc(c(cc1F)F)Br 34a_100012457948_100015361967 [0,2,0,0,0,0|2,0,0]=4 16239 B12R1.1123 FCOc1cc(c(cc1F)F)Br 7a_100012457948_100015361967 [0,2,0,0,0,0|2,0,0]=4 16240 B12R1.1123 FCOc1cc(c(cc1F)F)F 34a_100000237555_100015361967 [0,2,0,0,0,0|2,0,0]=4 16241 B12R1.1123 FCOc1cc(c(cc1F)F)F 7a_100000237555_100015361967 [0,2,0,0,0,0|2,0,0]=4 16242 B12R1.1123 FCOc1cc(c(cc1F)F)I 34a_100015789030_100015361967 [0,2,0,0,0,0|2,0,0]=4 16243 B12R1.1123 FCOc1cc(c(cc1F)F)I 7a_100015789030_100015361967 [0,2,0,0,0,0|2,0,0]=4 16244 B12R1.1123 FCOc1cc(c(cc1I)F)F 34a_100010749349_100015361967 [0,2,0,0,0,0|2,0,0]=4 16245 B12R1.1123 FCOc1cc(c(cc1I)F)F 7a_100010749349_100015361967 [0,2,0,0,0,0|2,0,0]=4 16246 B12R1.1123 Nc1cc(c(cc1Br)OCF)Br 34a_100011080774_100015361967 [0,2,0,0,0,0|2,0,0]=4 16247 B12R1.1123 Nc1cc(c(cc1Br)OCF)Br 7a_100011080774_100015361967 [0,2,0,0,0,0|2,0,0]=4 16248 B12R1.1123 Nc1cc(c(cc1Cl)Cl)OCF 34a_100000037174_100015361967 [0,2,0,0,0,0|2,0,0]=4 16249 B12R1.1123 Nc1cc(c(cc1Cl)Cl)OCF 7a_100000037174_100015361967 [0,2,0,0,0,0|2,0,0]=4 16250 B12R1.1123 Nc1cc(c(cc1Cl)OCF)Cl 34a_100012000071_100015361967 [0,2,0,0,0,0|2,0,0]=4 16251 B12R1.1123 Nc1cc(c(cc1Cl)OCF)Cl 7a_100012000071_100015361967 [0,2,0,0,0,0|2,0,0]=4 16252 B12R1.1123 Nc1cc(c(cc1Cl)OCF)F 34a_100009886023_100015361967 [0,2,0,0,0,0|2,0,0]=4 16253 B12R1.1123 Nc1cc(c(cc1Cl)OCF)F 7a_100009886023_100015361967 [0,2,0,0,0,0|2,0,0]=4 16254 B12R1.1123 Nc1cc(c(cc1F)Cl)OCF 34a_100000042052_100015361967 [0,2,0,0,0,0|2,0,0]=4 16255 B12R1.1123 Nc1cc(c(cc1F)Cl)OCF 7a_100000042052_100015361967 [0,2,0,0,0,0|2,0,0]=4 16256 B12R1.1123 Nc1cc(c(cc1F)F)OCF 34a_100011219470_100015361967 [0,2,0,0,0,0|2,0,0]=4 16257 B12R1.1123 Nc1cc(c(cc1F)F)OCF 7a_100011219470_100015361967 [0,2,0,0,0,0|2,0,0]=4 16258 B12R1.1123 Nc1cc(c(cc1F)OCF)F 34a_100020635945_100015361967 [0,2,0,0,0,0|2,0,0]=4 16259 B12R1.1123 Nc1cc(c(cc1F)OCF)F 7a_100020635945_100015361967 [0,2,0,0,0,0|2,0,0]=4 16260 B12R1.1123 Nc1cc(c(cc1O)Cl)SCF 62a_100011011175_100015361967 [0,2,0,0,0,0|1,1,0]=4 16261 B12R1.1123 Nc1cc(c(cc1O)Cl)SCF 62a_100015361967_100011011175 [0,2,0,0,0,0|1,1,0]=4 16262 B12R1.1123 Nc1cc(c(cc1O)F)SCF 62a_100012359894_100015361967 [0,2,0,0,0,0|1,1,0]=4 16263 B12R1.1123 Nc1cc(c(cc1O)F)SCF 62a_100015361967_100012359894 [0,2,0,0,0,0|1,1,0]=4 16264 B12R1.1123 Nc1cc(c(cc1OCF)Br)Br 34a_200010781931_100015361967 [0,2,0,0,0,0|2,0,0]=4 16265 B12R1.1123 Nc1cc(c(cc1OCF)Br)Br 7a_200010781931_100015361967 [0,2,0,0,0,0|2,0,0]=4 16266 B12R1.1123 Nc1cc(c(cc1OCF)Br)F 34a_100013038943_100015361967 [0,2,0,0,0,0|2,0,0]=4 16267 B12R1.1123 Nc1cc(c(cc1OCF)Br)F 7a_100013038943_100015361967 [0,2,0,0,0,0|2,0,0]=4 16268 B12R1.1123 Nc1cc(c(cc1OCF)Cl)Br 34a_100013488937_100015361967 [0,2,0,0,0,0|2,0,0]=4 16269 B12R1.1123 Nc1cc(c(cc1OCF)Cl)Br 7a_100013488937_100015361967 [0,2,0,0,0,0|2,0,0]=4 16270 B12R1.1123 Nc1cc(c(cc1OCF)Cl)Cl 34a_100000696747_100015361967 [0,2,0,0,0,0|2,0,0]=4 16271 B12R1.1123 Nc1cc(c(cc1OCF)Cl)Cl 7a_100000696747_100015361967 [0,2,0,0,0,0|2,0,0]=4 16272 B12R1.1123 Nc1cc(c(cc1OCF)Cl)I 34a_100011011175_100015361967 [0,2,0,0,0,0|2,0,0]=4 16273 B12R1.1123 Nc1cc(c(cc1OCF)Cl)I 7a_100011011175_100015361967 [0,2,0,0,0,0|2,0,0]=4 16274 B12R1.1123 Nc1cc(c(cc1OCF)F)Br 34a_100012359894_100015361967 [0,2,0,0,0,0|2,0,0]=4 16275 B12R1.1123 Nc1cc(c(cc1OCF)F)Br 7a_100012359894_100015361967 [0,2,0,0,0,0|2,0,0]=4 16276 B12R1.1123 Nc1cc(c(cc1OCF)F)F 34a_100011217416_100015361967 [0,2,0,0,0,0|2,0,0]=4 16277 B12R1.1123 Nc1cc(c(cc1OCF)F)F 7a_100011217416_100015361967 [0,2,0,0,0,0|2,0,0]=4 16278 B12R1.1123 Oc1cc(c(cc1Br)NCF)Br 34a_100011080774_100015361967 [0,2,0,0,0,0|2,0,0]=4 16279 B12R1.1123 Oc1cc(c(cc1Br)NCF)Br 7a_100011080774_100015361967 [0,2,0,0,0,0|2,0,0]=4 16280 B12R1.1123 Oc1cc(c(cc1Cl)NCF)Cl 34a_100012000071_100015361967 [0,2,0,0,0,0|2,0,0]=4 16281 B12R1.1123 Oc1cc(c(cc1Cl)NCF)Cl 7a_100012000071_100015361967 [0,2,0,0,0,0|2,0,0]=4 16282 B12R1.1123 Oc1cc(c(cc1F)NCF)Cl 34a_100009886023_100015361967 [0,2,0,0,0,0|2,0,0]=4 16283 B12R1.1123 Oc1cc(c(cc1F)NCF)Cl 7a_100009886023_100015361967 [0,2,0,0,0,0|2,0,0]=4 16284 B12R1.1123 Oc1cc(c(cc1F)NCF)F 34a_100020635945_100015361967 [0,2,0,0,0,0|2,0,0]=4 16285 B12R1.1123 Oc1cc(c(cc1F)NCF)F 7a_100020635945_100015361967 [0,2,0,0,0,0|2,0,0]=4 16286 B12R1.1123 Oc1cc(c(cc1F)SCF)F 62a_100011830439_100015361967 [0,2,0,0,0,0|1,1,0]=4 16287 B12R1.1123 Oc1cc(c(cc1F)SCF)F 62a_100015361967_100011830439 [0,2,0,0,0,0|1,1,0]=4 16288 B12R1.113 C=C(C)c1ccc(cc1)CCC 271570a_100000694244_100000750032 [0,2,0,0,0,0|2,0,0]=4 16289 B12R1.113 C=C(C)c1ccc(cc1)NCC 271570a_100000694244_100000219632 [0,2,0,0,0,0|2,0,0]=4 16290 B12R1.113 C=C(C)c1ccc(cc1)OCC 271570a_100000694244_100000169946 [0,2,0,0,0,0|1,0,0]=3 16291 B12R1.113 C=C(C)c1ccc(cc1)OCC 34a_100009880102_100000210202 [0,2,0,0,0,0|1,0,0]=3 16292 B12R1.113 C=C(C)c1ccc(cc1)OCC 7a_100009880102_100000210202 [0,2,0,0,0,0|1,0,0]=3 16293 B12R1.113 C=C(C)c1ccc(cc1)OCF 34a_100009880102_100015361967 [0,2,0,0,0,0|2,0,0]=4 16294 B12R1.113 C=C(C)c1ccc(cc1)OCF 7a_100009880102_100015361967 [0,2,0,0,0,0|2,0,0]=4 16295 B12R1.113 C=C(C)c1ccc(cc1)SCC 271570a_100000694244_200009811893 [0,2,0,0,0,0|1,1,0]=4 16296 B12R1.113 C=C(C)c1ccc(cc1)SCC 62a_100000185454_100000210202 [0,2,0,0,0,0|1,1,0]=4 16297 B12R1.113 C=C(C)c1ccc(cc1)SCC 62a_100000210202_100000185454 [0,2,0,0,0,0|1,1,0]=4 16298 B12R1.113 C=C(C)c1ccc(cn1)OCC 271570a_100000694244_100000753957 [0,2,0,0,0,0|2,0,0]=4 16299 B12R1.113 C=C(C)c1ccc(nc1)OCC 271570a_100000694244_100011219444 [0,2,0,0,0,0|2,0,0]=4 16300 B12R1.113 CC(=O)c1ccc(cc1)OCF 34a_100000185113_100015361967 [0,2,0,0,0,0|1,0,1]=4 16301 B12R1.113 CC(=O)c1ccc(cc1)OCF 7a_100000185113_100015361967 [0,2,0,0,0,0|1,0,1]=4 16302 B12R1.113 CC(C)c1ccc(cc1)OCF 34a_100000181308_100015361967 [0,2,0,0,0,0|2,0,0]=4 16303 B12R1.113 CC(C)c1ccc(cc1)OCF 7a_100000181308_100015361967 [0,2,0,0,0,0|2,0,0]=4 16304 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 2230a_200000048501_200025704644 [0,2,0,0,0,0|2,0,0]=4 16305 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 34a_200000048501_200025704644 [0,2,0,0,0,0|2,0,0]=4 16306 B12R1.113 CC(O)c1ccc(cc1)NCF 34a_100011216399_100015361967 [0,2,0,0,0,0|2,0,0]=4 16307 B12R1.113 CC(O)c1ccc(cc1)OCF 34a_100000754508_100015361967 [0,2,0,0,0,0|1,0,0]=3 16308 B12R1.113 CC(O)c1ccc(cc1)OCF 7a_100000754508_100015361967 [0,2,0,0,0,0|1,0,0]=3 16309 B12R1.113 CC(O)c1ccc(cc1)SCF 62a_100000745893_100015361967 [0,2,0,0,0,0|1,1,0]=4 16310 B12R1.113 CC(O)c1ccc(cc1)SCF 62a_100015361967_100000745893 [0,2,0,0,0,0|1,1,0]=4 16311 B12R1.113 CC=Cc1ccc(cc1)B(O)O 271570a_100016259895_100000754493 [0,2,0,0,0,0|1,0,1]=4 16312 B12R1.113 CC=Cc1ccc(cc1)C(C)O 271570a_100016259895_100000745893 [0,2,0,0,0,0|1,0,1]=4 16313 B12R1.113 CCCc1ccc(cc1)C(=O)C 1458a_100011207308_200000210301 [0,2,0,0,0,0|1,0,1]=4 16314 B12R1.113 CCCc1ccc(cc1)C(=O)[13CH3] 1458a_100011207308_200025704644 [0,2,0,0,0,0|1,0,1]=4 16315 B12R1.113 CCNc1ccc(cc1)C(=O)N 27a_100015525214_100000162191 [0,2,0,0,0,0|1,0,1]=4 16316 B12R1.113 CCNc1ccc(cc1)C(=O)N 34a_100000210537_100000210202 [0,2,0,0,0,0|1,0,1]=4 16317 B12R1.113 CCNc1ccc(cc1)C(C)C 2230a_100000210773_100000210202 [0,2,0,0,0,0|2,0,0]=4 16318 B12R1.113 CCNc1ccc(cc1)C(C)C 34a_100000210773_100000210202 [0,2,0,0,0,0|2,0,0]=4 16319 B12R1.113 CCNc1ccc(cc1)C(C)C 7a_100000210773_100000210202 [0,2,0,0,0,0|2,0,0]=4 16320 B12R1.113 CCNc1ccc(cc1)C(C)O 2230a_100011216399_100000210202 [0,2,0,0,0,0|1,0,0]=3 16321 B12R1.113 CCNc1ccc(cc1)C(C)O 34a_100011216399_100000210202 [0,2,0,0,0,0|1,0,0]=3 16322 B12R1.113 CCNc1ccc(cc1)C(F)F 34a_100020620101_100000210202 [0,2,0,0,0,0|2,0,0]=4 16323 B12R1.113 CCNc1ccc(cc1)C(F)F 7a_100020620101_100000210202 [0,2,0,0,0,0|2,0,0]=4 16324 B12R1.113 CCNc1ccc(cc1)N(C)C 34a_100016997997_100000210202 [0,2,0,0,0,0|2,0,0]=4 16325 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210202 [0,2,0,0,0,0|1,0,1]=4 16326 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210202 [0,2,0,0,0,0|1,0,1]=4 16327 B12R1.113 CCOc1ccc(cc1)C(=O)C 1458a_100000181891_200000210301 [0,2,0,0,0,0|0,0,1]=3 16328 B12R1.113 CCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210202 [0,2,0,0,0,0|0,0,1]=3 16329 B12R1.113 CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210202 [0,2,0,0,0,0|0,0,1]=3 16330 B12R1.113 CCOc1ccc(cc1)C(=O)N 34a_100000746352_100000210202 [0,2,0,0,0,0|0,0,1]=3 16331 B12R1.113 CCOc1ccc(cc1)C(=O)N 7a_100000746352_100000210202 [0,2,0,0,0,0|0,0,1]=3 16332 B12R1.113 CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000181891_200025704644 [0,2,0,0,0,0|0,0,1]=3 16333 B12R1.113 CCOc1ccc(cc1)C(C)C 34a_100000181308_100000210202 [0,2,0,0,0,0|1,0,0]=3 16334 B12R1.113 CCOc1ccc(cc1)C(C)C 7a_100000181308_100000210202 [0,2,0,0,0,0|1,0,0]=3 16335 B12R1.113 CCOc1ccc(cc1)C(C)O 34a_100000754508_100000210202 [0,2,0,0,0,0|0,0,0]=2 16336 B12R1.113 CCOc1ccc(cc1)C(C)O 7a_100000754508_100000210202 [0,2,0,0,0,0|0,0,0]=2 16337 B12R1.113 CCOc1ccc(cc1)N(C)C 2230a_100025784348_200000210301 [0,2,0,0,0,0|1,0,0]=3 16338 B12R1.113 CCOc1ccc(cc1)N(C)C 269982a_100025784348_200000210301 [0,2,0,0,0,0|1,0,0]=3 16339 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100000718910_100000210202 [0,2,0,0,0,0|1,0,0]=3 16340 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100025784348_200000210301 [0,2,0,0,0,0|1,0,0]=3 16341 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 2230a_100025784348_200025704644 [0,2,0,0,0,0|1,0,0]=3 16342 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 269982a_100025784348_200025704644 [0,2,0,0,0,0|1,0,0]=3 16343 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 34a_100025784348_200025704644 [0,2,0,0,0,0|1,0,0]=3 16344 B12R1.113 CCOc1ccc(cc1)S(=O)C 34a_200000064373_100000210202 [0,2,0,0,0,0|0,0,1]=3 16345 B12R1.113 CCOc1ccc(cc1)S(=O)C 7a_200000064373_100000210202 [0,2,0,0,0,0|0,0,1]=3 16346 B12R1.113 CCOc1ccc(cc1)[C@H](C)N 34a_100161106496_100000210202 [0,2,0,0,0,0|1,0,0]=3 16347 B12R1.113 CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210202 [0,2,0,0,0,0|0,0,1]=3 16348 B12R1.113 CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210202 [0,2,0,0,0,0|0,0,1]=3 16349 B12R1.113 CCOc1ccc(cc1)[S+](C)C 34a_100010188728_100000210202 [0,2,0,0,0,0|0,1,0]=3 16350 B12R1.113 CCOc1ccc(cc1)[S+](C)C 7a_100010188728_100000210202 [0,2,0,0,0,0|0,1,0]=3 16351 B12R1.113 CCOc1ccc(nc1)C(=O)C 34a_100012001710_100000210202 [0,2,0,0,0,0|1,0,1]=4 16352 B12R1.113 CCOc1ccc(nc1)C(=O)C 7a_100012001710_100000210202 [0,2,0,0,0,0|1,0,1]=4 16353 B12R1.113 CCOc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000210202 [0,2,0,0,0,0|1,0,1]=4 16354 B12R1.113 CCSc1ccc(cc1)B(O)O 62a_100000210202_100000754493 [0,2,0,0,0,0|0,1,0]=3 16355 B12R1.113 CCSc1ccc(cc1)B(O)O 62a_100000754493_100000210202 [0,2,0,0,0,0|0,1,0]=3 16356 B12R1.113 CCSc1ccc(cc1)C(=O)C 1458a_100000244969_200000210301 [0,2,0,0,0,0|0,1,1]=4 16357 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210202 [0,2,0,0,0,0|0,1,1]=4 16358 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000210202_100000185465 [0,2,0,0,0,0|0,1,1]=4 16359 B12R1.113 CCSc1ccc(cc1)C(=O)N 62a_100000162191_100000210202 [0,2,0,0,0,0|0,1,1]=4 16360 B12R1.113 CCSc1ccc(cc1)C(=O)N 62a_100000210202_100000162191 [0,2,0,0,0,0|0,1,1]=4 16361 B12R1.113 CCSc1ccc(cc1)C(=O)[13CH3] 1458a_100000244969_200025704644 [0,2,0,0,0,0|0,1,1]=4 16362 B12R1.113 CCSc1ccc(cc1)C(C)C 62a_100000210202_100000750031 [0,2,0,0,0,0|1,1,0]=4 16363 B12R1.113 CCSc1ccc(cc1)C(C)C 62a_100000750031_100000210202 [0,2,0,0,0,0|1,1,0]=4 16364 B12R1.113 CCSc1ccc(cc1)C(C)O 62a_100000210202_100000745893 [0,2,0,0,0,0|0,1,0]=3 16365 B12R1.113 CCSc1ccc(cc1)C(C)O 62a_100000745893_100000210202 [0,2,0,0,0,0|0,1,0]=3 16366 B12R1.113 CCSc1ccc(cc1)C(F)F 62a_100000210202_100000687661 [0,2,0,0,0,0|1,1,0]=4 16367 B12R1.113 CCSc1ccc(cc1)C(F)F 62a_100000687661_100000210202 [0,2,0,0,0,0|1,1,0]=4 16368 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210202_100000210421 [0,2,0,0,0,0|1,1,0]=4 16369 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210421_100000210202 [0,2,0,0,0,0|1,1,0]=4 16370 B12R1.113 CCSc1ccc(cc1)S(=O)C 62a_100009816266_100000210202 [0,2,0,0,0,0|0,1,1]=4 16371 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N 62a_100000210202_100000720352 [0,2,0,0,0,0|1,1,0]=4 16372 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N 62a_100000720352_100000210202 [0,2,0,0,0,0|1,1,0]=4 16373 B12R1.113 CCSc1ccc(cc1)[C@H](C)N 62a_100000210202_100000753911 [0,2,0,0,0,0|1,1,0]=4 16374 B12R1.113 CCSc1ccc(cc1)[C@H](C)N 62a_100000753911_100000210202 [0,2,0,0,0,0|1,1,0]=4 16375 B12R1.113 CCSc1ccc(cn1)B(O)O 62a_100000210202_100000688115 [0,2,0,0,0,0|1,1,0]=4 16376 B12R1.113 CCSc1ccc(cn1)B(O)O 62a_100000688115_100000210202 [0,2,0,0,0,0|1,1,0]=4 16377 B12R1.113 CCSc1ccc(cn1)C(C)O 62a_100000210202_200010274204 [0,2,0,0,0,0|1,1,0]=4 16378 B12R1.113 CCSc1ccc(cn1)C(C)O 62a_200010274204_100000210202 [0,2,0,0,0,0|1,1,0]=4 16379 B12R1.113 CCSc1ccc(nc1)B(O)O 62a_100000210202_200010198023 [0,2,0,0,0,0|1,1,0]=4 16380 B12R1.113 CCSc1ccc(nc1)B(O)O 62a_200010198023_100000210202 [0,2,0,0,0,0|1,1,0]=4 16381 B12R1.113 CCSc1ccc(nc1)C(C)O 62a_100000210202_100012353650 [0,2,0,0,0,0|1,1,0]=4 16382 B12R1.113 CCSc1ccc(nc1)C(C)O 62a_100012353650_100000210202 [0,2,0,0,0,0|1,1,0]=4 16383 B12R1.113 CN(C)c1ccc(cc1)OCF 34a_100000718910_100015361967 [0,2,0,0,0,0|2,0,0]=4 16384 B12R1.113 CNCc1ccc(cc1)B(O)O 2230a_106832991635_100009813762 [0,2,0,0,0,0|2,0,0]=4 16385 B12R1.113 CNCc1ccc(cc1)B(O)O 34a_100102657272_100009813762 [0,2,0,0,0,0|2,0,0]=4 16386 B12R1.113 CNCc1ccc(cc1)B(O)O 7a_106832991635_100009813762 [0,2,0,0,0,0|2,0,0]=4 16387 B12R1.113 CNCc1ccc(cc1)C(=O)O 269956a_100000181780_200000210301 [0,2,0,0,0,0|2,0,0]=4 16388 B12R1.113 CNCc1ccc(cc1)C(C)O 2230a_200000048501_200000210301 [0,2,0,0,0,0|2,0,0]=4 16389 B12R1.113 CNCc1ccc(cc1)C(C)O 26a_100102657272_100000754508 [0,2,0,0,0,0|2,0,0]=4 16390 B12R1.113 CNCc1ccc(cc1)C(C)O 34a_200000048501_200000210301 [0,2,0,0,0,0|2,0,0]=4 16391 B12R1.113 COCc1ccc(cc1)B(O)O 34a_100138415774_100009813762 [0,2,0,0,0,0|2,0,0]=4 16392 B12R1.113 CS(=O)c1ccc(cc1)OCF 34a_200000064373_100015361967 [0,2,0,0,0,0|1,0,1]=4 16393 B12R1.113 CS(=O)c1ccc(cc1)OCF 7a_200000064373_100015361967 [0,2,0,0,0,0|1,0,1]=4 16394 B12R1.113 CSCc1ccc(cc1)B(O)O 62a_100009813762_200000210301 [0,2,0,0,0,0|2,0,0]=4 16395 B12R1.113 CSCc1ccc(cc1)B(O)O 62a_200000210301_100009813762 [0,2,0,0,0,0|2,0,0]=4 16396 B12R1.113 C[C@H](N)c1ccc(cc1)OCF 34a_100161106496_100015361967 [0,2,0,0,0,0|2,0,0]=4 16397 B12R1.113 C[S+](C)c1ccc(cc1)OCF 34a_100010188728_100015361967 [0,2,0,0,0,0|1,1,0]=4 16398 B12R1.113 C[S+](C)c1ccc(cc1)OCF 7a_100010188728_100015361967 [0,2,0,0,0,0|1,1,0]=4 16399 B12R1.113 NC(=O)c1ccc(cc1)OCF 34a_100000746352_100015361967 [0,2,0,0,0,0|1,0,1]=4 16400 B12R1.113 NC(=O)c1ccc(cc1)OCF 7a_100000746352_100015361967 [0,2,0,0,0,0|1,0,1]=4 16401 B12R1.113 O=[N+]([O-])c1ccc(cc1)OCF 34a_100000185810_100015361967 [0,2,0,0,0,0|1,0,1]=4 16402 B12R1.113 O=[N+]([O-])c1ccc(cc1)OCF 7a_100000185810_100015361967 [0,2,0,0,0,0|1,0,1]=4 16403 B12R1.113 OB(O)c1ccc(cc1)SCF 62a_100000754493_100015361967 [0,2,0,0,0,0|1,1,0]=4 16404 B12R1.113 OB(O)c1ccc(cc1)SCF 62a_100015361967_100000754493 [0,2,0,0,0,0|1,1,0]=4 16405 B12R1.113 [13CH3]NCc1ccc(cc1)C(=O)O 269956a_100000181780_200025704644 [0,2,0,0,0,0|2,0,0]=4 16406 B12R1.113 [13CH3]SCc1ccc(cc1)B(O)O 62a_100009813762_200025704644 [0,2,0,0,0,0|2,0,0]=4 16407 B12R1.113 [13CH3]SCc1ccc(cc1)B(O)O 62a_200025704644_100009813762 [0,2,0,0,0,0|2,0,0]=4 16408 B12R1.116 C/C=C/c1ccc(cc1)SCC 62a_100000210202_100016259036 [0,2,0,0,0,0|1,1,0]=4 16409 B12R1.116 C/C=C/c1ccc(cc1)SCC 62a_100016259036_100000210202 [0,2,0,0,0,0|1,1,0]=4 16410 B12R1.116 C=C=Cc1ccc(cc1)CCC 271570a_100015277604_100000750032 [0,2,0,0,0,0|2,0,0]=4 16411 B12R1.116 C=C=Cc1ccc(cc1)NCC 271570a_100015277604_100000219632 [0,2,0,0,0,0|2,0,0]=4 16412 B12R1.116 C=C=Cc1ccc(cc1)OCC 271570a_100015277604_100000169946 [0,2,0,0,0,0|1,0,0]=3 16413 B12R1.116 C=C=Cc1ccc(cc1)SCC 271570a_100015277604_200009811893 [0,2,0,0,0,0|1,1,0]=4 16414 B12R1.116 C=C=Cc1ccc(cn1)OCC 271570a_100015277604_100000753957 [0,2,0,0,0,0|2,0,0]=4 16415 B12R1.116 C=C=Cc1ccc(nc1)OCC 271570a_100015277604_100011219444 [0,2,0,0,0,0|2,0,0]=4 16416 B12R1.116 C=CCc1ccc(cc1)OCC 34a_100000078792_100000210202 [0,2,0,0,0,0|1,0,0]=3 16417 B12R1.116 C=CCc1ccc(cc1)OCC 7a_100000078792_100000210202 [0,2,0,0,0,0|1,0,0]=3 16418 B12R1.116 C=CCc1ccc(cc1)OCF 34a_100000078792_100015361967 [0,2,0,0,0,0|2,0,0]=4 16419 B12R1.116 C=CCc1ccc(cc1)OCF 7a_100000078792_100015361967 [0,2,0,0,0,0|2,0,0]=4 16420 B12R1.116 C=COc1ccc(cc1)SCC 62a_100000210202_100000704263 [0,2,0,0,0,0|0,1,0]=3 16421 B12R1.116 C=COc1ccc(cc1)SCC 62a_100000704263_100000210202 [0,2,0,0,0,0|0,1,0]=3 16422 B12R1.116 C=COc1ccc(cc1)SCF 62a_100000704263_100015361967 [0,2,0,0,0,0|1,1,0]=4 16423 B12R1.116 C=COc1ccc(cc1)SCF 62a_100015361967_100000704263 [0,2,0,0,0,0|1,1,0]=4 16424 B12R1.116 CC=Cc1ccc(cc1)CCC 271570a_100016259895_100000750032 [0,2,0,0,0,0|2,0,0]=4 16425 B12R1.116 CC=Cc1ccc(cc1)CCO 271570a_100016259895_100000766406 [0,2,0,0,0,0|1,0,1]=4 16426 B12R1.116 CC=Cc1ccc(cc1)COC 271570a_100016259895_100011493685 [0,2,0,0,0,0|1,0,1]=4 16427 B12R1.116 CC=Cc1ccc(cc1)NCC 271570a_100016259895_100000219632 [0,2,0,0,0,0|2,0,0]=4 16428 B12R1.116 CC=Cc1ccc(cc1)OCC 271570a_100016259895_100000169946 [0,2,0,0,0,0|1,0,0]=3 16429 B12R1.116 CC=Cc1ccc(cc1)SCC 271570a_100016259895_200009811893 [0,2,0,0,0,0|1,1,0]=4 16430 B12R1.116 CC=Cc1ccc(cn1)OCC 271570a_100016259895_100000753957 [0,2,0,0,0,0|2,0,0]=4 16431 B12R1.116 CC=Cc1ccc(nc1)OCC 271570a_100016259895_100011219444 [0,2,0,0,0,0|2,0,0]=4 16432 B12R1.116 CCCc1ccc(cc1)CNC 207a_100102657272_100000229940 [0,2,0,0,0,0|2,0,0]=4 16433 B12R1.116 CCCc1ccc(cc1)CNC 2230a_100020632977_200000210301 [0,2,0,0,0,0|2,0,0]=4 16434 B12R1.116 CCCc1ccc(cc1)CNC 2230a_106832991635_100011982809 [0,2,0,0,0,0|2,0,0]=4 16435 B12R1.116 CCCc1ccc(cc1)CNC 26a_100102657272_100000749406 [0,2,0,0,0,0|2,0,0]=4 16436 B12R1.116 CCCc1ccc(cc1)CNC 270004a_106832991635_100000229940 [0,2,0,0,0,0|2,0,0]=4 16437 B12R1.116 CCCc1ccc(cc1)CNC 34a_100020632977_200000210301 [0,2,0,0,0,0|2,0,0]=4 16438 B12R1.116 CCCc1ccc(cc1)CNC 34a_100102657272_100011982809 [0,2,0,0,0,0|2,0,0]=4 16439 B12R1.116 CCCc1ccc(cc1)CNC 7a_106832991635_100011982809 [0,2,0,0,0,0|2,0,0]=4 16440 B12R1.116 CCCc1ccc(cc1)CN[13CH3] 2230a_100020632977_200025704644 [0,2,0,0,0,0|2,0,0]=4 16441 B12R1.116 CCCc1ccc(cc1)CN[13CH3] 34a_100020632977_200025704644 [0,2,0,0,0,0|2,0,0]=4 16442 B12R1.116 CCCc1ccc(cc1)COC 34a_100138415774_100011982809 [0,2,0,0,0,0|1,0,0]=3 16443 B12R1.116 CCCc1ccc(cc1)CSC 62a_100011982809_200000210301 [0,2,0,0,0,0|1,1,0]=4 16444 B12R1.116 CCCc1ccc(cc1)CSC 62a_200000210301_100011982809 [0,2,0,0,0,0|1,1,0]=4 16445 B12R1.116 CCCc1ccc(cc1)CS[13CH3] 62a_100011982809_200025704644 [0,2,0,0,0,0|1,1,0]=4 16446 B12R1.116 CCCc1ccc(cc1)CS[13CH3] 62a_200025704644_100011982809 [0,2,0,0,0,0|1,1,0]=4 16447 B12R1.116 CCCc1ccc(cc1)NCC 2230a_100000211780_100000210202 [0,2,0,0,0,0|2,0,0]=4 16448 B12R1.116 CCCc1ccc(cc1)NCC 34a_100000211780_100000210202 [0,2,0,0,0,0|2,0,0]=4 16449 B12R1.116 CCCc1ccc(cc1)NCF 34a_100000211780_100015361967 [0,2,0,0,0,0|2,0,0]=4 16450 B12R1.116 CCCc1ccc(cc1)OCC 34a_100000749406_100000210202 [0,2,0,0,0,0|1,0,0]=3 16451 B12R1.116 CCCc1ccc(cc1)OCC 7a_100000749406_100000210202 [0,2,0,0,0,0|1,0,0]=3 16452 B12R1.116 CCCc1ccc(cc1)OCF 34a_100000749406_100015361967 [0,2,0,0,0,0|1,0,0]=3 16453 B12R1.116 CCCc1ccc(cc1)OCF 7a_100000749406_100015361967 [0,2,0,0,0,0|1,0,0]=3 16454 B12R1.116 CCCc1ccc(cc1)SCC 62a_100000210202_100000750032 [0,2,0,0,0,0|1,1,0]=4 16455 B12R1.116 CCCc1ccc(cc1)SCC 62a_100000750032_100000210202 [0,2,0,0,0,0|1,1,0]=4 16456 B12R1.116 CCCc1ccc(cc1)SCF 62a_100000750032_100015361967 [0,2,0,0,0,0|1,1,0]=4 16457 B12R1.116 CCCc1ccc(cc1)SCF 62a_100015361967_100000750032 [0,2,0,0,0,0|1,1,0]=4 16458 B12R1.116 CCNc1ccc(cc1)CC#N 34a_100000198999_100000210202 [0,2,0,0,0,0|2,0,0]=4 16459 B12R1.116 CCNc1ccc(cc1)CCO 2230a_100011204434_100000210202 [0,2,0,0,0,0|1,0,0]=3 16460 B12R1.116 CCNc1ccc(cc1)CCO 34a_100011204434_100000210202 [0,2,0,0,0,0|1,0,0]=3 16461 B12R1.116 CCNc1ccc(cc1)COC 34a_100000694113_100000210202 [0,2,0,0,0,0|1,0,0]=3 16462 B12R1.116 CCNc1ccc(cc1)CSC 2230a_106726388226_100000210202 [0,2,0,0,0,0|1,1,0]=4 16463 B12R1.116 CCNc1ccc(cc1)CSC 34a_106726388226_100000210202 [0,2,0,0,0,0|1,1,0]=4 16464 B12R1.116 CCNc1ccc(cc1)CSC 7a_106726388226_100000210202 [0,2,0,0,0,0|1,1,0]=4 16465 B12R1.116 CCNc1ccc(cc1)N=[N+]=[N-] 2230a_100000032754_100000210202 [0,2,0,0,0,0|2,0,0]=4 16466 B12R1.116 CCNc1ccc(cc1)OCC 2230a_100000739623_100000210202 [0,2,0,0,0,0|1,0,0]=3 16467 B12R1.116 CCNc1ccc(cc1)OCC 34a_100000739623_100000210202 [0,2,0,0,0,0|1,0,0]=3 16468 B12R1.116 CCNc1ccc(cc1)OCC 34a_100011337800_100000210202 [0,2,0,0,0,0|1,0,0]=3 16469 B12R1.116 CCNc1ccc(cc1)OCC 7a_100011337800_100000210202 [0,2,0,0,0,0|1,0,0]=3 16470 B12R1.116 CCNc1ccc(cc1)OCF 34a_100011337800_100015361967 [0,2,0,0,0,0|1,0,0]=3 16471 B12R1.116 CCNc1ccc(cc1)OCF 7a_100011337800_100015361967 [0,2,0,0,0,0|1,0,0]=3 16472 B12R1.116 CCNc1ccc(cc1)SCC 34a_100015187087_100000210202 [0,2,0,0,0,0|1,1,0]=4 16473 B12R1.116 CCNc1ccc(cc1)SCC 62a_100000210202_100000219632 [0,2,0,0,0,0|1,1,0]=4 16474 B12R1.116 CCNc1ccc(cc1)SCF 62a_100015361967_100000219632 [0,2,0,0,0,0|1,1,0]=4 16475 B12R1.116 CCOc1ccc(cc1)CC#N 34a_100000198970_100000210202 [0,2,0,0,0,0|1,0,0]=3 16476 B12R1.116 CCOc1ccc(cc1)CC#N 7a_100000198970_100000210202 [0,2,0,0,0,0|1,0,0]=3 16477 B12R1.116 CCOc1ccc(cc1)CCBr 34a_100009816426_100000210202 [0,2,0,0,0,0|1,0,0]=3 16478 B12R1.116 CCOc1ccc(cc1)CCBr 7a_100009816426_100000210202 [0,2,0,0,0,0|1,0,0]=3 16479 B12R1.116 CCOc1ccc(cc1)CCN 34a_100000743037_100000210202 [0,2,0,0,0,0|1,0,0]=3 16480 B12R1.116 CCOc1ccc(cc1)CCO 34a_100011215338_100000210202 [0,2,0,0,0,0|0,0,0]=2 16481 B12R1.116 CCOc1ccc(cc1)CCO 7a_100011215338_100000210202 [0,2,0,0,0,0|0,0,0]=2 16482 B12R1.116 CCOc1ccc(cc1)CNC 207a_100102657272_100000169836 [0,2,0,0,0,0|1,0,0]=3 16483 B12R1.116 CCOc1ccc(cc1)CNC 2230a_100000185588_200000210301 [0,2,0,0,0,0|1,0,0]=3 16484 B12R1.116 CCOc1ccc(cc1)CNC 270004a_106832991635_100000169836 [0,2,0,0,0,0|1,0,0]=3 16485 B12R1.116 CCOc1ccc(cc1)CNC 34a_100000185588_200000210301 [0,2,0,0,0,0|1,0,0]=3 16486 B12R1.116 CCOc1ccc(cc1)CNC 34a_100000207500_100000210202 [0,2,0,0,0,0|1,0,0]=3 16487 B12R1.116 CCOc1ccc(cc1)CN[13CH3] 2230a_100000185588_200025704644 [0,2,0,0,0,0|1,0,0]=3 16488 B12R1.116 CCOc1ccc(cc1)CN[13CH3] 34a_100000185588_200025704644 [0,2,0,0,0,0|1,0,0]=3 16489 B12R1.116 CCOc1ccc(cc1)COC 34a_100000173027_200000210301 [0,2,0,0,0,0|0,0,0]=2 16490 B12R1.116 CCOc1ccc(cc1)COC 34a_200011995677_100000210202 [0,2,0,0,0,0|0,0,0]=2 16491 B12R1.116 CCOc1ccc(cc1)COC 7a_100000173027_200000210301 [0,2,0,0,0,0|0,0,0]=2 16492 B12R1.116 CCOc1ccc(cc1)COC 7a_200011995677_100000210202 [0,2,0,0,0,0|0,0,0]=2 16493 B12R1.116 CCOc1ccc(cc1)CO[13CH3] 34a_100000173027_200025704644 [0,2,0,0,0,0|0,0,0]=2 16494 B12R1.116 CCOc1ccc(cc1)CO[13CH3] 7a_100000173027_200025704644 [0,2,0,0,0,0|0,0,0]=2 16495 B12R1.116 CCOc1ccc(cc1)NCF 34a_100000739623_100015361967 [0,2,0,0,0,0|1,0,0]=3 16496 B12R1.116 CCOc1ccc(cc1)OCC 34a_100000185467_100000210202 [0,2,0,0,0,0|0,0,0]=2 16497 B12R1.116 CCOc1ccc(cc1)OCF 34a_100000185467_100015361967 [0,2,0,0,0,0|0,0,0]=2 16498 B12R1.116 CCOc1ccc(cc1)SCC 62a_100000210202_100000171712 [0,2,0,0,0,0|0,1,0]=3 16499 B12R1.116 CCOc1ccc(cc1)SCF 62a_100015361967_100000171712 [0,2,0,0,0,0|0,1,0]=3 16500 B12R1.116 CCOc1ccc(cn1)CNC 207a_100102657272_100012002837 [0,2,0,0,0,0|2,0,0]=4 16501 B12R1.116 CCOc1ccc(cn1)CNC 2230a_100102710506_200000210301 [0,2,0,0,0,0|2,0,0]=4 16502 B12R1.116 CCOc1ccc(cn1)CNC 270004a_106832991635_100012002837 [0,2,0,0,0,0|2,0,0]=4 16503 B12R1.116 CCOc1ccc(cn1)CN[13CH3] 2230a_100102710506_200025704644 [0,2,0,0,0,0|2,0,0]=4 16504 B12R1.116 CCOc1ccc(cn1)SCC 62a_100000210202_100011219444 [0,2,0,0,0,0|1,1,0]=4 16505 B12R1.116 CCOc1ccc(cn1)SCC 62a_100011219444_100000210202 [0,2,0,0,0,0|1,1,0]=4 16506 B12R1.116 CCOc1ccc(cn1)SCF 62a_100011219444_100015361967 [0,2,0,0,0,0|1,1,0]=4 16507 B12R1.116 CCOc1ccc(cn1)SCF 62a_100015361967_100011219444 [0,2,0,0,0,0|1,1,0]=4 16508 B12R1.116 CCOc1ccc(nc1)COC 34a_200012645146_200000210301 [0,2,0,0,0,0|1,0,0]=3 16509 B12R1.116 CCOc1ccc(nc1)CO[13CH3] 34a_200012645146_200025704644 [0,2,0,0,0,0|1,0,0]=3 16510 B12R1.116 CCOc1ccc(nc1)SCC 62a_100000210202_100000753957 [0,2,0,0,0,0|1,1,0]=4 16511 B12R1.116 CCOc1ccc(nc1)SCC 62a_100012355646_100000210202 [0,2,0,0,0,0|1,1,0]=4 16512 B12R1.116 CCOc1ccc(nc1)SCF 62a_100012355646_100015361967 [0,2,0,0,0,0|1,1,0]=4 16513 B12R1.116 CCOc1ccc(nc1)SCF 62a_100015361967_100000753957 [0,2,0,0,0,0|1,1,0]=4 16514 B12R1.116 CCSc1ccc(cc1)/C=C/Br 62a_100000210202_200016255901 [0,2,0,0,0,0|1,1,0]=4 16515 B12R1.116 CCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000210202 [0,2,0,0,0,0|1,1,0]=4 16516 B12R1.116 CCSc1ccc(cc1)CC#N 62a_100000210202_100011217881 [0,2,0,0,0,0|1,1,0]=4 16517 B12R1.116 CCSc1ccc(cc1)CC#N 62a_100011217881_100000210202 [0,2,0,0,0,0|1,1,0]=4 16518 B12R1.116 CCSc1ccc(cc1)CC=O 62a_100000210202_100011361690 [0,2,0,0,0,0|0,1,1]=4 16519 B12R1.116 CCSc1ccc(cc1)CC=O 62a_100011361690_100000210202 [0,2,0,0,0,0|0,1,1]=4 16520 B12R1.116 CCSc1ccc(cc1)CCN 62a_100000210202_100000755846 [0,2,0,0,0,0|1,1,0]=4 16521 B12R1.116 CCSc1ccc(cc1)CCN 62a_100000755846_100000210202 [0,2,0,0,0,0|1,1,0]=4 16522 B12R1.116 CCSc1ccc(cc1)CCO 62a_100000210202_100000766406 [0,2,0,0,0,0|0,1,0]=3 16523 B12R1.116 CCSc1ccc(cc1)CCO 62a_100000766406_100000210202 [0,2,0,0,0,0|0,1,0]=3 16524 B12R1.116 CCSc1ccc(cc1)CNC 62a_100000180866_100000210202 [0,2,0,0,0,0|1,1,0]=4 16525 B12R1.116 CCSc1ccc(cc1)CNC 62a_100000210202_100000180866 [0,2,0,0,0,0|1,1,0]=4 16526 B12R1.116 CCSc1ccc(cc1)CNN 62a_100000210202_100016993955 [0,2,0,0,0,0|1,1,0]=4 16527 B12R1.116 CCSc1ccc(cc1)CNN 62a_100016993955_100000210202 [0,2,0,0,0,0|1,1,0]=4 16528 B12R1.116 CCSc1ccc(cc1)COC 62a_100000210202_100011493685 [0,2,0,0,0,0|0,1,0]=3 16529 B12R1.116 CCSc1ccc(cc1)COC 62a_100011493685_100000210202 [0,2,0,0,0,0|0,1,0]=3 16530 B12R1.116 CCSc1ccc(cc1)N=[N+]=[N-] 62a_100000210202_100000735661 [0,2,0,0,0,0|1,1,0]=4 16531 B12R1.116 CCSc1ccc(cc1)NC#N 62a_100000210202_100011685341 [0,2,0,0,0,0|1,1,0]=4 16532 B12R1.116 CCSc1ccc(cc1)NCF 34a_100015187087_100015361967 [0,2,0,0,0,0|1,1,0]=4 16533 B12R1.116 CCSc1ccc(cc1)SCC 62a_100000210202_200009811893 [0,2,0,0,0,0|0,2,0]=4 16534 B12R1.116 CCSc1ccc(cc1)SCC 62a_200009811893_100000210202 [0,2,0,0,0,0|0,2,0]=4 16535 B12R1.116 CCSc1ccc(cc1)SCF 62a_100015361967_200009811893 [0,2,0,0,0,0|0,2,0]=4 16536 B12R1.116 CCSc1ccc(cc1)SCF 62a_200009811893_100015361967 [0,2,0,0,0,0|0,2,0]=4 16537 B12R1.116 CCSc1ccc(cn1)CCO 62a_100000210202_100009880866 [0,2,0,0,0,0|1,1,0]=4 16538 B12R1.116 CCSc1ccc(cn1)CCO 62a_100009880866_100000210202 [0,2,0,0,0,0|1,1,0]=4 16539 B12R1.116 CCSc1ccc(nc1)CCO 62a_100000210202_100012357577 [0,2,0,0,0,0|1,1,0]=4 16540 B12R1.116 CCSc1ccc(nc1)CCO 62a_100012357577_100000210202 [0,2,0,0,0,0|1,1,0]=4 16541 B12R1.116 CNCc1ccc(cc1)CCO 26a_100102657272_100011215338 [0,2,0,0,0,0|2,0,0]=4 16542 B12R1.116 CNCc1ccc(cc1)COC 2230a_100000738208_200000210301 [0,2,0,0,0,0|2,0,0]=4 16543 B12R1.116 CNCc1ccc(cc1)COC 26a_100102657272_200011995677 [0,2,0,0,0,0|2,0,0]=4 16544 B12R1.116 CNCc1ccc(cc1)COC 34a_100000738208_200000210301 [0,2,0,0,0,0|2,0,0]=4 16545 B12R1.116 CNCc1ccc(cc1)OCF 34a_100000207500_100015361967 [0,2,0,0,0,0|2,0,0]=4 16546 B12R1.116 COCc1ccc(cc1)CN[13CH3] 2230a_100000738208_200025704644 [0,2,0,0,0,0|2,0,0]=4 16547 B12R1.116 COCc1ccc(cc1)CN[13CH3] 34a_100000738208_200025704644 [0,2,0,0,0,0|2,0,0]=4 16548 B12R1.116 COCc1ccc(cc1)NCF 34a_100000694113_100015361967 [0,2,0,0,0,0|2,0,0]=4 16549 B12R1.116 COCc1ccc(cc1)OCF 34a_200011995677_100015361967 [0,2,0,0,0,0|1,0,0]=3 16550 B12R1.116 COCc1ccc(cc1)OCF 7a_200011995677_100015361967 [0,2,0,0,0,0|1,0,0]=3 16551 B12R1.116 COCc1ccc(cc1)SCF 62a_100011493685_100015361967 [0,2,0,0,0,0|1,1,0]=4 16552 B12R1.116 COCc1ccc(cc1)SCF 62a_100015361967_100011493685 [0,2,0,0,0,0|1,1,0]=4 16553 B12R1.116 FCOc1ccc(cc1)CCBr 34a_100009816426_100015361967 [0,2,0,0,0,0|2,0,0]=4 16554 B12R1.116 FCOc1ccc(cc1)CCBr 7a_100009816426_100015361967 [0,2,0,0,0,0|2,0,0]=4 16555 B12R1.116 N#CCc1ccc(cc1)OCF 34a_100000198970_100015361967 [0,2,0,0,0,0|2,0,0]=4 16556 B12R1.116 N#CCc1ccc(cc1)OCF 7a_100000198970_100015361967 [0,2,0,0,0,0|2,0,0]=4 16557 B12R1.116 NCCc1ccc(cc1)OCF 34a_100000743037_100015361967 [0,2,0,0,0,0|2,0,0]=4 16558 B12R1.116 OCCc1ccc(cc1)NCF 34a_100011204434_100015361967 [0,2,0,0,0,0|2,0,0]=4 16559 B12R1.116 OCCc1ccc(cc1)OCF 34a_100011215338_100015361967 [0,2,0,0,0,0|1,0,0]=3 16560 B12R1.116 OCCc1ccc(cc1)OCF 7a_100011215338_100015361967 [0,2,0,0,0,0|1,0,0]=3 16561 B12R1.116 OCCc1ccc(cc1)SCF 62a_100000766406_100015361967 [0,2,0,0,0,0|1,1,0]=4 16562 B12R1.116 OCCc1ccc(cc1)SCF 62a_100015361967_100000766406 [0,2,0,0,0,0|1,1,0]=4 16563 B12R1.288 C#Cc1ccc(cc1Cl)NCC 2230a_100012001888_100000210202 [0,2,0,0,0,0|2,0,0]=4 16564 B12R1.288 C#Cc1ccc(cc1Cl)NCC 34a_100012001888_100000210202 [0,2,0,0,0,0|2,0,0]=4 16565 B12R1.288 C#Cc1ccc(cc1F)NCC 2230a_100012001886_100000210202 [0,2,0,0,0,0|2,0,0]=4 16566 B12R1.288 C#Cc1ccc(cc1F)NCC 34a_100012001886_100000210202 [0,2,0,0,0,0|2,0,0]=4 16567 B12R1.288 C=Cc1ccc(cc1C)NCC 271570a_100011290941_100015183089 [0,2,0,0,0,0|2,0,0]=4 16568 B12R1.288 C=Cc1ccc(cc1C)OCC 271570a_100011290941_100012344538 [0,2,0,0,0,0|1,0,0]=3 16569 B12R1.288 C=Cc1ccc(cc1F)CCC 271570a_100011290941_200010686677 [0,2,0,0,0,0|2,0,0]=4 16570 B12R1.288 C=Cc1ccc(cc1F)OCC 271570a_100011290941_100000692347 [0,2,0,0,0,0|1,0,0]=3 16571 B12R1.288 C=Cc1ccc(cc1F)SCC 62a_100000210202_100011935271 [0,2,0,0,0,0|1,1,0]=4 16572 B12R1.288 C=Cc1ccc(cc1F)SCC 62a_100011935271_100000210202 [0,2,0,0,0,0|1,1,0]=4 16573 B12R1.288 C=Cc1cnc(cc1C)OCC 271570a_100011290941_200012351029 [0,2,0,0,0,0|2,0,0]=4 16574 B12R1.288 CC=Cc1ccc(c(c1)Br)CO 271570a_100016259895_100010240206 [0,2,0,0,0,0|1,0,1]=4 16575 B12R1.288 CC=Cc1ccc(c(c1)Br)OC 271570a_100016259895_100011249507 [0,2,0,0,0,0|1,0,1]=4 16576 B12R1.288 CC=Cc1ccc(c(c1)C)CO 271570a_100016259895_100000748258 [0,2,0,0,0,0|1,0,1]=4 16577 B12R1.288 CC=Cc1ccc(c(c1)C)OC 271570a_100016259895_100011219705 [0,2,0,0,0,0|1,0,1]=4 16578 B12R1.288 CC=Cc1ccc(c(c1)Cl)OC 271570a_100016259895_100012355395 [0,2,0,0,0,0|1,0,1]=4 16579 B12R1.288 CC=Cc1ccc(c(c1)F)CO 271570a_100016259895_100011191541 [0,2,0,0,0,0|1,0,1]=4 16580 B12R1.288 CC=Cc1ccc(c(c1)F)OC 271570a_100016259895_100000185480 [0,2,0,0,0,0|1,0,1]=4 16581 B12R1.288 CC=Cc1ccc(c(c1)N)CO 271570a_100016259895_100000718831 [0,2,0,0,0,0|1,0,1]=4 16582 B12R1.288 CC=Cc1ccc(c(c1)N)OC 271570a_100016259895_100000743470 [0,2,0,0,0,0|1,0,1]=4 16583 B12R1.288 CC=Cc1ccc(c(c1)O)CO 271570a_100016259895_100000071718 [0,2,0,0,0,0|1,0,1]=4 16584 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [0,2,0,0,0,0|1,0,1]=4 16585 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200000210301_200010686677 [0,2,0,0,0,0|1,1,0]=4 16586 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200010686677_200000210301 [0,2,0,0,0,0|1,1,0]=4 16587 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200010686677_200025704644 [0,2,0,0,0,0|1,1,0]=4 16588 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_200010686677 [0,2,0,0,0,0|1,1,0]=4 16589 B12R1.288 CCNc1ccc(c(c1)Br)C#N 27a_100015525214_100012349582 [0,2,0,0,0,0|2,0,0]=4 16590 B12R1.288 CCNc1ccc(c(c1)Br)C#N 34a_100000689153_100000210202 [0,2,0,0,0,0|2,0,0]=4 16591 B12R1.288 CCNc1ccc(c(c1)Br)C#N 7a_100000689153_100000210202 [0,2,0,0,0,0|2,0,0]=4 16592 B12R1.288 CCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210202 [0,2,0,0,0,0|1,0,0]=3 16593 B12R1.288 CCNc1ccc(c(c1)C)C#N 34a_100011999795_100000210202 [0,2,0,0,0,0|2,0,0]=4 16594 B12R1.288 CCNc1ccc(c(c1)C)C#N 7a_100011999795_100000210202 [0,2,0,0,0,0|2,0,0]=4 16595 B12R1.288 CCNc1ccc(c(c1)C)CO 34a_100000102464_100000210202 [0,2,0,0,0,0|1,0,0]=3 16596 B12R1.288 CCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210202 [0,2,0,0,0,0|1,0,0]=3 16597 B12R1.288 CCNc1ccc(c(c1)C)OC 34a_100000743268_100000210202 [0,2,0,0,0,0|1,0,0]=3 16598 B12R1.288 CCNc1ccc(c(c1)C)OC 7a_100000743268_100000210202 [0,2,0,0,0,0|1,0,0]=3 16599 B12R1.288 CCNc1ccc(c(c1)C)SC 62a_100015183089_200000210301 [0,2,0,0,0,0|1,1,0]=4 16600 B12R1.288 CCNc1ccc(c(c1)C)SC 62a_200000210301_100015183089 [0,2,0,0,0,0|1,1,0]=4 16601 B12R1.288 CCNc1ccc(c(c1)C)S[13CH3] 62a_100015183089_200025704644 [0,2,0,0,0,0|1,1,0]=4 16602 B12R1.288 CCNc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100015183089 [0,2,0,0,0,0|1,1,0]=4 16603 B12R1.288 CCNc1ccc(c(c1)Cl)C#N 34a_100000211542_100000210202 [0,2,0,0,0,0|2,0,0]=4 16604 B12R1.288 CCNc1ccc(c(c1)Cl)C#N 7a_100000211542_100000210202 [0,2,0,0,0,0|2,0,0]=4 16605 B12R1.288 CCNc1ccc(c(c1)Cl)CC 2230a_100000766362_100000210202 [0,2,0,0,0,0|2,0,0]=4 16606 B12R1.288 CCNc1ccc(c(c1)Cl)CC 34a_100000766362_100000210202 [0,2,0,0,0,0|2,0,0]=4 16607 B12R1.288 CCNc1ccc(c(c1)Cl)CC 7a_100000766362_100000210202 [0,2,0,0,0,0|2,0,0]=4 16608 B12R1.288 CCNc1ccc(c(c1)Cl)CO 34a_100000689119_100000210202 [0,2,0,0,0,0|1,0,0]=3 16609 B12R1.288 CCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210202 [0,2,0,0,0,0|1,0,0]=3 16610 B12R1.288 CCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210202 [0,2,0,0,0,0|1,0,0]=3 16611 B12R1.288 CCNc1ccc(c(c1)F)C#N 27a_100015525214_100000037869 [0,2,0,0,0,0|2,0,0]=4 16612 B12R1.288 CCNc1ccc(c(c1)F)C#N 34a_100000765089_100000210202 [0,2,0,0,0,0|2,0,0]=4 16613 B12R1.288 CCNc1ccc(c(c1)F)C#N 7a_100000765089_100000210202 [0,2,0,0,0,0|2,0,0]=4 16614 B12R1.288 CCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210202 [0,2,0,0,0,0|1,0,0]=3 16615 B12R1.288 CCNc1ccc(c(c1)F)OC 34a_100000740183_100000210202 [0,2,0,0,0,0|1,0,0]=3 16616 B12R1.288 CCNc1ccc(c(c1)F)SC 2230a_100000762756_100000210202 [0,2,0,0,0,0|1,1,0]=4 16617 B12R1.288 CCNc1ccc(c(c1)F)SC 34a_100000762756_100000210202 [0,2,0,0,0,0|1,1,0]=4 16618 B12R1.288 CCNc1ccc(c(c1)I)OC 34a_100011356947_100000210202 [0,2,0,0,0,0|1,0,0]=3 16619 B12R1.288 CCNc1ccc(c(c1)O)C#N 34a_100000094571_100000210202 [0,2,0,0,0,0|2,0,0]=4 16620 B12R1.288 CCNc1ccc(c(c1)O)C#N 7a_100000094571_100000210202 [0,2,0,0,0,0|2,0,0]=4 16621 B12R1.288 CCNc1ccc(c(c1)O)OC 34a_100000211920_100000210202 [0,2,0,0,0,0|1,0,0]=3 16622 B12R1.288 CCNc1ccc(c(n1)F)CO 27a_100015525214_100010065253 [0,2,0,0,0,0|2,0,0]=4 16623 B12R1.288 CCNc1ccc(c(n1)F)OC 27a_100015525214_100010138636 [0,2,0,0,0,0|2,0,0]=4 16624 B12R1.288 CCOc1cc(c(cn1)SC)C 62a_200000210301_200012351029 [0,2,0,0,0,0|1,1,0]=4 16625 B12R1.288 CCOc1cc(c(cn1)SC)C 62a_200012351029_200000210301 [0,2,0,0,0,0|1,1,0]=4 16626 B12R1.288 CCOc1cc(c(cn1)S[13CH3])C 62a_200012351029_200025704644 [0,2,0,0,0,0|1,1,0]=4 16627 B12R1.288 CCOc1cc(c(cn1)S[13CH3])C 62a_200025704644_200012351029 [0,2,0,0,0,0|1,1,0]=4 16628 B12R1.288 CCOc1ccc(c(c1)Br)C#N 34a_100012184851_100000210202 [0,2,0,0,0,0|1,0,0]=3 16629 B12R1.288 CCOc1ccc(c(c1)Br)C#N 7a_100012184851_100000210202 [0,2,0,0,0,0|1,0,0]=3 16630 B12R1.288 CCOc1ccc(c(c1)Br)CO 34a_100010146404_100000210202 [0,2,0,0,0,0|0,0,0]=2 16631 B12R1.288 CCOc1ccc(c(c1)Br)CO 7a_100010146404_100000210202 [0,2,0,0,0,0|0,0,0]=2 16632 B12R1.288 CCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210202 [0,2,0,0,0,0|0,0,0]=2 16633 B12R1.288 CCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210202 [0,2,0,0,0,0|0,0,0]=2 16634 B12R1.288 CCOc1ccc(c(c1)C)C#N 34a_100000720286_100000210202 [0,2,0,0,0,0|1,0,0]=3 16635 B12R1.288 CCOc1ccc(c(c1)C)C#N 7a_100000720286_100000210202 [0,2,0,0,0,0|1,0,0]=3 16636 B12R1.288 CCOc1ccc(c(c1)C)NC 2230a_100000742753_200000210301 [0,2,0,0,0,0|1,0,0]=3 16637 B12R1.288 CCOc1ccc(c(c1)C)NC 34a_100000742753_200000210301 [0,2,0,0,0,0|1,0,0]=3 16638 B12R1.288 CCOc1ccc(c(c1)C)NC 34a_100161107805_100000210202 [0,2,0,0,0,0|1,0,0]=3 16639 B12R1.288 CCOc1ccc(c(c1)C)NC 7a_100161107805_100000210202 [0,2,0,0,0,0|1,0,0]=3 16640 B12R1.288 CCOc1ccc(c(c1)C)N[13CH3] 2230a_100000742753_200025704644 [0,2,0,0,0,0|1,0,0]=3 16641 B12R1.288 CCOc1ccc(c(c1)C)N[13CH3] 34a_100000742753_200025704644 [0,2,0,0,0,0|1,0,0]=3 16642 B12R1.288 CCOc1ccc(c(c1)C)OC 34a_100000759738_100000210202 [0,2,0,0,0,0|0,0,0]=2 16643 B12R1.288 CCOc1ccc(c(c1)C)OC 7a_100000759738_100000210202 [0,2,0,0,0,0|0,0,0]=2 16644 B12R1.288 CCOc1ccc(c(c1)C)SC 34a_100000030144_100000210202 [0,2,0,0,0,0|0,1,0]=3 16645 B12R1.288 CCOc1ccc(c(c1)C)SC 62a_200000210301_100012344538 [0,2,0,0,0,0|0,1,0]=3 16646 B12R1.288 CCOc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100012344538 [0,2,0,0,0,0|0,1,0]=3 16647 B12R1.288 CCOc1ccc(c(c1)Cl)C#N 34a_100000716493_100000210202 [0,2,0,0,0,0|1,0,0]=3 16648 B12R1.288 CCOc1ccc(c(c1)Cl)C#N 7a_100000716493_100000210202 [0,2,0,0,0,0|1,0,0]=3 16649 B12R1.288 CCOc1ccc(c(c1)Cl)CC 34a_100009886192_100000210202 [0,2,0,0,0,0|1,0,0]=3 16650 B12R1.288 CCOc1ccc(c(c1)Cl)CC 7a_100009886192_100000210202 [0,2,0,0,0,0|1,0,0]=3 16651 B12R1.288 CCOc1ccc(c(c1)Cl)CN 34a_200161156549_100000210202 [0,2,0,0,0,0|1,0,0]=3 16652 B12R1.288 CCOc1ccc(c(c1)Cl)CO 34a_200000075811_100000210202 [0,2,0,0,0,0|0,0,0]=2 16653 B12R1.288 CCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000210202 [0,2,0,0,0,0|0,0,0]=2 16654 B12R1.288 CCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210202 [0,2,0,0,0,0|0,0,0]=2 16655 B12R1.288 CCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210202 [0,2,0,0,0,0|0,0,0]=2 16656 B12R1.288 CCOc1ccc(c(c1)F)C#N 34a_100000753931_100000210202 [0,2,0,0,0,0|1,0,0]=3 16657 B12R1.288 CCOc1ccc(c(c1)F)C#N 7a_100000753931_100000210202 [0,2,0,0,0,0|1,0,0]=3 16658 B12R1.288 CCOc1ccc(c(c1)F)CO 34a_100000084598_100000210202 [0,2,0,0,0,0|0,0,0]=2 16659 B12R1.288 CCOc1ccc(c(c1)F)CO 7a_100000084598_100000210202 [0,2,0,0,0,0|0,0,0]=2 16660 B12R1.288 CCOc1ccc(c(c1)F)NC 2230a_100015186438_200000210301 [0,2,0,0,0,0|1,0,0]=3 16661 B12R1.288 CCOc1ccc(c(c1)F)NC 34a_100015186438_200000210301 [0,2,0,0,0,0|1,0,0]=3 16662 B12R1.288 CCOc1ccc(c(c1)F)N[13CH3] 2230a_100015186438_200025704644 [0,2,0,0,0,0|1,0,0]=3 16663 B12R1.288 CCOc1ccc(c(c1)F)N[13CH3] 34a_100015186438_200025704644 [0,2,0,0,0,0|1,0,0]=3 16664 B12R1.288 CCOc1ccc(c(c1)F)OC 34a_100000746305_100000210202 [0,2,0,0,0,0|0,0,0]=2 16665 B12R1.288 CCOc1ccc(c(c1)F)OC 7a_100000746305_100000210202 [0,2,0,0,0,0|0,0,0]=2 16666 B12R1.288 CCOc1ccc(c(c1)F)SC 62a_100000692347_200000210301 [0,2,0,0,0,0|0,1,0]=3 16667 B12R1.288 CCOc1ccc(c(c1)F)SC 62a_200000210301_100000692347 [0,2,0,0,0,0|0,1,0]=3 16668 B12R1.288 CCOc1ccc(c(c1)F)S[13CH3] 62a_100000692347_200025704644 [0,2,0,0,0,0|0,1,0]=3 16669 B12R1.288 CCOc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000692347 [0,2,0,0,0,0|0,1,0]=3 16670 B12R1.288 CCOc1ccc(c(c1)I)OC 34a_100010084122_100000210202 [0,2,0,0,0,0|0,0,0]=2 16671 B12R1.288 CCOc1ccc(c(c1)I)OC 7a_100010084122_100000210202 [0,2,0,0,0,0|0,0,0]=2 16672 B12R1.288 CCOc1ccc(c(c1)O)C=O 271570a_203496583355_200012721597 [0,2,0,0,0,0|0,0,1]=3 16673 B12R1.288 CCOc1cnc(c(c1)Br)C#N 34a_200015293162_100000210202 [0,2,0,0,0,0|2,0,0]=4 16674 B12R1.288 CCOc1cnc(c(c1)Br)C#N 7a_200015293162_100000210202 [0,2,0,0,0,0|2,0,0]=4 16675 B12R1.288 CCSc1cc(c(cn1)CO)C 62a_100000210202_100010277336 [0,2,0,0,0,0|1,1,0]=4 16676 B12R1.288 CCSc1cc(c(cn1)CO)C 62a_100010277336_100000210202 [0,2,0,0,0,0|1,1,0]=4 16677 B12R1.288 CCSc1cc(c(cn1)CO)N 62a_100000210202_100009830438 [0,2,0,0,0,0|1,1,0]=4 16678 B12R1.288 CCSc1cc(c(cn1)CO)N 62a_100009830438_100000210202 [0,2,0,0,0,0|1,1,0]=4 16679 B12R1.288 CCSc1cc(c(cn1)OC)N 62a_100000210202_100010896307 [0,2,0,0,0,0|1,1,0]=4 16680 B12R1.288 CCSc1cc(c(cn1)OC)N 62a_100010896307_100000210202 [0,2,0,0,0,0|1,1,0]=4 16681 B12R1.288 CCSc1cc(c(cn1)OC)O 62a_100000210202_100010264082 [0,2,0,0,0,0|1,1,0]=4 16682 B12R1.288 CCSc1ccc(c(c1)Br)C#N 62a_100000210202_100012349582 [0,2,0,0,0,0|1,1,0]=4 16683 B12R1.288 CCSc1ccc(c(c1)Br)C#N 62a_100012349582_100000210202 [0,2,0,0,0,0|1,1,0]=4 16684 B12R1.288 CCSc1ccc(c(c1)Br)C=O 62a_100000210202_100010185650 [0,2,0,0,0,0|0,1,1]=4 16685 B12R1.288 CCSc1ccc(c(c1)Br)C=O 62a_100010185650_100000210202 [0,2,0,0,0,0|0,1,1]=4 16686 B12R1.288 CCSc1ccc(c(c1)Br)CO 62a_100000210202_100010240206 [0,2,0,0,0,0|0,1,0]=3 16687 B12R1.288 CCSc1ccc(c(c1)Br)CO 62a_100010240206_100000210202 [0,2,0,0,0,0|0,1,0]=3 16688 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100000210202_100011249507 [0,2,0,0,0,0|0,1,0]=3 16689 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210202 [0,2,0,0,0,0|0,1,0]=3 16690 B12R1.288 CCSc1ccc(c(c1)C)C#N 62a_100000210202_100000687762 [0,2,0,0,0,0|1,1,0]=4 16691 B12R1.288 CCSc1ccc(c(c1)C)C=O 62a_100000210202_100000766358 [0,2,0,0,0,0|0,1,1]=4 16692 B12R1.288 CCSc1ccc(c(c1)C)C=O 62a_100000766358_100000210202 [0,2,0,0,0,0|0,1,1]=4 16693 B12R1.288 CCSc1ccc(c(c1)C)CF 62a_100000210202_200010711859 [0,2,0,0,0,0|1,1,0]=4 16694 B12R1.288 CCSc1ccc(c(c1)C)CF 62a_200010711859_100000210202 [0,2,0,0,0,0|1,1,0]=4 16695 B12R1.288 CCSc1ccc(c(c1)C)CN 62a_100000210202_100000753881 [0,2,0,0,0,0|1,1,0]=4 16696 B12R1.288 CCSc1ccc(c(c1)C)CN 62a_100000753881_100000210202 [0,2,0,0,0,0|1,1,0]=4 16697 B12R1.288 CCSc1ccc(c(c1)C)CO 62a_100000210202_100000748258 [0,2,0,0,0,0|0,1,0]=3 16698 B12R1.288 CCSc1ccc(c(c1)C)CO 62a_100000748258_100000210202 [0,2,0,0,0,0|0,1,0]=3 16699 B12R1.288 CCSc1ccc(c(c1)C)NC 62a_100000210202_100000221803 [0,2,0,0,0,0|1,1,0]=4 16700 B12R1.288 CCSc1ccc(c(c1)C)NC 62a_100000221803_100000210202 [0,2,0,0,0,0|1,1,0]=4 16701 B12R1.288 CCSc1ccc(c(c1)C)NN 62a_100000210202_100000751375 [0,2,0,0,0,0|1,1,0]=4 16702 B12R1.288 CCSc1ccc(c(c1)C)NN 62a_100000751375_100000210202 [0,2,0,0,0,0|1,1,0]=4 16703 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100000210202_100011219705 [0,2,0,0,0,0|0,1,0]=3 16704 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100011219705_100000210202 [0,2,0,0,0,0|0,1,0]=3 16705 B12R1.288 CCSc1ccc(c(c1)Cl)C#N 62a_100000210202_100012349662 [0,2,0,0,0,0|1,1,0]=4 16706 B12R1.288 CCSc1ccc(c(c1)Cl)C=O 62a_100000210202_100000727542 [0,2,0,0,0,0|0,1,1]=4 16707 B12R1.288 CCSc1ccc(c(c1)Cl)C=O 62a_100000727542_100000210202 [0,2,0,0,0,0|0,1,1]=4 16708 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100000210202_100012355395 [0,2,0,0,0,0|0,1,0]=3 16709 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210202 [0,2,0,0,0,0|0,1,0]=3 16710 B12R1.288 CCSc1ccc(c(c1)Cl)SC 62a_100000210202_206447510565 [0,2,0,0,0,0|0,2,0]=4 16711 B12R1.288 CCSc1ccc(c(c1)Cl)SC 62a_206447510565_100000210202 [0,2,0,0,0,0|0,2,0]=4 16712 B12R1.288 CCSc1ccc(c(c1)F)C#N 62a_100000210202_100000037869 [0,2,0,0,0,0|1,1,0]=4 16713 B12R1.288 CCSc1ccc(c(c1)F)C=O 62a_100000210202_100000211676 [0,2,0,0,0,0|0,1,1]=4 16714 B12R1.288 CCSc1ccc(c(c1)F)C=O 62a_100000211676_100000210202 [0,2,0,0,0,0|0,1,1]=4 16715 B12R1.288 CCSc1ccc(c(c1)F)CC 62a_100000210202_200010071577 [0,2,0,0,0,0|1,1,0]=4 16716 B12R1.288 CCSc1ccc(c(c1)F)CC 62a_200010071577_100000210202 [0,2,0,0,0,0|1,1,0]=4 16717 B12R1.288 CCSc1ccc(c(c1)F)CN 62a_100000210202_100000754580 [0,2,0,0,0,0|1,1,0]=4 16718 B12R1.288 CCSc1ccc(c(c1)F)CN 62a_100000754580_100000210202 [0,2,0,0,0,0|1,1,0]=4 16719 B12R1.288 CCSc1ccc(c(c1)F)CO 62a_100000210202_100011191541 [0,2,0,0,0,0|0,1,0]=3 16720 B12R1.288 CCSc1ccc(c(c1)F)CO 62a_100011191541_100000210202 [0,2,0,0,0,0|0,1,0]=3 16721 B12R1.288 CCSc1ccc(c(c1)F)NC 62a_100000210202_100000743884 [0,2,0,0,0,0|1,1,0]=4 16722 B12R1.288 CCSc1ccc(c(c1)F)NC 62a_100000743884_100000210202 [0,2,0,0,0,0|1,1,0]=4 16723 B12R1.288 CCSc1ccc(c(c1)F)NN 62a_100000210202_100000751572 [0,2,0,0,0,0|1,1,0]=4 16724 B12R1.288 CCSc1ccc(c(c1)F)NN 62a_100000751572_100000210202 [0,2,0,0,0,0|1,1,0]=4 16725 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000171752_100000210202 [0,2,0,0,0,0|0,1,0]=3 16726 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000210202_100000171752 [0,2,0,0,0,0|0,1,0]=3 16727 B12R1.288 CCSc1ccc(c(c1)F)SC 62a_100000210202_100010161220 [0,2,0,0,0,0|0,2,0]=4 16728 B12R1.288 CCSc1ccc(c(c1)F)SC 62a_100010161220_100000210202 [0,2,0,0,0,0|0,2,0]=4 16729 B12R1.288 CCSc1ccc(c(c1)N)C#N 62a_100000210202_100000699244 [0,2,0,0,0,0|1,1,0]=4 16730 B12R1.288 CCSc1ccc(c(c1)N)C=O 62a_100009814810_100000210202 [0,2,0,0,0,0|0,1,1]=4 16731 B12R1.288 CCSc1ccc(c(c1)N)CC 62a_100000210202_100012354963 [0,2,0,0,0,0|1,1,0]=4 16732 B12R1.288 CCSc1ccc(c(c1)N)CC 62a_100012354963_100000210202 [0,2,0,0,0,0|1,1,0]=4 16733 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000210202_100000718831 [0,2,0,0,0,0|0,1,0]=3 16734 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000718831_100000210202 [0,2,0,0,0,0|0,1,0]=3 16735 B12R1.288 CCSc1ccc(c(c1)N)NC 62a_100000741790_100000210202 [0,2,0,0,0,0|1,1,0]=4 16736 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100000210202_100011249504 [0,2,0,0,0,0|0,1,0]=3 16737 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100011249504_100000210202 [0,2,0,0,0,0|0,1,0]=3 16738 B12R1.288 CCSc1ccc(c(c1)O)C#N 62a_100000210202_100011934713 [0,2,0,0,0,0|1,1,0]=4 16739 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100000210202_100011277552 [0,2,0,0,0,0|0,1,1]=4 16740 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100011277552_100000210202 [0,2,0,0,0,0|0,1,1]=4 16741 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000071718_100000210202 [0,2,0,0,0,0|0,1,0]=3 16742 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000210202_100000071718 [0,2,0,0,0,0|0,1,0]=3 16743 B12R1.288 CCSc1ccc(c(c1)O)OC 62a_100000210202_100009816560 [0,2,0,0,0,0|0,1,0]=3 16744 B12R1.288 CCSc1ccc(c(n1)Br)OC 62a_100000210202_100010214827 [0,2,0,0,0,0|1,1,0]=4 16745 B12R1.288 CCSc1ccc(c(n1)Br)OC 62a_100010214827_100000210202 [0,2,0,0,0,0|1,1,0]=4 16746 B12R1.288 CCSc1ccc(c(n1)C)OC 62a_100000210202_100010244750 [0,2,0,0,0,0|1,1,0]=4 16747 B12R1.288 CCSc1ccc(c(n1)C)OC 62a_100010244750_100000210202 [0,2,0,0,0,0|1,1,0]=4 16748 B12R1.288 CCSc1ccc(c(n1)Cl)OC 62a_100000210202_100010233546 [0,2,0,0,0,0|1,1,0]=4 16749 B12R1.288 CCSc1ccc(c(n1)F)CO 62a_100000210202_100009870654 [0,2,0,0,0,0|1,1,0]=4 16750 B12R1.288 CCSc1ccc(c(n1)F)CO 62a_100009870654_100000210202 [0,2,0,0,0,0|1,1,0]=4 16751 B12R1.288 CCSc1ccc(c(n1)F)OC 62a_100000210202_100010138636 [0,2,0,0,0,0|1,1,0]=4 16752 B12R1.288 CCSc1ccc(c(n1)F)OC 62a_100010138636_100000210202 [0,2,0,0,0,0|1,1,0]=4 16753 B12R1.288 CCSc1ccc(c(n1)N)OC 62a_100010192976_100000210202 [0,2,0,0,0,0|1,1,0]=4 16754 B12R1.288 CCSc1cnc(c(c1)Br)OC 62a_100000210202_200010988584 [0,2,0,0,0,0|1,1,0]=4 16755 B12R1.288 CCSc1cnc(c(c1)Br)OC 62a_200010988584_100000210202 [0,2,0,0,0,0|1,1,0]=4 16756 B12R1.288 CCSc1cnc(c(c1)C)CO 62a_100000210202_100010116297 [0,2,0,0,0,0|1,1,0]=4 16757 B12R1.288 CCSc1cnc(c(c1)C)CO 62a_100010116297_100000210202 [0,2,0,0,0,0|1,1,0]=4 16758 B12R1.288 CCSc1cnc(c(c1)C)OC 62a_100000210202_100011290809 [0,2,0,0,0,0|1,1,0]=4 16759 B12R1.288 CCSc1cnc(c(c1)C)OC 62a_100011290809_100000210202 [0,2,0,0,0,0|1,1,0]=4 16760 B12R1.288 CCSc1cnc(c(c1)F)CO 62a_100000210202_100010065252 [0,2,0,0,0,0|1,1,0]=4 16761 B12R1.288 CCSc1cnc(c(c1)F)CO 62a_100010065252_100000210202 [0,2,0,0,0,0|1,1,0]=4 16762 B12R1.288 CCSc1cnc(c(c1)F)OC 62a_100000210202_100011880707 [0,2,0,0,0,0|1,1,0]=4 16763 B12R1.288 CCSc1cnc(c(c1)F)OC 62a_100011880707_100000210202 [0,2,0,0,0,0|1,1,0]=4 16764 B12R1.288 CCSc1cnc(c(c1)N)OC 62a_100000210202_100000748608 [0,2,0,0,0,0|1,1,0]=4 16765 B12R1.288 CCSc1cnc(c(c1)N)OC 62a_100000748608_100000210202 [0,2,0,0,0,0|1,1,0]=4 16766 B12R1.288 CCSc1cnc(c(c1)O)OC 62a_100000210202_100010135713 [0,2,0,0,0,0|1,1,0]=4 16767 B12R1.288 CCc1ccc(cc1Cl)OCF 34a_100009886192_100015361967 [0,2,0,0,0,0|2,0,0]=4 16768 B12R1.288 CCc1ccc(cc1Cl)OCF 7a_100009886192_100015361967 [0,2,0,0,0,0|2,0,0]=4 16769 B12R1.288 CNCc1ccc(c(c1)Br)CO 26a_100102657272_100010146404 [0,2,0,0,0,0|2,0,0]=4 16770 B12R1.288 CNCc1ccc(c(c1)Br)OC 207a_100102657272_100000173361 [0,2,0,0,0,0|2,0,0]=4 16771 B12R1.288 CNCc1ccc(c(c1)Br)OC 2230a_106832991635_200011397701 [0,2,0,0,0,0|2,0,0]=4 16772 B12R1.288 CNCc1ccc(c(c1)Br)OC 26a_100102657272_100010234764 [0,2,0,0,0,0|2,0,0]=4 16773 B12R1.288 CNCc1ccc(c(c1)Br)OC 270004a_106832991635_100000173361 [0,2,0,0,0,0|2,0,0]=4 16774 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100102657272_200011397701 [0,2,0,0,0,0|2,0,0]=4 16775 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100159240714_200000210301 [0,2,0,0,0,0|2,0,0]=4 16776 B12R1.288 CNCc1ccc(c(c1)Br)OC 7a_106832991635_200011397701 [0,2,0,0,0,0|2,0,0]=4 16777 B12R1.288 CNCc1ccc(c(c1)C)OC 207a_100102657272_100000239718 [0,2,0,0,0,0|2,0,0]=4 16778 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_100102679029_200000210301 [0,2,0,0,0,0|2,0,0]=4 16779 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_106832991635_200011290836 [0,2,0,0,0,0|2,0,0]=4 16780 B12R1.288 CNCc1ccc(c(c1)C)OC 270004a_106832991635_100000239718 [0,2,0,0,0,0|2,0,0]=4 16781 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102657272_200011290836 [0,2,0,0,0,0|2,0,0]=4 16782 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102679029_200000210301 [0,2,0,0,0,0|2,0,0]=4 16783 B12R1.288 CNCc1ccc(c(c1)C)OC 7a_106832991635_200011290836 [0,2,0,0,0,0|2,0,0]=4 16784 B12R1.288 CNCc1ccc(c(c1)Cl)CO 26a_100102657272_200000075811 [0,2,0,0,0,0|2,0,0]=4 16785 B12R1.288 CNCc1ccc(c(c1)Cl)OC 207a_100102657272_100000186747 [0,2,0,0,0,0|2,0,0]=4 16786 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_100000008799_200000210301 [0,2,0,0,0,0|2,0,0]=4 16787 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_106832991635_100000693707 [0,2,0,0,0,0|2,0,0]=4 16788 B12R1.288 CNCc1ccc(c(c1)Cl)OC 26a_100102657272_200009861682 [0,2,0,0,0,0|2,0,0]=4 16789 B12R1.288 CNCc1ccc(c(c1)Cl)OC 270004a_106832991635_100000186747 [0,2,0,0,0,0|2,0,0]=4 16790 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100000008799_200000210301 [0,2,0,0,0,0|2,0,0]=4 16791 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100102657272_100000693707 [0,2,0,0,0,0|2,0,0]=4 16792 B12R1.288 CNCc1ccc(c(c1)Cl)OC 7a_106832991635_100000693707 [0,2,0,0,0,0|2,0,0]=4 16793 B12R1.288 CNCc1ccc(c(c1)F)OC 207a_100102657272_100000204617 [0,2,0,0,0,0|2,0,0]=4 16794 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_100000737316_200000210301 [0,2,0,0,0,0|2,0,0]=4 16795 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_106832991635_100000189595 [0,2,0,0,0,0|2,0,0]=4 16796 B12R1.288 CNCc1ccc(c(c1)F)OC 270004a_106832991635_100000204617 [0,2,0,0,0,0|2,0,0]=4 16797 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100000737316_200000210301 [0,2,0,0,0,0|2,0,0]=4 16798 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100102657272_100000189595 [0,2,0,0,0,0|2,0,0]=4 16799 B12R1.288 CNCc1ccc(c(c1)F)OC 7a_106832991635_100000189595 [0,2,0,0,0,0|2,0,0]=4 16800 B12R1.288 CNCc1ccc(c(c1)I)OC 207a_100102657272_100009827998 [0,2,0,0,0,0|2,0,0]=4 16801 B12R1.288 CNCc1ccc(c(c1)I)OC 270004a_106832991635_100009827998 [0,2,0,0,0,0|2,0,0]=4 16802 B12R1.288 CNCc1ccc(c(c1)O)OC 34a_100000740000_200000210301 [0,2,0,0,0,0|2,0,0]=4 16803 B12R1.288 CNc1ccc(cc1C)OCF 34a_100161107805_100015361967 [0,2,0,0,0,0|2,0,0]=4 16804 B12R1.288 CNc1ccc(cc1C)OCF 7a_100161107805_100015361967 [0,2,0,0,0,0|2,0,0]=4 16805 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100000246451_200000210301 [0,2,0,0,0,0|2,0,0]=4 16806 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100138415774_200011397701 [0,2,0,0,0,0|2,0,0]=4 16807 B12R1.288 COCc1ccc(c(c1)Br)OC 7a_100000246451_200000210301 [0,2,0,0,0,0|2,0,0]=4 16808 B12R1.288 COCc1ccc(c(c1)C)OC 34a_100138415774_200011290836 [0,2,0,0,0,0|2,0,0]=4 16809 B12R1.288 COCc1ccc(c(c1)C)OC 34a_200011290855_200000210301 [0,2,0,0,0,0|2,0,0]=4 16810 B12R1.288 COCc1ccc(c(c1)C)OC 7a_200011290855_200000210301 [0,2,0,0,0,0|2,0,0]=4 16811 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100000694469_200000210301 [0,2,0,0,0,0|2,0,0]=4 16812 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100138415774_100000693707 [0,2,0,0,0,0|2,0,0]=4 16813 B12R1.288 COCc1ccc(c(c1)Cl)OC 7a_100000694469_200000210301 [0,2,0,0,0,0|2,0,0]=4 16814 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100000246395_200000210301 [0,2,0,0,0,0|2,0,0]=4 16815 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100138415774_100000189595 [0,2,0,0,0,0|2,0,0]=4 16816 B12R1.288 COCc1ccc(c(c1)F)OC 7a_100000246395_200000210301 [0,2,0,0,0,0|2,0,0]=4 16817 B12R1.288 COCc1ccc(c(c1)I)OC 34a_200000013966_200000210301 [0,2,0,0,0,0|2,0,0]=4 16818 B12R1.288 COCc1ccc(c(c1)I)OC 7a_200000013966_200000210301 [0,2,0,0,0,0|2,0,0]=4 16819 B12R1.288 COCc1ccc(c(c1)N)OC 34a_100011269841_200000210301 [0,2,0,0,0,0|2,0,0]=4 16820 B12R1.288 COc1ccc(cc1Br)CN[13CH3] 34a_100159240714_200025704644 [0,2,0,0,0,0|2,0,0]=4 16821 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 34a_100000246451_200025704644 [0,2,0,0,0,0|2,0,0]=4 16822 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 7a_100000246451_200025704644 [0,2,0,0,0,0|2,0,0]=4 16823 B12R1.288 COc1ccc(cc1Br)CSC 62a_200000210301_200011397701 [0,2,0,0,0,0|2,0,0]=4 16824 B12R1.288 COc1ccc(cc1Br)CSC 62a_200011397701_200000210301 [0,2,0,0,0,0|2,0,0]=4 16825 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200011397701_200025704644 [0,2,0,0,0,0|2,0,0]=4 16826 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200025704644_200011397701 [0,2,0,0,0,0|2,0,0]=4 16827 B12R1.288 COc1ccc(cc1Br)NCF 34a_100000187427_100015361967 [0,2,0,0,0,0|2,0,0]=4 16828 B12R1.288 COc1ccc(cc1Br)OCF 34a_100010234764_100015361967 [0,2,0,0,0,0|1,0,0]=3 16829 B12R1.288 COc1ccc(cc1Br)OCF 7a_100010234764_100015361967 [0,2,0,0,0,0|1,0,0]=3 16830 B12R1.288 COc1ccc(cc1Br)SCF 62a_100011249507_100015361967 [0,2,0,0,0,0|1,1,0]=4 16831 B12R1.288 COc1ccc(cc1Br)SCF 62a_100015361967_100011249507 [0,2,0,0,0,0|1,1,0]=4 16832 B12R1.288 COc1ccc(cc1C)CN[13CH3] 2230a_100102679029_200025704644 [0,2,0,0,0,0|2,0,0]=4 16833 B12R1.288 COc1ccc(cc1C)CN[13CH3] 34a_100102679029_200025704644 [0,2,0,0,0,0|2,0,0]=4 16834 B12R1.288 COc1ccc(cc1C)CO[13CH3] 34a_200011290855_200025704644 [0,2,0,0,0,0|2,0,0]=4 16835 B12R1.288 COc1ccc(cc1C)CO[13CH3] 7a_200011290855_200025704644 [0,2,0,0,0,0|2,0,0]=4 16836 B12R1.288 COc1ccc(cc1C)CSC 62a_200000210301_200011290836 [0,2,0,0,0,0|2,0,0]=4 16837 B12R1.288 COc1ccc(cc1C)CSC 62a_200011290836_200000210301 [0,2,0,0,0,0|2,0,0]=4 16838 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200011290836_200025704644 [0,2,0,0,0,0|2,0,0]=4 16839 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200025704644_200011290836 [0,2,0,0,0,0|2,0,0]=4 16840 B12R1.288 COc1ccc(cc1C)NCF 34a_100000743268_100015361967 [0,2,0,0,0,0|2,0,0]=4 16841 B12R1.288 COc1ccc(cc1C)NCF 7a_100000743268_100015361967 [0,2,0,0,0,0|2,0,0]=4 16842 B12R1.288 COc1ccc(cc1C)OCF 34a_100000759738_100015361967 [0,2,0,0,0,0|1,0,0]=3 16843 B12R1.288 COc1ccc(cc1C)OCF 7a_100000759738_100015361967 [0,2,0,0,0,0|1,0,0]=3 16844 B12R1.288 COc1ccc(cc1C)SCF 62a_100011219705_100015361967 [0,2,0,0,0,0|1,1,0]=4 16845 B12R1.288 COc1ccc(cc1C)SCF 62a_100015361967_100011219705 [0,2,0,0,0,0|1,1,0]=4 16846 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 2230a_100000008799_200025704644 [0,2,0,0,0,0|2,0,0]=4 16847 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 34a_100000008799_200025704644 [0,2,0,0,0,0|2,0,0]=4 16848 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 34a_100000694469_200025704644 [0,2,0,0,0,0|2,0,0]=4 16849 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 7a_100000694469_200025704644 [0,2,0,0,0,0|2,0,0]=4 16850 B12R1.288 COc1ccc(cc1Cl)CSC 62a_100000693707_200000210301 [0,2,0,0,0,0|2,0,0]=4 16851 B12R1.288 COc1ccc(cc1Cl)CSC 62a_200000210301_100000693707 [0,2,0,0,0,0|2,0,0]=4 16852 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_100000693707_200025704644 [0,2,0,0,0,0|2,0,0]=4 16853 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100000693707 [0,2,0,0,0,0|2,0,0]=4 16854 B12R1.288 COc1ccc(cc1Cl)NCF 34a_100000211044_100015361967 [0,2,0,0,0,0|2,0,0]=4 16855 B12R1.288 COc1ccc(cc1Cl)OCF 34a_200009861682_100015361967 [0,2,0,0,0,0|1,0,0]=3 16856 B12R1.288 COc1ccc(cc1Cl)OCF 7a_200009861682_100015361967 [0,2,0,0,0,0|1,0,0]=3 16857 B12R1.288 COc1ccc(cc1Cl)SCF 62a_100012355395_100015361967 [0,2,0,0,0,0|1,1,0]=4 16858 B12R1.288 COc1ccc(cc1Cl)SCF 62a_100015361967_100012355395 [0,2,0,0,0,0|1,1,0]=4 16859 B12R1.288 COc1ccc(cc1F)CN[13CH3] 2230a_100000737316_200025704644 [0,2,0,0,0,0|2,0,0]=4 16860 B12R1.288 COc1ccc(cc1F)CN[13CH3] 34a_100000737316_200025704644 [0,2,0,0,0,0|2,0,0]=4 16861 B12R1.288 COc1ccc(cc1F)CO[13CH3] 34a_100000246395_200025704644 [0,2,0,0,0,0|2,0,0]=4 16862 B12R1.288 COc1ccc(cc1F)CO[13CH3] 7a_100000246395_200025704644 [0,2,0,0,0,0|2,0,0]=4 16863 B12R1.288 COc1ccc(cc1F)CSC 62a_100000189595_200000210301 [0,2,0,0,0,0|2,0,0]=4 16864 B12R1.288 COc1ccc(cc1F)CSC 62a_200000210301_100000189595 [0,2,0,0,0,0|2,0,0]=4 16865 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_100000189595_200025704644 [0,2,0,0,0,0|2,0,0]=4 16866 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_200025704644_100000189595 [0,2,0,0,0,0|2,0,0]=4 16867 B12R1.288 COc1ccc(cc1F)NCF 34a_100000740183_100015361967 [0,2,0,0,0,0|2,0,0]=4 16868 B12R1.288 COc1ccc(cc1F)OCF 34a_100000746305_100015361967 [0,2,0,0,0,0|1,0,0]=3 16869 B12R1.288 COc1ccc(cc1F)OCF 7a_100000746305_100015361967 [0,2,0,0,0,0|1,0,0]=3 16870 B12R1.288 COc1ccc(cc1F)SCF 62a_100000171752_100015361967 [0,2,0,0,0,0|1,1,0]=4 16871 B12R1.288 COc1ccc(cc1F)SCF 62a_100015361967_100000171752 [0,2,0,0,0,0|1,1,0]=4 16872 B12R1.288 COc1ccc(cc1I)CO[13CH3] 34a_200000013966_200025704644 [0,2,0,0,0,0|2,0,0]=4 16873 B12R1.288 COc1ccc(cc1I)CO[13CH3] 7a_200000013966_200025704644 [0,2,0,0,0,0|2,0,0]=4 16874 B12R1.288 COc1ccc(cc1I)NCF 34a_100011356947_100015361967 [0,2,0,0,0,0|2,0,0]=4 16875 B12R1.288 COc1ccc(cc1I)OCF 34a_100010084122_100015361967 [0,2,0,0,0,0|1,0,0]=3 16876 B12R1.288 COc1ccc(cc1I)OCF 7a_100010084122_100015361967 [0,2,0,0,0,0|1,0,0]=3 16877 B12R1.288 COc1ccc(cc1N)CO[13CH3] 34a_100011269841_200025704644 [0,2,0,0,0,0|2,0,0]=4 16878 B12R1.288 COc1ccc(cc1N)SCF 62a_100011249504_100015361967 [0,2,0,0,0,0|1,1,0]=4 16879 B12R1.288 COc1ccc(cc1N)SCF 62a_100015361967_100011249504 [0,2,0,0,0,0|1,1,0]=4 16880 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [0,2,0,0,0,0|2,0,0]=4 16881 B12R1.288 COc1ccc(cc1O)CCO 271570a_203496583355_100011962876 [0,2,0,0,0,0|2,0,0]=4 16882 B12R1.288 COc1ccc(cc1O)CN[13CH3] 34a_100000740000_200025704644 [0,2,0,0,0,0|2,0,0]=4 16883 B12R1.288 COc1ccc(cc1O)NCF 34a_100000211920_100015361967 [0,2,0,0,0,0|2,0,0]=4 16884 B12R1.288 COc1ccc(cc1O)SCF 62a_100015361967_100009816560 [0,2,0,0,0,0|1,1,0]=4 16885 B12R1.288 CSc1ccc(cc1C)OCF 34a_100000030144_100015361967 [0,2,0,0,0,0|1,1,0]=4 16886 B12R1.288 Cc1cc(ccc1C#N)OCF 34a_100000720286_100015361967 [0,2,0,0,0,0|2,0,0]=4 16887 B12R1.288 Cc1cc(ccc1C#N)OCF 7a_100000720286_100015361967 [0,2,0,0,0,0|2,0,0]=4 16888 B12R1.288 Cc1cc(ccc1CO)NCF 34a_100000102464_100015361967 [0,2,0,0,0,0|2,0,0]=4 16889 B12R1.288 Cc1cc(ccc1CO)SCF 62a_100000748258_100015361967 [0,2,0,0,0,0|1,1,0]=4 16890 B12R1.288 Cc1cc(ccc1CO)SCF 62a_100015361967_100000748258 [0,2,0,0,0,0|1,1,0]=4 16891 B12R1.288 N#Cc1ccc(cc1Br)OCF 34a_100012184851_100015361967 [0,2,0,0,0,0|2,0,0]=4 16892 B12R1.288 N#Cc1ccc(cc1Br)OCF 7a_100012184851_100015361967 [0,2,0,0,0,0|2,0,0]=4 16893 B12R1.288 N#Cc1ccc(cc1Cl)OCF 34a_100000716493_100015361967 [0,2,0,0,0,0|2,0,0]=4 16894 B12R1.288 N#Cc1ccc(cc1Cl)OCF 7a_100000716493_100015361967 [0,2,0,0,0,0|2,0,0]=4 16895 B12R1.288 N#Cc1ccc(cc1F)OCF 34a_100000753931_100015361967 [0,2,0,0,0,0|2,0,0]=4 16896 B12R1.288 N#Cc1ccc(cc1F)OCF 7a_100000753931_100015361967 [0,2,0,0,0,0|2,0,0]=4 16897 B12R1.288 NCc1ccc(cc1Cl)OCF 34a_200161156549_100015361967 [0,2,0,0,0,0|2,0,0]=4 16898 B12R1.288 Nc1cc(ccc1CO)SCF 62a_100000718831_100015361967 [0,2,0,0,0,0|1,1,0]=4 16899 B12R1.288 Nc1cc(ccc1CO)SCF 62a_100015361967_100000718831 [0,2,0,0,0,0|1,1,0]=4 16900 B12R1.288 OCc1ccc(cc1Br)OCF 34a_100010146404_100015361967 [0,2,0,0,0,0|1,0,0]=3 16901 B12R1.288 OCc1ccc(cc1Br)OCF 7a_100010146404_100015361967 [0,2,0,0,0,0|1,0,0]=3 16902 B12R1.288 OCc1ccc(cc1Br)SCF 62a_100010240206_100015361967 [0,2,0,0,0,0|1,1,0]=4 16903 B12R1.288 OCc1ccc(cc1Br)SCF 62a_100015361967_100010240206 [0,2,0,0,0,0|1,1,0]=4 16904 B12R1.288 OCc1ccc(cc1Cl)NCF 34a_100000689119_100015361967 [0,2,0,0,0,0|2,0,0]=4 16905 B12R1.288 OCc1ccc(cc1Cl)OCF 34a_200000075811_100015361967 [0,2,0,0,0,0|1,0,0]=3 16906 B12R1.288 OCc1ccc(cc1Cl)OCF 7a_200000075811_100015361967 [0,2,0,0,0,0|1,0,0]=3 16907 B12R1.288 OCc1ccc(cc1F)OCF 34a_100000084598_100015361967 [0,2,0,0,0,0|1,0,0]=3 16908 B12R1.288 OCc1ccc(cc1F)OCF 7a_100000084598_100015361967 [0,2,0,0,0,0|1,0,0]=3 16909 B12R1.288 OCc1ccc(cc1F)SCF 62a_100011191541_100015361967 [0,2,0,0,0,0|1,1,0]=4 16910 B12R1.288 OCc1ccc(cc1F)SCF 62a_100015361967_100011191541 [0,2,0,0,0,0|1,1,0]=4 16911 B12R1.288 OCc1ccc(cc1O)SCF 62a_100000071718_100015361967 [0,2,0,0,0,0|1,1,0]=4 16912 B12R1.288 OCc1ccc(cc1O)SCF 62a_100015361967_100000071718 [0,2,0,0,0,0|1,1,0]=4 16913 B12R1.44 CC=Cc1cc(c(c(c1)Br)O)C 271570a_100016259895_100010982682 [0,2,0,0,0,0|1,0,1]=4 16914 B12R1.44 CC=Cc1cc(c(c(c1)C)O)C 271570a_100016259895_100000187306 [0,2,0,0,0,0|1,0,1]=4 16915 B12R1.44 CC=Cc1cc(c(c(c1)Cl)O)C 271570a_100016259895_200015900153 [0,2,0,0,0,0|1,0,1]=4 16916 B12R1.44 CC=Cc1cc(c(c(c1)Cl)O)Cl 271570a_100016259895_100012339652 [0,2,0,0,0,0|1,0,1]=4 16917 B12R1.44 CC=Cc1cc(c(c(c1)F)O)F 271570a_100016259895_100011216917 [0,2,0,0,0,0|1,0,1]=4 16918 B12R1.44 CC=Cc1cc(c(c(c1)F)O)N 271570a_100016259895_100011217383 [0,2,0,0,0,0|1,0,1]=4 16919 B12R1.44 CC=Cc1cc(c(c(c1)N)O)C 271570a_100016259895_100011825904 [0,2,0,0,0,0|1,0,1]=4 16920 B12R1.44 CCNc1cc(c(c(c1)Br)C)Br 2230a_100009813276_100000210202 [0,2,0,0,0,0|2,0,0]=4 16921 B12R1.44 CCNc1cc(c(c(c1)Br)C)Br 34a_100009813276_100000210202 [0,2,0,0,0,0|2,0,0]=4 16922 B12R1.44 CCNc1cc(c(c(c1)Br)C)Br 7a_100009813276_100000210202 [0,2,0,0,0,0|2,0,0]=4 16923 B12R1.44 CCNc1cc(c(c(c1)Br)C)C 2230a_100010368239_100000210202 [0,2,0,0,0,0|2,0,0]=4 16924 B12R1.44 CCNc1cc(c(c(c1)Br)C)C 34a_100010368239_100000210202 [0,2,0,0,0,0|2,0,0]=4 16925 B12R1.44 CCNc1cc(c(c(c1)Br)C)C 7a_100010368239_100000210202 [0,2,0,0,0,0|2,0,0]=4 16926 B12R1.44 CCNc1cc(c(c(c1)Br)C)F 2230a_100010254531_100000210202 [0,2,0,0,0,0|2,0,0]=4 16927 B12R1.44 CCNc1cc(c(c(c1)Br)C)F 34a_100010254531_100000210202 [0,2,0,0,0,0|2,0,0]=4 16928 B12R1.44 CCNc1cc(c(c(c1)Br)C)F 7a_100010254531_100000210202 [0,2,0,0,0,0|2,0,0]=4 16929 B12R1.44 CCNc1cc(c(c(c1)Br)Cl)Cl 2230a_100010735061_100000210202 [0,2,0,0,0,0|2,0,0]=4 16930 B12R1.44 CCNc1cc(c(c(c1)Br)Cl)Cl 34a_100010735061_100000210202 [0,2,0,0,0,0|2,0,0]=4 16931 B12R1.44 CCNc1cc(c(c(c1)Br)Cl)Cl 7a_100010735061_100000210202 [0,2,0,0,0,0|2,0,0]=4 16932 B12R1.44 CCNc1cc(c(c(c1)Br)F)Br 2230a_100010209666_100000210202 [0,2,0,0,0,0|2,0,0]=4 16933 B12R1.44 CCNc1cc(c(c(c1)Br)F)Br 34a_100010209666_100000210202 [0,2,0,0,0,0|2,0,0]=4 16934 B12R1.44 CCNc1cc(c(c(c1)Br)F)Br 7a_100010209666_100000210202 [0,2,0,0,0,0|2,0,0]=4 16935 B12R1.44 CCNc1cc(c(c(c1)Br)F)F 2230a_100009816004_100000210202 [0,2,0,0,0,0|2,0,0]=4 16936 B12R1.44 CCNc1cc(c(c(c1)Br)F)F 34a_100009816004_100000210202 [0,2,0,0,0,0|2,0,0]=4 16937 B12R1.44 CCNc1cc(c(c(c1)Br)F)F 7a_100009816004_100000210202 [0,2,0,0,0,0|2,0,0]=4 16938 B12R1.44 CCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100000210202 [0,2,0,0,0,0|1,0,0]=3 16939 B12R1.44 CCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000210202 [0,2,0,0,0,0|1,0,0]=3 16940 B12R1.44 CCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000210202 [0,2,0,0,0,0|1,0,0]=3 16941 B12R1.44 CCNc1cc(c(c(c1)C)Br)C 2230a_100000684802_100000210202 [0,2,0,0,0,0|2,0,0]=4 16942 B12R1.44 CCNc1cc(c(c(c1)C)Br)C 34a_100000684802_100000210202 [0,2,0,0,0,0|2,0,0]=4 16943 B12R1.44 CCNc1cc(c(c(c1)C)Br)C 7a_100000684802_100000210202 [0,2,0,0,0,0|2,0,0]=4 16944 B12R1.44 CCNc1cc(c(c(c1)C)C)C 2230a_100000074974_100000210202 [0,2,0,0,0,0|2,0,0]=4 16945 B12R1.44 CCNc1cc(c(c(c1)C)C)C 34a_100000074974_100000210202 [0,2,0,0,0,0|2,0,0]=4 16946 B12R1.44 CCNc1cc(c(c(c1)C)C)C 7a_100000074974_100000210202 [0,2,0,0,0,0|2,0,0]=4 16947 B12R1.44 CCNc1cc(c(c(c1)C)F)C 2230a_100000061604_100000210202 [0,2,0,0,0,0|2,0,0]=4 16948 B12R1.44 CCNc1cc(c(c(c1)C)F)C 34a_100000061604_100000210202 [0,2,0,0,0,0|2,0,0]=4 16949 B12R1.44 CCNc1cc(c(c(c1)C)F)C 7a_100000061604_100000210202 [0,2,0,0,0,0|2,0,0]=4 16950 B12R1.44 CCNc1cc(c(c(c1)C)I)C 34a_100000215964_100000210202 [0,2,0,0,0,0|2,0,0]=4 16951 B12R1.44 CCNc1cc(c(c(c1)C)I)C 7a_100000215964_100000210202 [0,2,0,0,0,0|2,0,0]=4 16952 B12R1.44 CCNc1cc(c(c(c1)C)O)C 34a_100000703291_100000210202 [0,2,0,0,0,0|1,0,0]=3 16953 B12R1.44 CCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000210202 [0,2,0,0,0,0|1,0,0]=3 16954 B12R1.44 CCNc1cc(c(c(c1)Cl)Br)Cl 2230a_100010212259_100000210202 [0,2,0,0,0,0|2,0,0]=4 16955 B12R1.44 CCNc1cc(c(c(c1)Cl)Br)Cl 34a_100010212259_100000210202 [0,2,0,0,0,0|2,0,0]=4 16956 B12R1.44 CCNc1cc(c(c(c1)Cl)Br)Cl 7a_100010212259_100000210202 [0,2,0,0,0,0|2,0,0]=4 16957 B12R1.44 CCNc1cc(c(c(c1)Cl)Br)F 2230a_100000728458_100000210202 [0,2,0,0,0,0|2,0,0]=4 16958 B12R1.44 CCNc1cc(c(c(c1)Cl)Br)F 34a_100000728458_100000210202 [0,2,0,0,0,0|2,0,0]=4 16959 B12R1.44 CCNc1cc(c(c(c1)Cl)Br)F 7a_100000728458_100000210202 [0,2,0,0,0,0|2,0,0]=4 16960 B12R1.44 CCNc1cc(c(c(c1)Cl)C)Cl 2230a_100000745310_100000210202 [0,2,0,0,0,0|2,0,0]=4 16961 B12R1.44 CCNc1cc(c(c(c1)Cl)C)Cl 34a_100000745310_100000210202 [0,2,0,0,0,0|2,0,0]=4 16962 B12R1.44 CCNc1cc(c(c(c1)Cl)C)Cl 7a_100000745310_100000210202 [0,2,0,0,0,0|2,0,0]=4 16963 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)C 2230a_100009830880_100000210202 [0,2,0,0,0,0|2,0,0]=4 16964 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)C 34a_100009830880_100000210202 [0,2,0,0,0,0|2,0,0]=4 16965 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)C 7a_100009830880_100000210202 [0,2,0,0,0,0|2,0,0]=4 16966 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)Cl 34a_100000037808_100000210202 [0,2,0,0,0,0|2,0,0]=4 16967 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)Cl 7a_100000037808_100000210202 [0,2,0,0,0,0|2,0,0]=4 16968 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)F 2230a_100012961779_100000210202 [0,2,0,0,0,0|2,0,0]=4 16969 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)F 34a_100012961779_100000210202 [0,2,0,0,0,0|2,0,0]=4 16970 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)F 7a_100012961779_100000210202 [0,2,0,0,0,0|2,0,0]=4 16971 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100000210202 [0,2,0,0,0,0|2,0,0]=4 16972 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000210202 [0,2,0,0,0,0|2,0,0]=4 16973 B12R1.44 CCNc1cc(c(c(c1)Cl)F)Cl 2230a_100000700460_100000210202 [0,2,0,0,0,0|2,0,0]=4 16974 B12R1.44 CCNc1cc(c(c(c1)Cl)F)Cl 34a_100000700460_100000210202 [0,2,0,0,0,0|2,0,0]=4 16975 B12R1.44 CCNc1cc(c(c(c1)Cl)F)Cl 7a_100000700460_100000210202 [0,2,0,0,0,0|2,0,0]=4 16976 B12R1.44 CCNc1cc(c(c(c1)Cl)F)F 2230a_200009857453_100000210202 [0,2,0,0,0,0|2,0,0]=4 16977 B12R1.44 CCNc1cc(c(c(c1)Cl)F)F 34a_200009857453_100000210202 [0,2,0,0,0,0|2,0,0]=4 16978 B12R1.44 CCNc1cc(c(c(c1)Cl)F)F 7a_200009857453_100000210202 [0,2,0,0,0,0|2,0,0]=4 16979 B12R1.44 CCNc1cc(c(c(c1)Cl)I)F 34a_100014833993_100000210202 [0,2,0,0,0,0|2,0,0]=4 16980 B12R1.44 CCNc1cc(c(c(c1)Cl)I)F 7a_100014833993_100000210202 [0,2,0,0,0,0|2,0,0]=4 16981 B12R1.44 CCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100000210202 [0,2,0,0,0,0|1,0,0]=3 16982 B12R1.44 CCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000210202 [0,2,0,0,0,0|1,0,0]=3 16983 B12R1.44 CCNc1cc(c(c(c1)F)Br)C 2230a_100010115923_100000210202 [0,2,0,0,0,0|2,0,0]=4 16984 B12R1.44 CCNc1cc(c(c(c1)F)Br)C 34a_100010115923_100000210202 [0,2,0,0,0,0|2,0,0]=4 16985 B12R1.44 CCNc1cc(c(c(c1)F)Br)C 7a_100010115923_100000210202 [0,2,0,0,0,0|2,0,0]=4 16986 B12R1.44 CCNc1cc(c(c(c1)F)Br)F 2230a_100000687227_100000210202 [0,2,0,0,0,0|2,0,0]=4 16987 B12R1.44 CCNc1cc(c(c(c1)F)Br)F 34a_100000687227_100000210202 [0,2,0,0,0,0|2,0,0]=4 16988 B12R1.44 CCNc1cc(c(c(c1)F)Br)F 7a_100000687227_100000210202 [0,2,0,0,0,0|2,0,0]=4 16989 B12R1.44 CCNc1cc(c(c(c1)F)C)F 2230a_100011216606_100000210202 [0,2,0,0,0,0|2,0,0]=4 16990 B12R1.44 CCNc1cc(c(c(c1)F)C)F 34a_100011216606_100000210202 [0,2,0,0,0,0|2,0,0]=4 16991 B12R1.44 CCNc1cc(c(c(c1)F)C)F 7a_100011216606_100000210202 [0,2,0,0,0,0|2,0,0]=4 16992 B12R1.44 CCNc1cc(c(c(c1)F)Cl)F 2230a_100000094121_100000210202 [0,2,0,0,0,0|2,0,0]=4 16993 B12R1.44 CCNc1cc(c(c(c1)F)Cl)F 34a_100000094121_100000210202 [0,2,0,0,0,0|2,0,0]=4 16994 B12R1.44 CCNc1cc(c(c(c1)F)Cl)F 7a_100000094121_100000210202 [0,2,0,0,0,0|2,0,0]=4 16995 B12R1.44 CCNc1cc(c(c(c1)F)F)C 2230a_100010704045_100000210202 [0,2,0,0,0,0|2,0,0]=4 16996 B12R1.44 CCNc1cc(c(c(c1)F)F)C 34a_100010704045_100000210202 [0,2,0,0,0,0|2,0,0]=4 16997 B12R1.44 CCNc1cc(c(c(c1)F)F)C 7a_100010704045_100000210202 [0,2,0,0,0,0|2,0,0]=4 16998 B12R1.44 CCNc1cc(c(c(c1)F)F)F 2230a_100000750163_100000210202 [0,2,0,0,0,0|2,0,0]=4 16999 B12R1.44 CCNc1cc(c(c(c1)F)F)F 34a_100000750163_100000210202 [0,2,0,0,0,0|2,0,0]=4 17000 B12R1.44 CCNc1cc(c(c(c1)F)F)F 7a_100000750163_100000210202 [0,2,0,0,0,0|2,0,0]=4 17001 B12R1.44 CCNc1cc(c(c(c1)F)I)F 34a_100000057532_100000210202 [0,2,0,0,0,0|2,0,0]=4 17002 B12R1.44 CCNc1cc(c(c(c1)F)I)F 7a_100000057532_100000210202 [0,2,0,0,0,0|2,0,0]=4 17003 B12R1.44 CCNc1cc(c(c(c1)F)O)F 34a_100016987357_100000210202 [0,2,0,0,0,0|1,0,0]=3 17004 B12R1.44 CCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000210202 [0,2,0,0,0,0|1,0,0]=3 17005 B12R1.44 CCOc1cc(c(c(c1)Br)C)Br 34a_100009813510_100000210202 [0,2,0,0,0,0|1,0,0]=3 17006 B12R1.44 CCOc1cc(c(c(c1)Br)C)Br 7a_100009813510_100000210202 [0,2,0,0,0,0|1,0,0]=3 17007 B12R1.44 CCOc1cc(c(c(c1)Br)C)C 34a_100010068915_100000210202 [0,2,0,0,0,0|1,0,0]=3 17008 B12R1.44 CCOc1cc(c(c(c1)Br)C)C 7a_100010068915_100000210202 [0,2,0,0,0,0|1,0,0]=3 17009 B12R1.44 CCOc1cc(c(c(c1)Br)Cl)Cl 34a_100016179818_100000210202 [0,2,0,0,0,0|1,0,0]=3 17010 B12R1.44 CCOc1cc(c(c(c1)Br)Cl)Cl 7a_100016179818_100000210202 [0,2,0,0,0,0|1,0,0]=3 17011 B12R1.44 CCOc1cc(c(c(c1)Br)F)Cl 34a_200011105948_100000210202 [0,2,0,0,0,0|1,0,0]=3 17012 B12R1.44 CCOc1cc(c(c(c1)Br)F)Cl 7a_200011105948_100000210202 [0,2,0,0,0,0|1,0,0]=3 17013 B12R1.44 CCOc1cc(c(c(c1)Br)N)Br 34a_200010887395_100000210202 [0,2,0,0,0,0|1,0,0]=3 17014 B12R1.44 CCOc1cc(c(c(c1)Br)N)Br 7a_200010887395_100000210202 [0,2,0,0,0,0|1,0,0]=3 17015 B12R1.44 CCOc1cc(c(c(c1)C)Br)C 34a_100000243743_100000210202 [0,2,0,0,0,0|1,0,0]=3 17016 B12R1.44 CCOc1cc(c(c(c1)C)Br)C 7a_100000243743_100000210202 [0,2,0,0,0,0|1,0,0]=3 17017 B12R1.44 CCOc1cc(c(c(c1)C)C)C 34a_200000042890_100000210202 [0,2,0,0,0,0|1,0,0]=3 17018 B12R1.44 CCOc1cc(c(c(c1)C)C)C 7a_200000042890_100000210202 [0,2,0,0,0,0|1,0,0]=3 17019 B12R1.44 CCOc1cc(c(c(c1)C)Cl)C 34a_100000739557_100000210202 [0,2,0,0,0,0|1,0,0]=3 17020 B12R1.44 CCOc1cc(c(c(c1)C)Cl)C 7a_100000739557_100000210202 [0,2,0,0,0,0|1,0,0]=3 17021 B12R1.44 CCOc1cc(c(c(c1)C)I)C 34a_100011216239_100000210202 [0,2,0,0,0,0|1,0,0]=3 17022 B12R1.44 CCOc1cc(c(c(c1)C)I)C 7a_100011216239_100000210202 [0,2,0,0,0,0|1,0,0]=3 17023 B12R1.44 CCOc1cc(c(c(c1)C)N)C 34a_100011934200_100000210202 [0,2,0,0,0,0|1,0,0]=3 17024 B12R1.44 CCOc1cc(c(c(c1)C)N)C 7a_100011934200_100000210202 [0,2,0,0,0,0|1,0,0]=3 17025 B12R1.44 CCOc1cc(c(c(c1)Cl)Br)Cl 34a_100009888979_100000210202 [0,2,0,0,0,0|1,0,0]=3 17026 B12R1.44 CCOc1cc(c(c(c1)Cl)Br)Cl 7a_100009888979_100000210202 [0,2,0,0,0,0|1,0,0]=3 17027 B12R1.44 CCOc1cc(c(c(c1)Cl)Cl)Cl 34a_100000074982_100000210202 [0,2,0,0,0,0|1,0,0]=3 17028 B12R1.44 CCOc1cc(c(c(c1)Cl)Cl)Cl 7a_100000074982_100000210202 [0,2,0,0,0,0|1,0,0]=3 17029 B12R1.44 CCOc1cc(c(c(c1)Cl)F)Cl 34a_100012242831_100000210202 [0,2,0,0,0,0|1,0,0]=3 17030 B12R1.44 CCOc1cc(c(c(c1)Cl)F)Cl 7a_100012242831_100000210202 [0,2,0,0,0,0|1,0,0]=3 17031 B12R1.44 CCOc1cc(c(c(c1)F)Br)F 34a_100009816007_100000210202 [0,2,0,0,0,0|1,0,0]=3 17032 B12R1.44 CCOc1cc(c(c(c1)F)Br)F 7a_100009816007_100000210202 [0,2,0,0,0,0|1,0,0]=3 17033 B12R1.44 CCOc1cc(c(c(c1)F)Cl)F 34a_100000117300_100000210202 [0,2,0,0,0,0|1,0,0]=3 17034 B12R1.44 CCOc1cc(c(c(c1)F)Cl)F 7a_100000117300_100000210202 [0,2,0,0,0,0|1,0,0]=3 17035 B12R1.44 CCOc1cc(c(c(c1)F)F)F 34a_100000237451_100000210202 [0,2,0,0,0,0|1,0,0]=3 17036 B12R1.44 CCOc1cc(c(c(c1)F)F)F 7a_100000237451_100000210202 [0,2,0,0,0,0|1,0,0]=3 17037 B12R1.44 CCOc1cc(c(c(c1)F)I)F 34a_100010219129_100000210202 [0,2,0,0,0,0|1,0,0]=3 17038 B12R1.44 CCOc1cc(c(c(c1)F)I)F 7a_100010219129_100000210202 [0,2,0,0,0,0|1,0,0]=3 17039 B12R1.44 CCOc1cc(c(c(c1)F)N)F 34a_100000036573_100000210202 [0,2,0,0,0,0|1,0,0]=3 17040 B12R1.44 CCOc1cc(c(c(c1)F)N)F 7a_100000036573_100000210202 [0,2,0,0,0,0|1,0,0]=3 17041 B12R1.44 CCOc1cc(n(c(=O)c1)C)C 34a_100000075388_100000210202 [0,2,0,0,0,0|2,0,0]=4 17042 B12R1.44 CCSc1cc(c(c(c1)Br)C)Br 62a_100000210202_100011099977 [0,2,0,0,0,0|1,1,0]=4 17043 B12R1.44 CCSc1cc(c(c(c1)Br)C)Br 62a_100011099977_100000210202 [0,2,0,0,0,0|1,1,0]=4 17044 B12R1.44 CCSc1cc(c(c(c1)Br)O)C 62a_100000210202_100010982682 [0,2,0,0,0,0|0,1,0]=3 17045 B12R1.44 CCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000210202 [0,2,0,0,0,0|0,1,0]=3 17046 B12R1.44 CCSc1cc(c(c(c1)C)Br)C 62a_100000210202_100012353698 [0,2,0,0,0,0|1,1,0]=4 17047 B12R1.44 CCSc1cc(c(c(c1)C)Br)C 62a_100012353698_100000210202 [0,2,0,0,0,0|1,1,0]=4 17048 B12R1.44 CCSc1cc(c(c(c1)C)C)C 62a_100000210202_200011015895 [0,2,0,0,0,0|1,1,0]=4 17049 B12R1.44 CCSc1cc(c(c(c1)C)C)C 62a_200011015895_100000210202 [0,2,0,0,0,0|1,1,0]=4 17050 B12R1.44 CCSc1cc(c(c(c1)C)F)C 62a_100000210202_100009814169 [0,2,0,0,0,0|1,1,0]=4 17051 B12R1.44 CCSc1cc(c(c(c1)C)F)C 62a_100009814169_100000210202 [0,2,0,0,0,0|1,1,0]=4 17052 B12R1.44 CCSc1cc(c(c(c1)C)N)C 62a_100000210202_100000737279 [0,2,0,0,0,0|1,1,0]=4 17053 B12R1.44 CCSc1cc(c(c(c1)C)N)C 62a_100000737279_100000210202 [0,2,0,0,0,0|1,1,0]=4 17054 B12R1.44 CCSc1cc(c(c(c1)C)O)C 62a_100000210202_100011216129 [0,2,0,0,0,0|0,1,0]=3 17055 B12R1.44 CCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000210202 [0,2,0,0,0,0|0,1,0]=3 17056 B12R1.44 CCSc1cc(c(c(c1)Cl)Br)Cl 62a_100000210202_200010212260 [0,2,0,0,0,0|1,1,0]=4 17057 B12R1.44 CCSc1cc(c(c(c1)Cl)Br)Cl 62a_200010212260_100000210202 [0,2,0,0,0,0|1,1,0]=4 17058 B12R1.44 CCSc1cc(c(c(c1)Cl)F)Cl 62a_100000210202_100012357505 [0,2,0,0,0,0|1,1,0]=4 17059 B12R1.44 CCSc1cc(c(c(c1)Cl)F)Cl 62a_100012357505_100000210202 [0,2,0,0,0,0|1,1,0]=4 17060 B12R1.44 CCSc1cc(c(c(c1)Cl)O)C 62a_100000210202_200015900153 [0,2,0,0,0,0|0,1,0]=3 17061 B12R1.44 CCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000210202 [0,2,0,0,0,0|0,1,0]=3 17062 B12R1.44 CCSc1cc(c(c(c1)Cl)O)Cl 62a_100000210202_100012339652 [0,2,0,0,0,0|0,1,0]=3 17063 B12R1.44 CCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000210202 [0,2,0,0,0,0|0,1,0]=3 17064 B12R1.44 CCSc1cc(c(c(c1)F)Br)F 62a_100000210202_100010176052 [0,2,0,0,0,0|1,1,0]=4 17065 B12R1.44 CCSc1cc(c(c(c1)F)Br)F 62a_100010176052_100000210202 [0,2,0,0,0,0|1,1,0]=4 17066 B12R1.44 CCSc1cc(c(c(c1)F)C)F 62a_100000210202_100009814309 [0,2,0,0,0,0|1,1,0]=4 17067 B12R1.44 CCSc1cc(c(c(c1)F)C)F 62a_100009814309_100000210202 [0,2,0,0,0,0|1,1,0]=4 17068 B12R1.44 CCSc1cc(c(c(c1)F)C)N 62a_100000210202_100009813729 [0,2,0,0,0,0|1,1,0]=4 17069 B12R1.44 CCSc1cc(c(c(c1)F)C)N 62a_100009813729_100000210202 [0,2,0,0,0,0|1,1,0]=4 17070 B12R1.44 CCSc1cc(c(c(c1)F)Cl)F 62a_100000210202_100010154629 [0,2,0,0,0,0|1,1,0]=4 17071 B12R1.44 CCSc1cc(c(c(c1)F)Cl)F 62a_100010154629_100000210202 [0,2,0,0,0,0|1,1,0]=4 17072 B12R1.44 CCSc1cc(c(c(c1)F)F)C 62a_100000210202_200011068660 [0,2,0,0,0,0|1,1,0]=4 17073 B12R1.44 CCSc1cc(c(c(c1)F)F)C 62a_200011068660_100000210202 [0,2,0,0,0,0|1,1,0]=4 17074 B12R1.44 CCSc1cc(c(c(c1)F)F)F 62a_100000210202_100011215606 [0,2,0,0,0,0|1,1,0]=4 17075 B12R1.44 CCSc1cc(c(c(c1)F)F)F 62a_100011215606_100000210202 [0,2,0,0,0,0|1,1,0]=4 17076 B12R1.44 CCSc1cc(c(c(c1)F)F)O 62a_100000210202_100000709865 [0,2,0,0,0,0|1,1,0]=4 17077 B12R1.44 CCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000210202 [0,2,0,0,0,0|1,1,0]=4 17078 B12R1.44 CCSc1cc(c(c(c1)F)N)C 62a_100000210202_100000709789 [0,2,0,0,0,0|1,1,0]=4 17079 B12R1.44 CCSc1cc(c(c(c1)F)N)C 62a_100000709789_100000210202 [0,2,0,0,0,0|1,1,0]=4 17080 B12R1.44 CCSc1cc(c(c(c1)F)N)F 62a_100000210202_100000758902 [0,2,0,0,0,0|1,1,0]=4 17081 B12R1.44 CCSc1cc(c(c(c1)F)N)F 62a_100000758902_100000210202 [0,2,0,0,0,0|1,1,0]=4 17082 B12R1.44 CCSc1cc(c(c(c1)F)N)N 62a_100000210202_100011218333 [0,2,0,0,0,0|1,1,0]=4 17083 B12R1.44 CCSc1cc(c(c(c1)F)N)N 62a_100011218333_100000210202 [0,2,0,0,0,0|1,1,0]=4 17084 B12R1.44 CCSc1cc(c(c(c1)F)N)O 62a_100000210202_100015475841 [0,2,0,0,0,0|1,1,0]=4 17085 B12R1.44 CCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000210202 [0,2,0,0,0,0|1,1,0]=4 17086 B12R1.44 CCSc1cc(c(c(c1)F)O)F 62a_100000210202_100011216917 [0,2,0,0,0,0|0,1,0]=3 17087 B12R1.44 CCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000210202 [0,2,0,0,0,0|0,1,0]=3 17088 B12R1.44 CCSc1cc(c(c(c1)F)O)N 62a_100000210202_100011217383 [0,2,0,0,0,0|0,1,0]=3 17089 B12R1.44 CCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000210202 [0,2,0,0,0,0|0,1,0]=3 17090 B12R1.44 CCSc1cc(c(c(c1)F)O)O 62a_100000210202_100010114375 [0,2,0,0,0,0|0,1,0]=3 17091 B12R1.44 CCSc1cc(c(c(c1)N)F)C 62a_100000210202_100010381932 [0,2,0,0,0,0|1,1,0]=4 17092 B12R1.44 CCSc1cc(c(c(c1)N)F)C 62a_100010381932_100000210202 [0,2,0,0,0,0|1,1,0]=4 17093 B12R1.44 CCSc1cc(c(c(c1)N)N)C 62a_100000210202_100000688557 [0,2,0,0,0,0|1,1,0]=4 17094 B12R1.44 CCSc1cc(c(c(c1)N)N)C 62a_100000688557_100000210202 [0,2,0,0,0,0|1,1,0]=4 17095 B12R1.44 CCSc1cc(c(c(c1)N)O)C 62a_100000210202_100011825904 [0,2,0,0,0,0|0,1,0]=3 17096 B12R1.44 CCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000210202 [0,2,0,0,0,0|0,1,0]=3 17097 B12R1.44 CCSc1cc(c(c(c1)O)N)C 62a_100000210202_100010371313 [0,2,0,0,0,0|1,1,0]=4 17098 B12R1.44 CCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000210202 [0,2,0,0,0,0|1,1,0]=4 17099 B12R1.44 CCSc1cc(c(c(c1)O)O)O 62a_100000210202_100010658518 [0,2,0,0,0,0|0,1,0]=3 17100 B12R1.44 Cc1c(cc(cc1Br)OCF)Br 34a_100009813510_100015361967 [0,2,0,0,0,0|2,0,0]=4 17101 B12R1.44 Cc1c(cc(cc1Br)OCF)Br 7a_100009813510_100015361967 [0,2,0,0,0,0|2,0,0]=4 17102 B12R1.44 Cc1cc(cc(c1Br)C)OCF 34a_100000243743_100015361967 [0,2,0,0,0,0|2,0,0]=4 17103 B12R1.44 Cc1cc(cc(c1Br)C)OCF 7a_100000243743_100015361967 [0,2,0,0,0,0|2,0,0]=4 17104 B12R1.44 Cc1cc(cc(c1C)Br)OCF 34a_100010068915_100015361967 [0,2,0,0,0,0|2,0,0]=4 17105 B12R1.44 Cc1cc(cc(c1C)Br)OCF 7a_100010068915_100015361967 [0,2,0,0,0,0|2,0,0]=4 17106 B12R1.44 Cc1cc(cc(c1C)C)OCF 34a_200000042890_100015361967 [0,2,0,0,0,0|2,0,0]=4 17107 B12R1.44 Cc1cc(cc(c1C)C)OCF 7a_200000042890_100015361967 [0,2,0,0,0,0|2,0,0]=4 17108 B12R1.44 Cc1cc(cc(c1Cl)C)OCF 34a_100000739557_100015361967 [0,2,0,0,0,0|2,0,0]=4 17109 B12R1.44 Cc1cc(cc(c1Cl)C)OCF 7a_100000739557_100015361967 [0,2,0,0,0,0|2,0,0]=4 17110 B12R1.44 Cc1cc(cc(c1I)C)OCF 34a_100011216239_100015361967 [0,2,0,0,0,0|2,0,0]=4 17111 B12R1.44 Cc1cc(cc(c1I)C)OCF 7a_100011216239_100015361967 [0,2,0,0,0,0|2,0,0]=4 17112 B12R1.44 Cc1cc(cc(c1N)C)OCF 34a_100011934200_100015361967 [0,2,0,0,0,0|2,0,0]=4 17113 B12R1.44 Cc1cc(cc(c1N)C)OCF 7a_100011934200_100015361967 [0,2,0,0,0,0|2,0,0]=4 17114 B12R1.44 Cc1cc(cc(c1O)Br)NCF 34a_100010064301_100015361967 [0,2,0,0,0,0|2,0,0]=4 17115 B12R1.44 Cc1cc(cc(c1O)Br)NCF 7a_100010064301_100015361967 [0,2,0,0,0,0|2,0,0]=4 17116 B12R1.44 Cc1cc(cc(c1O)Br)SCF 62a_100010982682_100015361967 [0,2,0,0,0,0|1,1,0]=4 17117 B12R1.44 Cc1cc(cc(c1O)Br)SCF 62a_100015361967_100010982682 [0,2,0,0,0,0|1,1,0]=4 17118 B12R1.44 Cc1cc(cc(c1O)C)NCF 34a_100000703291_100015361967 [0,2,0,0,0,0|2,0,0]=4 17119 B12R1.44 Cc1cc(cc(c1O)C)NCF 7a_100000703291_100015361967 [0,2,0,0,0,0|2,0,0]=4 17120 B12R1.44 Cc1cc(cc(c1O)C)SCF 62a_100011216129_100015361967 [0,2,0,0,0,0|1,1,0]=4 17121 B12R1.44 Cc1cc(cc(c1O)C)SCF 62a_100015361967_100011216129 [0,2,0,0,0,0|1,1,0]=4 17122 B12R1.44 Cc1cc(cc(c1O)Cl)SCF 62a_100015361967_200015900153 [0,2,0,0,0,0|1,1,0]=4 17123 B12R1.44 Cc1cc(cc(c1O)Cl)SCF 62a_200015900153_100015361967 [0,2,0,0,0,0|1,1,0]=4 17124 B12R1.44 Cc1cc(cc(c1O)N)SCF 62a_100011825904_100015361967 [0,2,0,0,0,0|1,1,0]=4 17125 B12R1.44 Cc1cc(cc(c1O)N)SCF 62a_100015361967_100011825904 [0,2,0,0,0,0|1,1,0]=4 17126 B12R1.44 FCOc1cc(c(c(c1)Br)Cl)Cl 34a_100016179818_100015361967 [0,2,0,0,0,0|2,0,0]=4 17127 B12R1.44 FCOc1cc(c(c(c1)Br)Cl)Cl 7a_100016179818_100015361967 [0,2,0,0,0,0|2,0,0]=4 17128 B12R1.44 FCOc1cc(c(c(c1)Br)F)Cl 34a_200011105948_100015361967 [0,2,0,0,0,0|2,0,0]=4 17129 B12R1.44 FCOc1cc(c(c(c1)Br)F)Cl 7a_200011105948_100015361967 [0,2,0,0,0,0|2,0,0]=4 17130 B12R1.44 FCOc1cc(c(c(c1)Cl)Br)Cl 34a_100009888979_100015361967 [0,2,0,0,0,0|2,0,0]=4 17131 B12R1.44 FCOc1cc(c(c(c1)Cl)Br)Cl 7a_100009888979_100015361967 [0,2,0,0,0,0|2,0,0]=4 17132 B12R1.44 FCOc1cc(c(c(c1)Cl)Cl)Cl 34a_100000074982_100015361967 [0,2,0,0,0,0|2,0,0]=4 17133 B12R1.44 FCOc1cc(c(c(c1)Cl)Cl)Cl 7a_100000074982_100015361967 [0,2,0,0,0,0|2,0,0]=4 17134 B12R1.44 FCOc1cc(c(c(c1)Cl)F)Cl 34a_100012242831_100015361967 [0,2,0,0,0,0|2,0,0]=4 17135 B12R1.44 FCOc1cc(c(c(c1)Cl)F)Cl 7a_100012242831_100015361967 [0,2,0,0,0,0|2,0,0]=4 17136 B12R1.44 FCOc1cc(c(c(c1)F)Br)F 34a_100009816007_100015361967 [0,2,0,0,0,0|2,0,0]=4 17137 B12R1.44 FCOc1cc(c(c(c1)F)Br)F 7a_100009816007_100015361967 [0,2,0,0,0,0|2,0,0]=4 17138 B12R1.44 FCOc1cc(c(c(c1)F)Cl)F 34a_100000117300_100015361967 [0,2,0,0,0,0|2,0,0]=4 17139 B12R1.44 FCOc1cc(c(c(c1)F)Cl)F 7a_100000117300_100015361967 [0,2,0,0,0,0|2,0,0]=4 17140 B12R1.44 FCOc1cc(c(c(c1)F)F)F 34a_100000237451_100015361967 [0,2,0,0,0,0|2,0,0]=4 17141 B12R1.44 FCOc1cc(c(c(c1)F)F)F 7a_100000237451_100015361967 [0,2,0,0,0,0|2,0,0]=4 17142 B12R1.44 FCOc1cc(c(c(c1)F)I)F 34a_100010219129_100015361967 [0,2,0,0,0,0|2,0,0]=4 17143 B12R1.44 FCOc1cc(c(c(c1)F)I)F 7a_100010219129_100015361967 [0,2,0,0,0,0|2,0,0]=4 17144 B12R1.44 Nc1c(cc(cc1Br)OCF)Br 34a_200010887395_100015361967 [0,2,0,0,0,0|2,0,0]=4 17145 B12R1.44 Nc1c(cc(cc1Br)OCF)Br 7a_200010887395_100015361967 [0,2,0,0,0,0|2,0,0]=4 17146 B12R1.44 Nc1c(cc(cc1F)OCF)F 34a_100000036573_100015361967 [0,2,0,0,0,0|2,0,0]=4 17147 B12R1.44 Nc1c(cc(cc1F)OCF)F 7a_100000036573_100015361967 [0,2,0,0,0,0|2,0,0]=4 17148 B12R1.44 Nc1cc(cc(c1O)F)SCF 62a_100011217383_100015361967 [0,2,0,0,0,0|1,1,0]=4 17149 B12R1.44 Nc1cc(cc(c1O)F)SCF 62a_100015361967_100011217383 [0,2,0,0,0,0|1,1,0]=4 17150 B12R1.44 Oc1c(cc(cc1Br)NCF)Br 34a_200000186426_100015361967 [0,2,0,0,0,0|2,0,0]=4 17151 B12R1.44 Oc1c(cc(cc1Cl)NCF)Cl 34a_100000695418_100015361967 [0,2,0,0,0,0|2,0,0]=4 17152 B12R1.44 Oc1c(cc(cc1Cl)NCF)Cl 7a_100000695418_100015361967 [0,2,0,0,0,0|2,0,0]=4 17153 B12R1.44 Oc1c(cc(cc1Cl)SCF)Cl 62a_100012339652_100015361967 [0,2,0,0,0,0|1,1,0]=4 17154 B12R1.44 Oc1c(cc(cc1Cl)SCF)Cl 62a_100015361967_100012339652 [0,2,0,0,0,0|1,1,0]=4 17155 B12R1.44 Oc1c(cc(cc1F)NCF)F 34a_100016987357_100015361967 [0,2,0,0,0,0|2,0,0]=4 17156 B12R1.44 Oc1c(cc(cc1F)NCF)F 7a_100016987357_100015361967 [0,2,0,0,0,0|2,0,0]=4 17157 B12R1.44 Oc1c(cc(cc1F)SCF)F 62a_100011216917_100015361967 [0,2,0,0,0,0|1,1,0]=4 17158 B12R1.44 Oc1c(cc(cc1F)SCF)F 62a_100015361967_100011216917 [0,2,0,0,0,0|1,1,0]=4 17159 B12R1.44 Oc1cc(cc(c1O)F)SCF 62a_100015361967_100010114375 [0,2,0,0,0,0|1,1,0]=4 17160 B12R1.44 Oc1cc(cc(c1O)O)SCF 62a_100015361967_100010658518 [0,2,0,0,0,0|1,1,0]=4 17161 B12R1.286 C#Cc1cc(ccc1C)NCC 2230a_200012017271_100000210202 [0,2,0,0,0,0|2,0,0]=4 17162 B12R1.286 C#Cc1cc(ccc1C)NCC 34a_200012017271_100000210202 [0,2,0,0,0,0|2,0,0]=4 17163 B12R1.286 C#Cc1cc(ccc1Cl)NCC 2230a_103624766972_100000210202 [0,2,0,0,0,0|2,0,0]=4 17164 B12R1.286 C#Cc1cc(ccc1Cl)NCC 34a_103624766972_100000210202 [0,2,0,0,0,0|2,0,0]=4 17165 B12R1.286 C#Cc1cc(ccc1F)NCC 2230a_200011999510_100000210202 [0,2,0,0,0,0|2,0,0]=4 17166 B12R1.286 C#Cc1cc(ccc1F)NCC 34a_200011999510_100000210202 [0,2,0,0,0,0|2,0,0]=4 17167 B12R1.286 C=Cc1cc(ccc1C)OCC 271570a_100011290941_100011099959 [0,2,0,0,0,0|1,0,0]=3 17168 B12R1.286 C=Cc1cc(ccc1F)SCC 62a_100000210202_100000688377 [0,2,0,0,0,0|1,1,0]=4 17169 B12R1.286 C=Cc1cc(ccc1F)SCC 62a_100000688377_100000210202 [0,2,0,0,0,0|1,1,0]=4 17170 B12R1.286 CC=Cc1ccc(c(c1)C#N)O 271570a_100016259895_100000687585 [0,2,0,0,0,0|1,0,1]=4 17171 B12R1.286 CC=Cc1ccc(c(c1)C=O)O 271570a_100016259895_100000186750 [0,2,0,0,0,0|1,0,1]=4 17172 B12R1.286 CC=Cc1ccc(c(c1)CC)O 271570a_100016259895_100012338938 [0,2,0,0,0,0|1,0,1]=4 17173 B12R1.286 CC=Cc1ccc(c(c1)CN)O 271570a_100016259895_100000730032 [0,2,0,0,0,0|1,0,1]=4 17174 B12R1.286 CC=Cc1ccc(c(c1)CO)O 271570a_100016259895_100000184703 [0,2,0,0,0,0|1,0,1]=4 17175 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [0,2,0,0,0,0|1,0,1]=4 17176 B12R1.286 CCNc1ccc(c(c1)C#N)Br 34a_100011934039_100000210202 [0,2,0,0,0,0|2,0,0]=4 17177 B12R1.286 CCNc1ccc(c(c1)C#N)Br 7a_100011934039_100000210202 [0,2,0,0,0,0|2,0,0]=4 17178 B12R1.286 CCNc1ccc(c(c1)C#N)C 34a_100011216687_100000210202 [0,2,0,0,0,0|2,0,0]=4 17179 B12R1.286 CCNc1ccc(c(c1)C#N)C 7a_100011216687_100000210202 [0,2,0,0,0,0|2,0,0]=4 17180 B12R1.286 CCNc1ccc(c(c1)C#N)Cl 34a_100000239497_100000210202 [0,2,0,0,0,0|2,0,0]=4 17181 B12R1.286 CCNc1ccc(c(c1)C#N)Cl 7a_100000239497_100000210202 [0,2,0,0,0,0|2,0,0]=4 17182 B12R1.286 CCNc1ccc(c(c1)C#N)F 34a_100000748589_100000210202 [0,2,0,0,0,0|2,0,0]=4 17183 B12R1.286 CCNc1ccc(c(c1)C#N)F 7a_100000748589_100000210202 [0,2,0,0,0,0|2,0,0]=4 17184 B12R1.286 CCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210202 [0,2,0,0,0,0|1,0,0]=3 17185 B12R1.286 CCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000210202 [0,2,0,0,0,0|2,0,0]=4 17186 B12R1.286 CCNc1ccc(c(c1)CC)Br 34a_100010109747_100000210202 [0,2,0,0,0,0|2,0,0]=4 17187 B12R1.286 CCNc1ccc(c(c1)CC)Br 7a_100010109747_100000210202 [0,2,0,0,0,0|2,0,0]=4 17188 B12R1.286 CCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000210202 [0,2,0,0,0,0|2,0,0]=4 17189 B12R1.286 CCNc1ccc(c(c1)CO)Br 34a_100012347228_100000210202 [0,2,0,0,0,0|2,0,0]=4 17190 B12R1.286 CCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000210202 [0,2,0,0,0,0|2,0,0]=4 17191 B12R1.286 CCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000210202 [0,2,0,0,0,0|2,0,0]=4 17192 B12R1.286 CCNc1ccc(c(c1)CO)F 34a_100011218011_100000210202 [0,2,0,0,0,0|2,0,0]=4 17193 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [0,2,0,0,0,0|2,0,0]=4 17194 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [0,2,0,0,0,0|2,0,0]=4 17195 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [0,2,0,0,0,0|2,0,0]=4 17196 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [0,2,0,0,0,0|2,0,0]=4 17197 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [0,2,0,0,0,0|2,0,0]=4 17198 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [0,2,0,0,0,0|2,0,0]=4 17199 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [0,2,0,0,0,0|2,0,0]=4 17200 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [0,2,0,0,0,0|2,0,0]=4 17201 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [0,2,0,0,0,0|2,0,0]=4 17202 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [0,2,0,0,0,0|1,0,0]=3 17203 B12R1.286 CCOc1cc(c(cn1)O)C=O 271570a_203496583355_200010223332 [0,2,0,0,0,0|1,0,0]=3 17204 B12R1.286 CCOc1ccc(c(c1)C#N)Br 34a_100009818209_100000210202 [0,2,0,0,0,0|1,0,0]=3 17205 B12R1.286 CCOc1ccc(c(c1)C#N)Br 7a_100009818209_100000210202 [0,2,0,0,0,0|1,0,0]=3 17206 B12R1.286 CCOc1ccc(c(c1)C#N)Cl 34a_100000092820_100000210202 [0,2,0,0,0,0|1,0,0]=3 17207 B12R1.286 CCOc1ccc(c(c1)C#N)Cl 7a_100000092820_100000210202 [0,2,0,0,0,0|1,0,0]=3 17208 B12R1.286 CCOc1ccc(c(c1)C#N)F 34a_100000070142_100000210202 [0,2,0,0,0,0|1,0,0]=3 17209 B12R1.286 CCOc1ccc(c(c1)C#N)F 7a_100000070142_100000210202 [0,2,0,0,0,0|1,0,0]=3 17210 B12R1.286 CCOc1ccc(c(c1)C#N)N 34a_200011997737_100000210202 [0,2,0,0,0,0|1,0,0]=3 17211 B12R1.286 CCOc1ccc(c(c1)C#N)N 7a_200011997737_100000210202 [0,2,0,0,0,0|1,0,0]=3 17212 B12R1.286 CCOc1ccc(c(c1)C=O)O 271570a_203496583355_100012345016 [0,2,0,0,0,0|0,0,0]=2 17213 B12R1.286 CCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000210202 [0,2,0,0,0,0|1,0,0]=3 17214 B12R1.286 CCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000210202 [0,2,0,0,0,0|1,0,0]=3 17215 B12R1.286 CCOc1ccc(c(c1)CN)C 34a_200009844824_100000210202 [0,2,0,0,0,0|1,0,0]=3 17216 B12R1.286 CCOc1ccc(c(c1)CO)Br 34a_100012351483_100000210202 [0,2,0,0,0,0|1,0,0]=3 17217 B12R1.286 CCOc1ccc(c(c1)CO)Br 7a_100012351483_100000210202 [0,2,0,0,0,0|1,0,0]=3 17218 B12R1.286 CCOc1ccc(c(c1)CO)C 34a_100009878257_100000210202 [0,2,0,0,0,0|1,0,0]=3 17219 B12R1.286 CCOc1ccc(c(c1)CO)C 7a_100009878257_100000210202 [0,2,0,0,0,0|1,0,0]=3 17220 B12R1.286 CCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000210202 [0,2,0,0,0,0|1,0,0]=3 17221 B12R1.286 CCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000210202 [0,2,0,0,0,0|1,0,0]=3 17222 B12R1.286 CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210202 [0,2,0,0,0,0|1,0,0]=3 17223 B12R1.286 CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210202 [0,2,0,0,0,0|1,0,0]=3 17224 B12R1.286 CCOc1ccc(c(c1)OC)C 34a_100009865632_100000210202 [0,2,0,0,0,0|1,0,0]=3 17225 B12R1.286 CCOc1ccc(c(c1)OC)C 7a_100009865632_100000210202 [0,2,0,0,0,0|1,0,0]=3 17226 B12R1.286 CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210202 [0,2,0,0,0,0|1,0,0]=3 17227 B12R1.286 CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210202 [0,2,0,0,0,0|1,0,0]=3 17228 B12R1.286 CCOc1ccc(c(c1)OC)F 34a_100012001760_100000210202 [0,2,0,0,0,0|1,0,0]=3 17229 B12R1.286 CCOc1ccc(c(c1)OC)F 7a_100012001760_100000210202 [0,2,0,0,0,0|1,0,0]=3 17230 B12R1.286 CCOc1ccc(c(c1)OC)N 34a_100015326901_100000210202 [0,2,0,0,0,0|1,0,0]=3 17231 B12R1.286 CCOc1ccc(c(c1)OC)N 7a_100015326901_100000210202 [0,2,0,0,0,0|1,0,0]=3 17232 B12R1.286 CCOc1ccc(c(c1)SC)C 62a_200000210301_100011099959 [0,2,0,0,0,0|1,0,0]=3 17233 B12R1.286 CCOc1ccc(c(c1)S[13CH3])C 62a_200025704644_100011099959 [0,2,0,0,0,0|1,0,0]=3 17234 B12R1.286 CCSc1cc(c(cn1)O)C=O 62a_100000210202_100000048449 [0,2,0,0,0,0|1,1,0]=4 17235 B12R1.286 CCSc1ccc(c(c1)C#N)Br 62a_100000210202_100012355174 [0,2,0,0,0,0|1,1,0]=4 17236 B12R1.286 CCSc1ccc(c(c1)C#N)Br 62a_100012355174_100000210202 [0,2,0,0,0,0|1,1,0]=4 17237 B12R1.286 CCSc1ccc(c(c1)C#N)C 62a_100000210202_100011356939 [0,2,0,0,0,0|1,1,0]=4 17238 B12R1.286 CCSc1ccc(c(c1)C#N)Cl 62a_100000210202_100011356831 [0,2,0,0,0,0|1,1,0]=4 17239 B12R1.286 CCSc1ccc(c(c1)C#N)F 62a_100000210202_100000037165 [0,2,0,0,0,0|1,1,0]=4 17240 B12R1.286 CCSc1ccc(c(c1)C#N)N 62a_100000210202_100000688460 [0,2,0,0,0,0|1,1,0]=4 17241 B12R1.286 CCSc1ccc(c(c1)C#N)O 62a_100000210202_100000687585 [0,2,0,0,0,0|0,1,0]=3 17242 B12R1.286 CCSc1ccc(c(c1)C=O)Br 62a_100000210202_100010185652 [0,2,0,0,0,0|1,1,0]=4 17243 B12R1.286 CCSc1ccc(c(c1)C=O)Br 62a_100010185652_100000210202 [0,2,0,0,0,0|1,1,0]=4 17244 B12R1.286 CCSc1ccc(c(c1)C=O)C 62a_100000210202_100011361606 [0,2,0,0,0,0|1,1,0]=4 17245 B12R1.286 CCSc1ccc(c(c1)C=O)C 62a_100011361606_100000210202 [0,2,0,0,0,0|1,1,0]=4 17246 B12R1.286 CCSc1ccc(c(c1)C=O)Cl 62a_100000210202_100010254384 [0,2,0,0,0,0|1,1,0]=4 17247 B12R1.286 CCSc1ccc(c(c1)C=O)Cl 62a_100010254384_100000210202 [0,2,0,0,0,0|1,1,0]=4 17248 B12R1.286 CCSc1ccc(c(c1)C=O)F 62a_100000050626_100000210202 [0,2,0,0,0,0|1,1,0]=4 17249 B12R1.286 CCSc1ccc(c(c1)C=O)F 62a_100000210202_100000050626 [0,2,0,0,0,0|1,1,0]=4 17250 B12R1.286 CCSc1ccc(c(c1)C=O)N 62a_100011935258_100000210202 [0,2,0,0,0,0|1,1,0]=4 17251 B12R1.286 CCSc1ccc(c(c1)C=O)O 62a_100000210202_100000186750 [0,2,0,0,0,0|0,1,0]=3 17252 B12R1.286 CCSc1ccc(c(c1)CC)Br 62a_100000210202_100010244631 [0,2,0,0,0,0|1,1,0]=4 17253 B12R1.286 CCSc1ccc(c(c1)CC)Br 62a_100010244631_100000210202 [0,2,0,0,0,0|1,1,0]=4 17254 B12R1.286 CCSc1ccc(c(c1)CC)F 62a_100000210202_100010244625 [0,2,0,0,0,0|1,1,0]=4 17255 B12R1.286 CCSc1ccc(c(c1)CC)F 62a_100010244625_100000210202 [0,2,0,0,0,0|1,1,0]=4 17256 B12R1.286 CCSc1ccc(c(c1)CC)N 62a_100000210202_100000686106 [0,2,0,0,0,0|1,1,0]=4 17257 B12R1.286 CCSc1ccc(c(c1)CC)N 62a_100000686106_100000210202 [0,2,0,0,0,0|1,1,0]=4 17258 B12R1.286 CCSc1ccc(c(c1)CC)O 62a_100000210202_100012338938 [0,2,0,0,0,0|0,1,0]=3 17259 B12R1.286 CCSc1ccc(c(c1)CN)F 62a_100000210202_100009815772 [0,2,0,0,0,0|1,1,0]=4 17260 B12R1.286 CCSc1ccc(c(c1)CN)F 62a_100009815772_100000210202 [0,2,0,0,0,0|1,1,0]=4 17261 B12R1.286 CCSc1ccc(c(c1)CN)N 62a_100000210202_100012349119 [0,2,0,0,0,0|1,1,0]=4 17262 B12R1.286 CCSc1ccc(c(c1)CN)N 62a_100012349119_100000210202 [0,2,0,0,0,0|1,1,0]=4 17263 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000210202_100000730032 [0,2,0,0,0,0|0,1,0]=3 17264 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000730032_100000210202 [0,2,0,0,0,0|0,1,0]=3 17265 B12R1.286 CCSc1ccc(c(c1)CO)Br 62a_100000210202_100012359683 [0,2,0,0,0,0|1,1,0]=4 17266 B12R1.286 CCSc1ccc(c(c1)CO)Br 62a_100012359683_100000210202 [0,2,0,0,0,0|1,1,0]=4 17267 B12R1.286 CCSc1ccc(c(c1)CO)C 62a_100000210202_100000700630 [0,2,0,0,0,0|1,1,0]=4 17268 B12R1.286 CCSc1ccc(c(c1)CO)C 62a_100000700630_100000210202 [0,2,0,0,0,0|1,1,0]=4 17269 B12R1.286 CCSc1ccc(c(c1)CO)Cl 62a_100000210202_100010128486 [0,2,0,0,0,0|1,1,0]=4 17270 B12R1.286 CCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000210202 [0,2,0,0,0,0|1,1,0]=4 17271 B12R1.286 CCSc1ccc(c(c1)CO)F 62a_100000210202_100000246282 [0,2,0,0,0,0|1,1,0]=4 17272 B12R1.286 CCSc1ccc(c(c1)CO)F 62a_100000246282_100000210202 [0,2,0,0,0,0|1,1,0]=4 17273 B12R1.286 CCSc1ccc(c(c1)CO)N 62a_100000210202_100012353972 [0,2,0,0,0,0|1,1,0]=4 17274 B12R1.286 CCSc1ccc(c(c1)CO)N 62a_100012353972_100000210202 [0,2,0,0,0,0|1,1,0]=4 17275 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000184703_100000210202 [0,2,0,0,0,0|0,1,0]=3 17276 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000210202_100000184703 [0,2,0,0,0,0|0,1,0]=3 17277 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100000210202_100020629602 [0,2,0,0,0,0|1,1,0]=4 17278 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100020629602_100000210202 [0,2,0,0,0,0|1,1,0]=4 17279 B12R1.286 CCSc1ccc(c(c1)NC)F 62a_100000210202_100011314990 [0,2,0,0,0,0|1,1,0]=4 17280 B12R1.286 CCSc1ccc(c(c1)NC)F 62a_100011314990_100000210202 [0,2,0,0,0,0|1,1,0]=4 17281 B12R1.286 CCSc1ccc(c(c1)NC)N 62a_100000694363_100000210202 [0,2,0,0,0,0|1,1,0]=4 17282 B12R1.286 CCSc1ccc(c(c1)NN)F 62a_100000210202_100020610843 [0,2,0,0,0,0|1,1,0]=4 17283 B12R1.286 CCSc1ccc(c(c1)NN)F 62a_100020610843_100000210202 [0,2,0,0,0,0|1,1,0]=4 17284 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100000210202_100012353699 [0,2,0,0,0,0|1,1,0]=4 17285 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210202 [0,2,0,0,0,0|1,1,0]=4 17286 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100000210202_100011830276 [0,2,0,0,0,0|1,1,0]=4 17287 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210202 [0,2,0,0,0,0|1,1,0]=4 17288 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100000210202_100011356853 [0,2,0,0,0,0|1,1,0]=4 17289 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210202 [0,2,0,0,0,0|1,1,0]=4 17290 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100000210202_100011934186 [0,2,0,0,0,0|1,1,0]=4 17291 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210202 [0,2,0,0,0,0|1,1,0]=4 17292 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100000210202_100015196925 [0,2,0,0,0,0|1,1,0]=4 17293 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210202 [0,2,0,0,0,0|1,1,0]=4 17294 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [0,2,0,0,0,0|0,1,0]=3 17295 B12R1.286 CCSc1ccc(c(c1)SC)F 62a_100000210202_100010341305 [0,2,0,0,0,0|1,1,0]=4 17296 B12R1.286 CCSc1ccc(c(c1)SC)F 62a_100010341305_100000210202 [0,2,0,0,0,0|1,1,0]=4 17297 B12R1.286 CCSc1ccc(c(n1)OC)O 62a_100000210202_100010893133 [0,2,0,0,0,0|1,1,0]=4 17298 B12R1.286 CCSc1cnc(c(c1)C#N)O 62a_100000210202_100000697733 [0,2,0,0,0,0|1,1,0]=4 17299 B12R1.286 CCSc1cnc(c(c1)C=O)O 62a_100000210202_100010064889 [0,2,0,0,0,0|1,1,0]=4 17300 B12R1.286 CCSc1cnc(c(c1)C=O)O 62a_100010064889_100000210202 [0,2,0,0,0,0|1,1,0]=4 17301 B12R1.286 CCSc1cnc(c(c1)CO)O 62a_100000210202_100010065268 [0,2,0,0,0,0|1,1,0]=4 17302 B12R1.286 CCSc1cnc(c(c1)CO)O 62a_100010065268_100000210202 [0,2,0,0,0,0|1,1,0]=4 17303 B12R1.286 CCc1cc(ccc1Cl)OCF 34a_100000212063_100015361967 [0,2,0,0,0,0|2,0,0]=4 17304 B12R1.286 CCc1cc(ccc1Cl)OCF 7a_100000212063_100015361967 [0,2,0,0,0,0|2,0,0]=4 17305 B12R1.286 CCc1cc(ccc1O)SCF 62a_100015361967_100012338938 [0,2,0,0,0,0|1,1,0]=4 17306 B12R1.286 CNCc1ccc(c(c1)C=O)O 7a_106832991635_100000008128 [0,2,0,0,0,0|2,0,0]=4 17307 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [0,2,0,0,0,0|2,0,0]=4 17308 B12R1.286 COc1cc(ccc1Br)OCF 34a_100011827694_100015361967 [0,2,0,0,0,0|2,0,0]=4 17309 B12R1.286 COc1cc(ccc1Br)OCF 7a_100011827694_100015361967 [0,2,0,0,0,0|2,0,0]=4 17310 B12R1.286 COc1cc(ccc1C)OCF 34a_100009865632_100015361967 [0,2,0,0,0,0|2,0,0]=4 17311 B12R1.286 COc1cc(ccc1C)OCF 7a_100009865632_100015361967 [0,2,0,0,0,0|2,0,0]=4 17312 B12R1.286 COc1cc(ccc1Cl)OCF 34a_100012186310_100015361967 [0,2,0,0,0,0|2,0,0]=4 17313 B12R1.286 COc1cc(ccc1Cl)OCF 7a_100012186310_100015361967 [0,2,0,0,0,0|2,0,0]=4 17314 B12R1.286 COc1cc(ccc1F)OCF 34a_100012001760_100015361967 [0,2,0,0,0,0|2,0,0]=4 17315 B12R1.286 COc1cc(ccc1F)OCF 7a_100012001760_100015361967 [0,2,0,0,0,0|2,0,0]=4 17316 B12R1.286 COc1cc(ccc1N)OCF 34a_100015326901_100015361967 [0,2,0,0,0,0|2,0,0]=4 17317 B12R1.286 COc1cc(ccc1N)OCF 7a_100015326901_100015361967 [0,2,0,0,0,0|2,0,0]=4 17318 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [0,2,0,0,0,0|2,0,0]=4 17319 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [0,2,0,0,0,0|2,0,0]=4 17320 B12R1.286 COc1cc(ccc1O)SCF 62a_100015361967_100000694246 [0,2,0,0,0,0|1,1,0]=4 17321 B12R1.286 CSCc1ccc(c(c1)C=O)O 62a_200000210301_100000008128 [0,2,0,0,0,0|2,0,0]=4 17322 B12R1.286 Cc1ccc(cc1CN)OCF 34a_200009844824_100015361967 [0,2,0,0,0,0|2,0,0]=4 17323 B12R1.286 Cc1ccc(cc1CO)OCF 34a_100009878257_100015361967 [0,2,0,0,0,0|2,0,0]=4 17324 B12R1.286 Cc1ccc(cc1CO)OCF 7a_100009878257_100015361967 [0,2,0,0,0,0|2,0,0]=4 17325 B12R1.286 N#Cc1cc(ccc1Br)OCF 34a_100009818209_100015361967 [0,2,0,0,0,0|2,0,0]=4 17326 B12R1.286 N#Cc1cc(ccc1Br)OCF 7a_100009818209_100015361967 [0,2,0,0,0,0|2,0,0]=4 17327 B12R1.286 N#Cc1cc(ccc1Cl)OCF 34a_100000092820_100015361967 [0,2,0,0,0,0|2,0,0]=4 17328 B12R1.286 N#Cc1cc(ccc1Cl)OCF 7a_100000092820_100015361967 [0,2,0,0,0,0|2,0,0]=4 17329 B12R1.286 N#Cc1cc(ccc1F)OCF 34a_100000070142_100015361967 [0,2,0,0,0,0|2,0,0]=4 17330 B12R1.286 N#Cc1cc(ccc1F)OCF 7a_100000070142_100015361967 [0,2,0,0,0,0|2,0,0]=4 17331 B12R1.286 N#Cc1cc(ccc1N)OCF 34a_200011997737_100015361967 [0,2,0,0,0,0|2,0,0]=4 17332 B12R1.286 N#Cc1cc(ccc1N)OCF 7a_200011997737_100015361967 [0,2,0,0,0,0|2,0,0]=4 17333 B12R1.286 N#Cc1cc(ccc1O)NCF 34a_100011249283_100015361967 [0,2,0,0,0,0|2,0,0]=4 17334 B12R1.286 N#Cc1cc(ccc1O)SCF 62a_100015361967_100000687585 [0,2,0,0,0,0|1,1,0]=4 17335 B12R1.286 NCc1cc(ccc1O)SCF 62a_100000730032_100015361967 [0,2,0,0,0,0|1,1,0]=4 17336 B12R1.286 NCc1cc(ccc1O)SCF 62a_100015361967_100000730032 [0,2,0,0,0,0|1,1,0]=4 17337 B12R1.286 O=Cc1cc(ccc1O)SCF 62a_100015361967_100000186750 [0,2,0,0,0,0|1,1,0]=4 17338 B12R1.286 OCc1cc(ccc1Br)OCF 34a_100012351483_100015361967 [0,2,0,0,0,0|2,0,0]=4 17339 B12R1.286 OCc1cc(ccc1Br)OCF 7a_100012351483_100015361967 [0,2,0,0,0,0|2,0,0]=4 17340 B12R1.286 OCc1cc(ccc1Cl)OCF 34a_100000091669_100015361967 [0,2,0,0,0,0|2,0,0]=4 17341 B12R1.286 OCc1cc(ccc1Cl)OCF 7a_100000091669_100015361967 [0,2,0,0,0,0|2,0,0]=4 17342 B12R1.286 OCc1cc(ccc1O)SCF 62a_100000184703_100015361967 [0,2,0,0,0,0|1,1,0]=4 17343 B12R1.286 OCc1cc(ccc1O)SCF 62a_100015361967_100000184703 [0,2,0,0,0,0|1,1,0]=4 17344 B12R1.286 [13CH3]SCc1ccc(c(c1)C=O)O 62a_200025704644_100000008128 [0,2,0,0,0,0|2,0,0]=4 17345 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [0,0,1,1,0,0|2,0,0]=4 17346 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [0,0,1,1,0,0|2,0,0]=4 17347 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [0,0,1,1,0,0|2,0,0]=4 17348 B10R1.30 CCc1cc(ccc1Br)O 271570a_203496583355_100010244631 [0,0,1,1,0,0|2,0,0]=4 17349 B10R1.30 CCc1cc(ccc1F)O 271570a_203496583355_100010244625 [0,0,1,1,0,0|2,0,0]=4 17350 B10R1.30 CCc1cc(ccc1N)O 271570a_203496583355_100000686106 [0,0,1,1,0,0|2,0,0]=4 17351 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [0,0,1,1,0,0|2,0,0]=4 17352 B10R1.30 CCn1cc(ccc1=O)O 271570a_203496583355_100000231005 [0,0,1,1,0,0|2,0,0]=4 17353 B10R2.31 Oc1ccc2c(c1)CC2 271570a_203496583355_100009818592 [1,0,0,1,0,0|0,0,0]=2 17354 B10R2.6 c1cc(ccn1)C2CC2 271570a_100011220607_100000035832 [1,0,0,1,0,0|2,0,0]=4 17355 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|1,0,0]=3 17356 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [1,0,0,1,0,0|2,0,0]=4 17357 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [1,0,0,1,0,0|2,0,0]=4 17358 B12R2.24 Oc1ccc2c(c1)CCCC2 271570a_203496583355_100011221367 [0,1,0,1,0,0|1,0,0]=3 17359 B12R2.24 Oc1ccc2c(c1)CCCN2 271570a_203496583355_100016994925 [0,1,0,1,0,0|1,0,0]=3 17360 B12R2.24 Oc1ccc2c(c1)CCCO2 271570a_203496583355_100011393166 [0,1,0,1,0,0|0,0,0]=2 17361 B12R2.24 Oc1ccc2c(c1)CCNC2 271570a_203496583355_100000686056 [0,1,0,1,0,0|1,0,0]=3 17362 B12R2.24 Oc1ccc2c(c1)CNCC2 271570a_203496583355_100015189961 [0,1,0,1,0,0|1,0,0]=3 17363 B12R2.24 Oc1ccc2c(c1)COCC2 271570a_203496583355_100010128096 [0,1,0,1,0,0|1,0,0]=3 17364 B12R2.24 Oc1ccc2c(c1)NCCC2 271570a_203496583355_100010196366 [0,1,0,1,0,0|1,0,0]=3 17365 B12R2.24 Oc1ccc2c(c1)NCCO2 271570a_203496583355_100000708519 [0,1,0,1,0,0|0,0,0]=2 17366 B12R2.24 Oc1ccc2c(c1)NCCS2 271570a_203496583355_100013243616 [0,1,0,1,0,0|0,1,0]=3 17367 B12R2.24 Oc1ccc2c(c1)OCCC2 271570a_203496583355_100010700467 [0,1,0,1,0,0|1,0,0]=3 17368 B12R2.24 Oc1ccc2c(c1)OCCN2 271570a_203496583355_100012355470 [0,1,0,1,0,0|1,0,0]=3 17369 B12R2.24 Oc1ccc2c(c1)OCCO2 271570a_203496583355_100000184379 [0,1,0,1,0,0|0,0,0]=2 17370 B12R2.24 Oc1ccc2c(n1)CCCC2 271570a_203496583355_100000046135 [0,1,0,1,0,0|2,0,0]=4 17371 B12R2.24 Oc1ccc2c(n1)CCCN2 271570a_203496583355_100010277722 [0,1,0,1,0,0|2,0,0]=4 17372 B12R2.24 Oc1ccc2c(n1)CCNC2 271570a_203496583355_100015190003 [0,1,0,1,0,0|2,0,0]=4 17373 B12R2.24 Oc1ccc2c(n1)NCCC2 271570a_203496583355_100009952728 [0,1,0,1,0,0|2,0,0]=4 17374 B12R2.24 Oc1ccc2c(n1)NCCO2 271570a_203496583355_100010209492 [0,1,0,1,0,0|1,0,0]=3 17375 B12R2.24 Oc1cnc2c(c1)CCCC2 271570a_203496583355_100010236098 [0,1,0,1,0,0|2,0,0]=4 17376 B12R2.24 Oc1cnc2c(c1)CCCO2 271570a_203496583355_100010109689 [0,1,0,1,0,0|1,0,0]=3 17377 B12R2.24 Oc1cnc2c(c1)NCCO2 271570a_203496583355_100000700286 [0,1,0,1,0,0|1,0,0]=3 17378 B12R2.24 Oc1cnc2c(c1)OCCN2 271570a_203496583355_100009816924 [0,1,0,1,0,0|2,0,0]=4 17379 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [0,1,0,1,0,0|1,0,0]=3 17380 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,1,0,1,0,0|1,0,1]=4 17381 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,1,0,1,0,0|0,0,1]=3 17382 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,1,0,1,0,0|0,1,1]=4 17383 B12R2.132 Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100102524909 [0,1,0,1,0,0|1,0,1]=4 17384 B12R2.132 Cc1noc2c1cc(cc2)O 271570a_203496583355_100010196875 [0,1,0,1,0,0|0,0,1]=3 17385 B12R2.132 Cn1ccc2c1cc(cc2)O 271570a_203496583355_100011934912 [0,1,0,1,0,0|1,0,1]=4 17386 B12R2.132 Cn1cnc2c1cc(cc2)O 271570a_203496583355_100000702186 [0,1,0,1,0,0|1,0,1]=4 17387 B12R2.132 Cn1ncc2c1cc(cc2)O 271570a_203496583355_100009817177 [0,1,0,1,0,0|2,0,0]=4 17388 B12R2.132 Cn1nnc2c1cc(cc2)O 271570a_203496583355_100010241234 [0,1,0,1,0,0|2,0,0]=4 17389 B12R2.132 NC1CCc2c1cc(cc2)O 271570a_203496583355_100011435097 [0,1,0,1,0,0|1,0,0]=3 17390 B12R2.132 Nc1noc2c1cc(cc2)O 271570a_203496583355_100012356444 [0,1,0,1,0,0|1,0,1]=4 17391 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,1,0,1,0,0|1,0,1]=4 17392 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,1,0,1,0,0|0,0,1]=3 17393 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,1,0,1,0,0|1,0,1]=4 17394 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,1,0,1,0,0|1,0,1]=4 17395 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [0,1,0,1,0,0|1,0,0]=3 17396 B12R2.294 Brc1ccc(cc1)NC2CC2 34a_100000210018_100000211595 [0,1,0,1,0,0|2,0,0]=4 17397 B12R2.294 Brc1ccc(cc1)OC2CC2 34a_100000185759_100000211595 [0,1,0,1,0,0|1,0,0]=3 17398 B12R2.294 Brc1ccc(cc1)SC2CC2 62a_100000752885_100000211595 [0,1,0,1,0,0|1,1,0]=4 17399 B12R2.294 Brc1ccc(cn1)OC2CC2 34a_100000685995_100000211595 [0,1,0,1,0,0|2,0,0]=4 17400 B12R2.294 Cc1ccc(cc1)NC2CC2 34a_100000124888_100000211595 [0,1,0,1,0,0|2,0,0]=4 17401 B12R2.294 Cc1ccc(cc1)OC2CC2 34a_100000210336_100000211595 [0,1,0,1,0,0|1,0,0]=3 17402 B12R2.294 Cc1ccc(cc1)SC2CC2 62a_100000186775_100000211595 [0,1,0,1,0,0|1,1,0]=4 17403 B12R2.294 Cc1ccc(cn1)OC2CC2 34a_100000745506_100000211595 [0,1,0,1,0,0|2,0,0]=4 17404 B12R2.294 Cc1ccc(nc1)OC2CC2 34a_100000759353_100000211595 [0,1,0,1,0,0|2,0,0]=4 17405 B12R2.294 Clc1ccc(cc1)NC2CC2 34a_100000210052_100000211595 [0,1,0,1,0,0|2,0,0]=4 17406 B12R2.294 Clc1ccc(cc1)OC2CC2 34a_100000210216_100000211595 [0,1,0,1,0,0|1,0,0]=3 17407 B12R2.294 Clc1ccc(cc1)SC2CC2 62a_100000755918_100000211595 [0,1,0,1,0,0|1,1,0]=4 17408 B12R2.294 Clc1ccc(cn1)OC2CC2 34a_100000744096_100000211595 [0,1,0,1,0,0|2,0,0]=4 17409 B12R2.294 Clc1ccc(nc1)OC2CC2 34a_100011215309_100000211595 [0,1,0,1,0,0|2,0,0]=4 17410 B12R2.294 Fc1ccc(cc1)NC2CC2 34a_100000185862_100000211595 [0,1,0,1,0,0|2,0,0]=4 17411 B12R2.294 Fc1ccc(cc1)OC2CC2 34a_100000210339_100000211595 [0,1,0,1,0,0|1,0,0]=3 17412 B12R2.294 Fc1ccc(cc1)SC2CC2 62a_100000211213_100000211595 [0,1,0,1,0,0|1,1,0]=4 17413 B12R2.294 Fc1ccc(cn1)OC2CC2 34a_100000688820_100000211595 [0,1,0,1,0,0|2,0,0]=4 17414 B12R2.294 Fc1ccc(nc1)OC2CC2 34a_100000742473_100000211595 [0,1,0,1,0,0|2,0,0]=4 17415 B12R2.294 Ic1ccc(cc1)NC2CC2 34a_100000185761_100000211595 [0,1,0,1,0,0|2,0,0]=4 17416 B12R2.294 Ic1ccc(cc1)OC2CC2 34a_100000212066_100000211595 [0,1,0,1,0,0|1,0,0]=3 17417 B12R2.294 Ic1ccc(cn1)OC2CC2 34a_100000687607_100000211595 [0,1,0,1,0,0|2,0,0]=4 17418 B12R2.294 Nc1ccc(cc1)OC2CC2 34a_100000185829_100000211595 [0,1,0,1,0,0|1,0,0]=3 17419 B12R2.294 Nc1ccc(cc1)SC2CC2 62a_100000185761_100000211595 [0,1,0,1,0,0|1,1,0]=4 17420 B12R2.294 Nc1ccc(cn1)OC2CC2 34a_100015188713_100000211595 [0,1,0,1,0,0|2,0,0]=4 17421 B12R2.294 Nc1ccc(nc1)OC2CC2 34a_100000729260_100000211595 [0,1,0,1,0,0|2,0,0]=4 17422 B12R2.294 O=c1ccc(c[nH]1)OC2CC2 34a_100000075641_100000211595 [0,1,0,1,0,0|1,0,1]=4 17423 B12R2.294 Oc1ccc(cc1)NC2CC2 34a_100000185829_100000211595 [0,1,0,1,0,0|1,0,0]=3 17424 B12R2.294 Oc1ccc(cc1)OC2CC2 271570a_203496583355_100000704264 [0,1,0,1,0,0|0,0,0]=2 17425 B12R2.294 Oc1ccc(nc1)NC2CC2 271570a_203496583355_100011242975 [0,1,0,1,0,0|2,0,0]=4 17426 B12R2.294 Oc1ccc(nc1)SC2CC2 62a_100000685995_100000211595 [0,1,0,1,0,0|1,1,0]=4 17427 B12R2.2302 Oc1ccc(cc1)C2CCC2 271570a_203496583355_200010114027 [0,1,0,1,0,0|1,0,0]=3 17428 B12R2.2302 Oc1ccc(cc1)C2COC2 271570a_203496583355_100010732642 [0,1,0,1,0,0|1,0,0]=3 17429 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 17430 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 17431 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 17432 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,1,0,1,0,0|1,0,1]=4 17433 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,1,0,1,0,0|0,1,1]=4 17434 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,1,0,1,0,0|1,0,1]=4 17435 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,1,0,1,0,0|1,0,1]=4 17436 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,1,0,1,0,0|0,0,1]=3 17437 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,1,0,1,0,0|0,1,1]=4 17438 B12R2.606 Cc1nc2cc(cnc2o1)O 271570a_203496583355_100010178690 [0,1,0,1,0,0|1,0,1]=4 17439 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,1,0,0|1,0,1]=4 17440 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,1,0,1,0,0|1,0,1]=4 17441 B12R2.606 Cn1cc2cc(ccc2n1)O 271570a_203496583355_100009817163 [0,1,0,1,0,0|2,0,0]=4 17442 B12R2.606 Cn1cc2ccc(cc2n1)O 271570a_203496583355_100009817169 [0,1,0,1,0,0|2,0,0]=4 17443 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [0,1,0,1,0,0|1,0,0]=3 17444 B12R2.606 Nc1nc2cc(ccc2o1)O 271570a_203496583355_100000737949 [0,1,0,1,0,0|1,0,1]=4 17445 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,1,0,0|1,0,1]=4 17446 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,1,0,0|1,0,1]=4 17447 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,1,0,1,0,0|1,0,1]=4 17448 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [0,1,0,1,0,0|1,0,0]=3 17449 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 17450 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 17451 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 17452 B12R2.290 NC1(CC1)c2ccc(cc2)O 271570a_203496583355_100000742681 [0,1,0,1,0,0|1,0,0]=3 17453 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [0,1,0,1,0,0|1,0,0]=3 17454 B12R2.612 CN1CCc2c1ncc(c2)O 271570a_203496583355_200010383199 [0,1,0,1,0,0|2,0,0]=4 17455 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [0,1,0,1,0,0|1,0,0]=3 17456 B12R2.612 NC1COc2c1ccc(c2)O 271570a_203496583355_100020628175 [0,1,0,1,0,0|2,0,0]=4 17457 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,1,0,0|1,0,0]=3 17458 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,1,0,0|2,0,0]=4 17459 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,1,0,0|2,0,0]=4 17460 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,1,0,0|2,0,0]=4 17461 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [0,1,0,1,0,0|1,0,0]=3 17462 B12R2.246 Cc1cc(cc2c1occ2)O 271570a_203496583355_100012361858 [0,1,0,1,0,0|0,0,2]=4 17463 B12R2.246 Oc1cc(c2occc2c1)F 271570a_203496583355_100012355474 [0,1,0,1,0,0|0,0,2]=4 17464 B12R2.246 Oc1cc(c2occc2c1)O 271570a_203496583355_200010248604 [0,1,0,1,0,0|0,0,2]=4 17465 B12R2.1317 Brc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011484698 [0,1,0,1,0,0|2,0,0]=4 17466 B12R2.1317 Cc1cc(ccc1C2CC2)Br 271570a_100011220607_100000701812 [0,1,0,1,0,0|2,0,0]=4 17467 B12R2.1317 Cc1cc(ccc1C2CC2)Cl 271570a_100011220607_100011219607 [0,1,0,1,0,0|2,0,0]=4 17468 B12R2.1317 Cc1cc(ccc1C2CC2)F 271570a_100011220607_100011205405 [0,1,0,1,0,0|2,0,0]=4 17469 B12R2.1317 Cc1cc(ccc1C2CC2)N 271570a_100011220607_100000210723 [0,1,0,1,0,0|2,0,0]=4 17470 B12R2.1317 Cc1cc(ccc1C2CC2)O 271570a_100011220607_100000729255 [0,1,0,1,0,0|1,0,0]=3 17471 B12R2.1317 Cc1cc(cnc1C2CC2)O 271570a_100011220607_100012000486 [0,1,0,1,0,0|2,0,0]=4 17472 B12R2.1317 Cc1cc(ncc1C2CC2)O 271570a_100011220607_100010114363 [0,1,0,1,0,0|2,0,0]=4 17473 B12R2.1317 Cc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100009813563 [0,1,0,1,0,0|2,0,0]=4 17474 B12R2.1317 Cc1ccc(c(c1)C)C2CC2 271570a_100011220607_100011217332 [0,1,0,1,0,0|2,0,0]=4 17475 B12R2.1317 Cc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100011263221 [0,1,0,1,0,0|2,0,0]=4 17476 B12R2.1317 Cc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011216119 [0,1,0,1,0,0|2,0,0]=4 17477 B12R2.1317 Cc1ccc(c(c1)N)C2CC2 271570a_100011220607_100011216686 [0,1,0,1,0,0|2,0,0]=4 17478 B12R2.1317 Cc1ccc(c(c1)O)C2CC2 271570a_100011220607_100012002257 [0,1,0,1,0,0|2,0,0]=4 17479 B12R2.1317 Cc1nc(ccc1C2CC2)O 271570a_100011220607_100000691680 [0,1,0,1,0,0|2,0,0]=4 17480 B12R2.1317 Clc1cc(ccc1C2CC2)Br 271570a_100011220607_100011216062 [0,1,0,1,0,0|2,0,0]=4 17481 B12R2.1317 Clc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011219703 [0,1,0,1,0,0|2,0,0]=4 17482 B12R2.1317 Clc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000699841 [0,1,0,1,0,0|2,0,0]=4 17483 B12R2.1317 Fc1cc(ccc1C2CC2)Br 271570a_100011220607_100009814013 [0,1,0,1,0,0|2,0,0]=4 17484 B12R2.1317 Fc1cc(ccc1C2CC2)Cl 271570a_100011220607_100011216042 [0,1,0,1,0,0|2,0,0]=4 17485 B12R2.1317 Fc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011217111 [0,1,0,1,0,0|2,0,0]=4 17486 B12R2.1317 Fc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000733362 [0,1,0,1,0,0|2,0,0]=4 17487 B12R2.1317 Fc1ccc(c(c1)F)C2CC2 271570a_100011220607_100000750030 [0,1,0,1,0,0|2,0,0]=4 17488 B12R2.1317 Nc1cc(ccc1C2CC2)Br 271570a_100011220607_100000743836 [0,1,0,1,0,0|2,0,0]=4 17489 B12R2.1317 Nc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000761886 [0,1,0,1,0,0|2,0,0]=4 17490 B12R2.1317 Nc1cc(ccc1C2CC2)F 271570a_100011220607_100011218093 [0,1,0,1,0,0|2,0,0]=4 17491 B12R2.1317 Nc1cc(ccc1C2CC2)O 271570a_100011220607_100011999798 [0,1,0,1,0,0|1,0,0]=3 17492 B12R2.1317 Nc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100000750458 [0,1,0,1,0,0|2,0,0]=4 17493 B12R2.1317 Nc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000761885 [0,1,0,1,0,0|2,0,0]=4 17494 B12R2.1317 Nc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011356925 [0,1,0,1,0,0|2,0,0]=4 17495 B12R2.1317 Nc1ccc(c(c1)N)C2CC2 271570a_100011220607_200012175722 [0,1,0,1,0,0|2,0,0]=4 17496 B12R2.1317 Oc1cc(ccc1C2CC2)Br 271570a_100011220607_100012344904 [0,1,0,1,0,0|2,0,0]=4 17497 B12R2.1317 Oc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000050036 [0,1,0,1,0,0|2,0,0]=4 17498 B12R2.1317 Oc1cc(ccc1C2CC2)F 271570a_100011220607_100000690578 [0,1,0,1,0,0|2,0,0]=4 17499 B12R2.1317 Oc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100000701344 [0,1,0,1,0,0|1,0,0]=3 17500 B12R2.1317 Oc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000047559 [0,1,0,1,0,0|1,0,0]=3 17501 B12R2.1317 Oc1ccc(c(c1)F)C2CC2 271570a_100011220607_100000755031 [0,1,0,1,0,0|1,0,0]=3 17502 B12R2.1317 Oc1ccc(c(c1)O)C2CC2 271570a_100011220607_100009813921 [0,1,0,1,0,0|1,0,0]=3 17503 B12R2.1317 Oc1ccc(c(n1)F)C2CC2 271570a_100011220607_100009879308 [0,1,0,1,0,0|2,0,0]=4 17504 B12R2.1317 Oc1cnc(c(c1)F)C2CC2 271570a_100011220607_100000063512 [0,1,0,1,0,0|2,0,0]=4 17505 B12R2.9 C=Cc1ccc(cc1)C2CC2 271570a_100011290941_100009820665 [0,1,0,1,0,0|2,0,0]=4 17506 B12R2.9 CCc1ccc(cc1)C2CC2 271570a_100011220607_100011215824 [0,1,0,1,0,0|2,0,0]=4 17507 B12R2.9 CNc1ccc(cc1)C2CC2 271570a_100011220607_100000219623 [0,1,0,1,0,0|2,0,0]=4 17508 B12R2.9 CNc1ccc(cc1)C2CC2 34a_100016991203_200000210301 [0,1,0,1,0,0|2,0,0]=4 17509 B12R2.9 COc1ccc(cc1)C2CC2 271570a_100011220607_100000171711 [0,1,0,1,0,0|1,0,0]=3 17510 B12R2.9 COc1ccc(cc1)C2CC2 34a_100011997980_200000210301 [0,1,0,1,0,0|1,0,0]=3 17511 B12R2.9 COc1ccc(cc1)C2CC2 7a_100011997980_200000210301 [0,1,0,1,0,0|1,0,0]=3 17512 B12R2.9 COc1ccc(cn1)C2CC2 271570a_100011220607_100000047065 [0,1,0,1,0,0|2,0,0]=4 17513 B12R2.9 COc1ccc(nc1)C2CC2 271570a_100011220607_100000755202 [0,1,0,1,0,0|2,0,0]=4 17514 B12R2.9 CSc1ccc(cc1)C2CC2 271570a_100011220607_100011263217 [0,1,0,1,0,0|1,1,0]=4 17515 B12R2.9 CSc1ccc(cc1)C2CC2 62a_200000210301_100009820665 [0,1,0,1,0,0|1,1,0]=4 17516 B12R2.9 FCc1ccc(cc1)C2CC2 271570a_100011220607_100010268989 [0,1,0,1,0,0|2,0,0]=4 17517 B12R2.9 N#Cc1ccc(cc1)C2CC2 271570a_100011220607_100000179745 [0,1,0,1,0,0|2,0,0]=4 17518 B12R2.9 NCc1ccc(cc1)C2CC2 271570a_100011220607_100016989417 [0,1,0,1,0,0|2,0,0]=4 17519 B12R2.9 NNc1ccc(cc1)C2CC2 271570a_100011220607_100016988836 [0,1,0,1,0,0|2,0,0]=4 17520 B12R2.9 O=Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186029 [0,1,0,1,0,0|1,0,1]=4 17521 B12R2.9 OCc1ccc(cc1)C2CC2 271570a_100011220607_100000690907 [0,1,0,1,0,0|1,0,0]=3 17522 B12R2.9 OCc1ccc(cn1)C2CC2 271570a_100011220607_100000754261 [0,1,0,1,0,0|2,0,0]=4 17523 B12R2.9 OCc1ccc(nc1)C2CC2 271570a_100011220607_100009816760 [0,1,0,1,0,0|2,0,0]=4 17524 B12R2.9 [13CH3]Nc1ccc(cc1)C2CC2 34a_100016991203_200025704644 [0,1,0,1,0,0|2,0,0]=4 17525 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 34a_100011997980_200025704644 [0,1,0,1,0,0|1,0,0]=3 17526 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 7a_100011997980_200025704644 [0,1,0,1,0,0|1,0,0]=3 17527 B12R2.9 [13CH3]Sc1ccc(cc1)C2CC2 62a_200025704644_100009820665 [0,1,0,1,0,0|1,1,0]=4 17528 B12R2.44 C=Cc1cc2c(cn1)OCC2 271570a_100011290941_102495363667 [0,1,0,1,0,0|2,0,0]=4 17529 B12R2.44 C=Cc1ccc2c(c1)CCC2 271570a_100011290941_100000745594 [0,1,0,1,0,0|2,0,0]=4 17530 B12R2.44 C=Cc1ccc2c(c1)CCN2 271570a_100011290941_100000026929 [0,1,0,1,0,0|2,0,0]=4 17531 B12R2.44 C=Cc1ccc2c(c1)CCO2 271570a_100011290941_100000729065 [0,1,0,1,0,0|1,0,0]=3 17532 B12R2.44 C=Cc1ccc2c(c1)OCO2 271570a_100011290941_100000688060 [0,1,0,1,0,0|2,0,0]=4 17533 B12R2.44 CNc1ccc2c(c1)CCC2 2230a_100000211504_200000210301 [0,1,0,1,0,0|2,0,0]=4 17534 B12R2.44 CNc1ccc2c(c1)CCC2 34a_100000211504_200000210301 [0,1,0,1,0,0|2,0,0]=4 17535 B12R2.44 CNc1ccc2c(c1)CCO2 2230a_100000736984_200000210301 [0,1,0,1,0,0|1,0,0]=3 17536 B12R2.44 CNc1ccc2c(c1)CCO2 34a_100000736984_200000210301 [0,1,0,1,0,0|1,0,0]=3 17537 B12R2.44 CNc1ccc2c(c1)OCO2 2230a_100000209953_200000210301 [0,1,0,1,0,0|2,0,0]=4 17538 B12R2.44 CNc1ccc2c(c1)OCO2 34a_100000209953_200000210301 [0,1,0,1,0,0|2,0,0]=4 17539 B12R2.44 COc1ccc2c(c1)CCC2 34a_100000209987_200000210301 [0,1,0,1,0,0|1,0,0]=3 17540 B12R2.44 COc1ccc2c(c1)CCC2 7a_100000209987_200000210301 [0,1,0,1,0,0|1,0,0]=3 17541 B12R2.44 COc1ccc2c(c1)CCN2 34a_100020636429_200000210301 [0,1,0,1,0,0|1,0,0]=3 17542 B12R2.44 COc1ccc2c(c1)CNC2 34a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 17543 B12R2.44 COc1ccc2c(c1)NCC2 34a_100020636427_200000210301 [0,1,0,1,0,0|2,0,0]=4 17544 B12R2.44 COc1ccc2c(c1)OCO2 34a_100000210298_200000210301 [0,1,0,1,0,0|1,0,0]=3 17545 B12R2.44 COc1ccc2occc2c1 34a_100000070125_200000210301 [0,1,0,1,0,0|0,0,2]=4 17546 B12R2.44 COc1ccc2occc2c1 7a_100000070125_200000210301 [0,1,0,1,0,0|0,0,2]=4 17547 B12R2.44 CSc1cc2c(cn1)OCC2 62a_102495363667_200000210301 [0,1,0,1,0,0|1,1,0]=4 17548 B12R2.44 CSc1cc2c(cn1)OCC2 62a_200000210301_102495363667 [0,1,0,1,0,0|1,1,0]=4 17549 B12R2.44 CSc1ccc2c(c1)CCC2 62a_100000745594_200000210301 [0,1,0,1,0,0|1,1,0]=4 17550 B12R2.44 CSc1ccc2c(c1)CCC2 62a_200000210301_100000745594 [0,1,0,1,0,0|1,1,0]=4 17551 B12R2.44 CSc1ccc2c(c1)CCN2 62a_100000691068_200000210301 [0,1,0,1,0,0|1,1,0]=4 17552 B12R2.44 CSc1ccc2c(c1)CCN2 62a_200000210301_100000691068 [0,1,0,1,0,0|1,1,0]=4 17553 B12R2.44 CSc1ccc2c(c1)CCO2 62a_100000729065_200000210301 [0,1,0,1,0,0|0,1,0]=3 17554 B12R2.44 CSc1ccc2c(c1)CCO2 62a_200000210301_100000729065 [0,1,0,1,0,0|0,1,0]=3 17555 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 2230a_100000211504_200025704644 [0,1,0,1,0,0|2,0,0]=4 17556 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 34a_100000211504_200025704644 [0,1,0,1,0,0|2,0,0]=4 17557 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 2230a_100000736984_200025704644 [0,1,0,1,0,0|1,0,0]=3 17558 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 34a_100000736984_200025704644 [0,1,0,1,0,0|1,0,0]=3 17559 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 2230a_100000209953_200025704644 [0,1,0,1,0,0|2,0,0]=4 17560 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 34a_100000209953_200025704644 [0,1,0,1,0,0|2,0,0]=4 17561 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 34a_100000209987_200025704644 [0,1,0,1,0,0|1,0,0]=3 17562 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 7a_100000209987_200025704644 [0,1,0,1,0,0|1,0,0]=3 17563 B12R2.44 [13CH3]Oc1ccc2c(c1)CCN2 34a_100020636429_200025704644 [0,1,0,1,0,0|1,0,0]=3 17564 B12R2.44 [13CH3]Oc1ccc2c(c1)CNC2 34a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 17565 B12R2.44 [13CH3]Oc1ccc2c(c1)NCC2 34a_100020636427_200025704644 [0,1,0,1,0,0|2,0,0]=4 17566 B12R2.44 [13CH3]Oc1ccc2c(c1)OCO2 34a_100000210298_200025704644 [0,1,0,1,0,0|1,0,0]=3 17567 B12R2.44 [13CH3]Oc1ccc2occc2c1 34a_100000070125_200025704644 [0,1,0,1,0,0|0,0,2]=4 17568 B12R2.44 [13CH3]Oc1ccc2occc2c1 7a_100000070125_200025704644 [0,1,0,1,0,0|0,0,2]=4 17569 B12R2.44 [13CH3]Sc1cc2c(cn1)OCC2 62a_102495363667_200025704644 [0,1,0,1,0,0|1,1,0]=4 17570 B12R2.44 [13CH3]Sc1cc2c(cn1)OCC2 62a_200025704644_102495363667 [0,1,0,1,0,0|1,1,0]=4 17571 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_100000745594_200025704644 [0,1,0,1,0,0|1,1,0]=4 17572 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_200025704644_100000745594 [0,1,0,1,0,0|1,1,0]=4 17573 B12R2.44 [13CH3]Sc1ccc2c(c1)CCN2 62a_100000691068_200025704644 [0,1,0,1,0,0|1,1,0]=4 17574 B12R2.44 [13CH3]Sc1ccc2c(c1)CCN2 62a_200025704644_100000691068 [0,1,0,1,0,0|1,1,0]=4 17575 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_100000729065_200025704644 [0,1,0,1,0,0|0,1,0]=3 17576 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_200025704644_100000729065 [0,1,0,1,0,0|0,1,0]=3 17577 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100000210202_100009818592 [0,1,0,1,0,0|1,1,0]=4 17578 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100009818592_100000210202 [0,1,0,1,0,0|1,1,0]=4 17579 B12R2.82 Cc1c(ccc2c1OCO2)O 271570a_203496583355_100010335860 [0,1,0,1,0,0|1,0,0]=3 17580 B12R2.82 Nc1c(ccc2c1CCC2)O 271570a_203496583355_202495424074 [0,1,0,1,0,0|1,0,0]=3 17581 B12R2.82 Oc1ccc2c(c1F)CCN2 271570a_203496583355_100011013764 [0,1,0,1,0,0|1,0,0]=3 17582 B12R2.82 Oc1ccc2c(c1F)OCO2 271570a_203496583355_100010223184 [0,1,0,1,0,0|1,0,0]=3 17583 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [0,1,0,1,0,0|1,0,0]=3 17584 B12R2.100 Nc1cc2c(cc1O)OCO2 271570a_203496583355_100012557033 [0,1,0,1,0,0|1,0,0]=3 17585 B12R2.100 Oc1cc2c(cc1F)NCC2 271570a_203496583355_100012771920 [0,1,0,1,0,0|1,0,0]=3 17586 B12R2.100 Oc1cc2c(cc1O)CCC2 271570a_203496583355_200010659162 [0,1,0,1,0,0|1,0,0]=3 17587 B12R2.100 Oc1cc2c(cc1O)OCO2 271570a_203496583355_100010290809 [0,1,0,1,0,0|1,0,0]=3 17588 B12R2.291 Brc1ccc(cc1Br)C2CC2 271570a_100011220607_100012356285 [0,1,0,1,0,0|2,0,0]=4 17589 B12R2.291 Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100009813585 [0,1,0,1,0,0|2,0,0]=4 17590 B12R2.291 Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100000049509 [0,1,0,1,0,0|2,0,0]=4 17591 B12R2.291 Cc1cc(ccc1F)C2CC2 271570a_100011220607_100011218330 [0,1,0,1,0,0|2,0,0]=4 17592 B12R2.291 Cc1cc(ccc1N)C2CC2 271570a_100011220607_100000211769 [0,1,0,1,0,0|2,0,0]=4 17593 B12R2.291 Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186361 [0,1,0,1,0,0|1,0,0]=3 17594 B12R2.291 Cc1cc(cnc1O)C2CC2 271570a_100011220607_100000685391 [0,1,0,1,0,0|2,0,0]=4 17595 B12R2.291 Cc1cc(ncc1O)C2CC2 271570a_100011220607_100000692680 [0,1,0,1,0,0|2,0,0]=4 17596 B12R2.291 Cc1ccc(cc1Br)C2CC2 271570a_100011220607_100011847877 [0,1,0,1,0,0|2,0,0]=4 17597 B12R2.291 Cc1ccc(cc1C)C2CC2 271570a_100011220607_100011215607 [0,1,0,1,0,0|2,0,0]=4 17598 B12R2.291 Cc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011216363 [0,1,0,1,0,0|2,0,0]=4 17599 B12R2.291 Cc1ccc(cc1F)C2CC2 271570a_100011220607_100000720648 [0,1,0,1,0,0|2,0,0]=4 17600 B12R2.291 Cc1ccc(cc1N)C2CC2 271570a_100011220607_100000761890 [0,1,0,1,0,0|2,0,0]=4 17601 B12R2.291 Cc1ccc(cc1O)C2CC2 271570a_100011220607_100000766334 [0,1,0,1,0,0|2,0,0]=4 17602 B12R2.291 Cc1nc(ccc1O)C2CC2 271570a_100011220607_100010233687 [0,1,0,1,0,0|2,0,0]=4 17603 B12R2.291 Clc1cc(ccc1Br)C2CC2 271570a_100011220607_100012047281 [0,1,0,1,0,0|2,0,0]=4 17604 B12R2.291 Clc1ccc(cc1Br)C2CC2 271570a_100011220607_100012353702 [0,1,0,1,0,0|2,0,0]=4 17605 B12R2.291 Clc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011214914 [0,1,0,1,0,0|2,0,0]=4 17606 B12R2.291 Fc1cc(ccc1Br)C2CC2 271570a_100011220607_100000685389 [0,1,0,1,0,0|2,0,0]=4 17607 B12R2.291 Fc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011216805 [0,1,0,1,0,0|2,0,0]=4 17608 B12R2.291 Fc1ccc(cc1Br)C2CC2 271570a_100011220607_100012047266 [0,1,0,1,0,0|2,0,0]=4 17609 B12R2.291 Fc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011215976 [0,1,0,1,0,0|2,0,0]=4 17610 B12R2.291 Fc1ccc(cc1F)C2CC2 271570a_100011220607_100000750028 [0,1,0,1,0,0|2,0,0]=4 17611 B12R2.291 Nc1cc(ccc1Br)C2CC2 271570a_100011220607_100000750456 [0,1,0,1,0,0|2,0,0]=4 17612 B12R2.291 Nc1cc(ccc1Cl)C2CC2 271570a_100011220607_200000761891 [0,1,0,1,0,0|2,0,0]=4 17613 B12R2.291 Nc1cc(ccc1F)C2CC2 271570a_100011220607_100000740924 [0,1,0,1,0,0|2,0,0]=4 17614 B12R2.291 Nc1cc(ccc1O)C2CC2 271570a_100011220607_100000752626 [0,1,0,1,0,0|1,0,0]=3 17615 B12R2.291 Nc1cc(cnc1O)C2CC2 271570a_100011220607_100000743729 [0,1,0,1,0,0|2,0,0]=4 17616 B12R2.291 Nc1cc(ncc1O)C2CC2 271570a_100011220607_100009819941 [0,1,0,1,0,0|2,0,0]=4 17617 B12R2.291 Nc1ccc(cc1Br)C2CC2 271570a_100011220607_100000750455 [0,1,0,1,0,0|2,0,0]=4 17618 B12R2.291 Nc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011218065 [0,1,0,1,0,0|2,0,0]=4 17619 B12R2.291 Nc1ccc(cc1F)C2CC2 271570a_100011220607_100011215594 [0,1,0,1,0,0|2,0,0]=4 17620 B12R2.291 Nc1ccc(cc1N)C2CC2 271570a_100011220607_100000741789 [0,1,0,1,0,0|2,0,0]=4 17621 B12R2.291 Nc1ccc(cc1O)C2CC2 271570a_100011220607_100000739049 [0,1,0,1,0,0|2,0,0]=4 17622 B12R2.291 Nc1nc(ccc1O)C2CC2 271570a_100011220607_100000685527 [0,1,0,1,0,0|2,0,0]=4 17623 B12R2.291 Oc1cc(ccc1Br)C2CC2 271570a_100011220607_100012356990 [0,1,0,1,0,0|2,0,0]=4 17624 B12R2.291 Oc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356854 [0,1,0,1,0,0|2,0,0]=4 17625 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_100011220607_100000686035 [0,1,0,1,0,0|2,0,0]=4 17626 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_203496583355_100010281199 [0,1,0,1,0,0|2,0,0]=4 17627 B12R2.291 Oc1ccc(cc1Br)C2CC2 271570a_100011220607_100012361655 [0,1,0,1,0,0|1,0,0]=3 17628 B12R2.291 Oc1ccc(cc1Cl)C2CC2 271570a_100011220607_100012360047 [0,1,0,1,0,0|1,0,0]=3 17629 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_100011220607_100000185481 [0,1,0,1,0,0|1,0,0]=3 17630 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_203496583355_100010281179 [0,1,0,1,0,0|1,0,0]=3 17631 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_100011220607_100009813601 [0,1,0,1,0,0|1,0,0]=3 17632 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_203496583355_100135415898 [0,1,0,1,0,0|1,0,0]=3 17633 B12R2.291 Oc1ccc(nc1Br)C2CC2 271570a_100011220607_100000725334 [0,1,0,1,0,0|2,0,0]=4 17634 B12R2.291 Oc1ccc(nc1Cl)C2CC2 271570a_100011220607_100000721234 [0,1,0,1,0,0|2,0,0]=4 17635 B12R2.291 Oc1ccc(nc1F)C2CC2 271570a_100011220607_100009819667 [0,1,0,1,0,0|2,0,0]=4 17636 B12R2.291 Oc1ncc(cc1Cl)C2CC2 271570a_100011220607_100010238531 [0,1,0,1,0,0|2,0,0]=4 17637 B8R1.1 CCc1cc(cs1)O 271570a_203496583355_100009846239 [1,0,0,0,1,0|1,0,0]=3 17638 B8R1.1 CCc1ccc(s1)O 271570a_203496583355_100009844052 [1,0,0,0,1,0|1,0,0]=3 17639 B8R1.1 CCn1cc(cn1)O 271570a_203496583355_100011400201 [1,0,0,0,1,0|2,0,0]=4 17640 B8R1.1 CCn1ccc(n1)O 271570a_203496583355_100012350556 [1,0,0,0,1,0|2,0,0]=4 17641 B8R1.1 CCn1cnc(c1)O 271570a_203496583355_100010368372 [1,0,0,0,1,0|2,0,0]=4 17642 B8R1.1 COc1nc(cs1)O 271570a_203496583355_100000727839 [1,0,0,0,1,0|2,0,0]=4 17643 B8R1.1 COc1ncc(s1)O 271570a_203496583355_100000729428 [1,0,0,0,1,0|2,0,0]=4 17644 B8R1.1 CSc1cc(cs1)O 271570a_203496583355_200010256830 [1,0,0,0,1,0|1,1,0]=4 17645 B8R1.1 NCc1ccc(o1)O 271570a_203496583355_100000708654 [1,0,0,0,1,0|2,0,0]=4 17646 B8R1.1 NCc1ccc(s1)O 271570a_203496583355_100000737305 [1,0,0,0,1,0|2,0,0]=4 17647 B8R1.1 OCc1cc(cs1)O 271570a_203496583355_100000238369 [1,0,0,0,1,0|2,0,0]=4 17648 B8R1.1 OCc1ccc(o1)O 271570a_203496583355_100000246276 [1,0,0,0,1,0|2,0,0]=4 17649 B8R1.1 OCc1ccc(s1)O 271570a_203496583355_100000246291 [1,0,0,0,1,0|2,0,0]=4 17650 B8R1.8 CCOc1ccsc1 34a_100000106738_100000210202 [1,0,0,0,1,0|1,0,0]=3 17651 B8R1.8 CCOc1ccsc1 7a_100000106738_100000210202 [1,0,0,0,1,0|1,0,0]=3 17652 B8R1.8 CCSc1ccco1 62a_100000210202_100009814098 [1,0,0,0,1,0|1,1,0]=4 17653 B8R1.8 CCSc1ccco1 62a_100009814098_100000210202 [1,0,0,0,1,0|1,1,0]=4 17654 B8R1.8 CCSc1cccs1 62a_100000210202_100011215356 [1,0,0,0,1,0|1,1,0]=4 17655 B8R1.8 CCSc1cccs1 62a_100011215356_100000210202 [1,0,0,0,1,0|1,1,0]=4 17656 B8R1.8 CCSc1ccoc1 62a_100000210202_100011215275 [1,0,0,0,1,0|1,1,0]=4 17657 B8R1.8 CCSc1ccoc1 62a_100011215275_100000210202 [1,0,0,0,1,0|1,1,0]=4 17658 B8R1.8 CCSc1ccsc1 62a_100000210202_100000738268 [1,0,0,0,1,0|1,1,0]=4 17659 B8R1.8 CCSc1ccsc1 62a_100000738268_100000210202 [1,0,0,0,1,0|1,1,0]=4 17660 B8R1.8 FCOc1ccsc1 34a_100000106738_100015361967 [1,0,0,0,1,0|2,0,0]=4 17661 B8R1.8 FCOc1ccsc1 7a_100000106738_100015361967 [1,0,0,0,1,0|2,0,0]=4