0 B8R1.5 Cc1c(cccn1)N CM14488 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.5 Cc1cccnc1Cl CM13849 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.5 c1c(c(ncn1)N)Br CM10426 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.5 c1c(c(ncn1)N)N CM14060 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.5 c1cc(c(nc1)N)N CM14021 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.5 c1cc(c(nc1)O)F CM10987 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.5 c1ccc(c(c1)F)Cl CM12138 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.5 c1ccc(c(c1)I)I CM12234 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.5 c1ccc(c(c1)N)Br CM11265 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.5 c1ccc(c(c1)N)I CM11493 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.5 c1cnc(c(n1)N)Br CM10652 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.5 c1cnc(c(n1)N)O CM10654 [0,0,0,0,0,0|2,0,0]=2 12 B7R1.3 c1c(cncn1)Br CM14047 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.3 c1cc(cnc1)F CM13853 [1,0,0,0,0,0|2,0,0]=3 14 B7R1.3 c1ccnc(c1)Cl CM13847 [1,0,0,0,0,0|2,0,0]=3 15 B7R1.3 c1cnc(nc1)Br CM14046 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.3 c1cnc(nc1)Cl CM14045 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.3 c1cnc(nc1)I CM14295 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.3 c1cncnc1N CM10689 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.3 Cc1c(cccc1Br)F CM13926 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.3 Cc1c(cccc1Br)N CM11317 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.3 Cc1c(cccc1Cl)N CM11377 [0,1,0,0,0,0|3,0,0]=4 22 B9R1.3 Cc1c(cccc1F)F CM13956 [0,1,0,0,0,0|3,0,0]=4 23 B9R1.3 Cc1c(cccc1F)N CM11464 [0,1,0,0,0,0|3,0,0]=4 24 B9R1.3 Cc1c(cccc1F)O CM11760 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.3 Cc1c(cccc1I)Cl CM13945 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.3 Cc1c(ccnc1Cl)I CM10087 [0,1,0,0,0,0|2,0,0]=3 27 B9R1.3 Cc1cccc(c1Br)Cl CM10337 [0,1,0,0,0,0|3,0,0]=4 28 B9R1.3 Cc1cccc(c1Br)N CM11315 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.3 Cc1cccc(c1C)Br CM12245 [0,1,0,0,0,0|2,0,0]=3 30 B9R1.3 Cc1cccc(c1C)Cl CM12248 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.3 Cc1cccc(c1C)F CM12253 [0,1,0,0,0,0|2,0,0]=3 32 B9R1.3 Cc1cccc(c1Cl)C CM12250 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.3 Cc1cccc(c1F)Br CM13927 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.3 Cc1cccc(c1F)C CM12254 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.3 Cc1cccc(c1F)Cl CM14017 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.3 Cc1cccc(c1F)F CM13954 [0,1,0,0,0,0|3,0,0]=4 37 B9R1.3 Cc1cccc(c1F)N CM11462 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.3 Cc1cccc(c1F)O CM11757 [0,1,0,0,0,0|3,0,0]=4 39 B9R1.3 Cc1cccc(c1I)O CM10210 [0,1,0,0,0,0|3,0,0]=4 40 B9R1.3 Cc1cccc(c1N)Br CM11316 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.3 Cc1cccc(c1N)N CM13949 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.3 Cc1cccc(c1N)O CM11590 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.3 Cc1cccc(c1O)C CM11741 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.3 Cc1cccc(c1O)F CM11759 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.3 Cc1ccnc(c1Br)C CM10661 [0,1,0,0,0,0|2,0,0]=3 46 B9R1.3 c1cnc(c(c1I)Cl)Cl CM10667 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.3 c1cnc(c(c1I)F)F CM10666 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.15 CCc1c(cccn1)Br CM10670 [0,1,0,0,0,0|2,0,0]=3 49 B9R1.15 COc1c(nccn1)N CM10653 [0,1,0,0,0,0|1,0,0]=2 50 B9R1.15 COc1cccnc1Br CM14120 [0,1,0,0,0,0|2,0,0]=3 51 B9R1.15 COc1cccnc1N CM10903 [0,1,0,0,0,0|2,0,0]=3 52 B9R1.15 CSc1ccccc1I CM11822 [0,1,0,0,0,0|3,0,0]=4 53 B9R1.15 c1ccc(c(c1)CBr)Cl CM13308 [0,1,0,0,0,0|3,0,0]=4 54 B9R1.15 c1ccc(c(c1)CCl)F CM13406 [0,1,0,0,0,0|3,0,0]=4 55 B9R1.15 c1ccc(c(c1)CN)F CM13538 [0,1,0,0,0,0|3,0,0]=4 56 B9R1.69 Cc1c(cc(cn1)Br)Cl CM10568 [0,1,0,0,0,0|2,0,0]=3 57 B9R1.69 Cc1c(ccc(n1)N)Br CM10976 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.69 Cc1c(cnc(n1)Br)Br CM10497 [0,1,0,0,0,0|3,0,0]=4 59 B9R1.69 Cc1cc(c(nc1)F)I CM10099 [0,1,0,0,0,0|3,0,0]=4 60 B9R1.69 Cc1cc(ccc1Br)Br CM13950 [0,1,0,0,0,0|3,0,0]=4 61 B9R1.69 Cc1cc(ccc1Br)I CM13933 [0,1,0,0,0,0|3,0,0]=4 62 B9R1.69 Cc1cc(ccc1Cl)I CM13944 [0,1,0,0,0,0|3,0,0]=4 63 B9R1.69 Cc1cc(ccc1F)N CM11467 [0,1,0,0,0,0|3,0,0]=4 64 B9R1.69 Cc1cc(ccc1F)O CM11763 [0,1,0,0,0,0|3,0,0]=4 65 B9R1.69 Cc1cc(ccc1N)Br CM11319 [0,1,0,0,0,0|3,0,0]=4 66 B9R1.69 Cc1cc(ccc1O)F CM11762 [0,1,0,0,0,0|3,0,0]=4 67 B9R1.69 Cc1cc(cnc1N)Br CM10974 [0,1,0,0,0,0|2,0,0]=3 68 B9R1.69 Cc1ccc(c(c1)Br)C CM12247 [0,1,0,0,0,0|3,0,0]=4 69 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [0,1,0,0,0,0|3,0,0]=4 70 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [0,1,0,0,0,0|3,0,0]=4 71 B9R1.69 Cc1ccc(cc1Br)N CM11318 [0,1,0,0,0,0|3,0,0]=4 72 B9R1.69 Cc1ccc(cc1Br)O CM10192 [0,1,0,0,0,0|3,0,0]=4 73 B9R1.69 Cc1ccc(cc1C)Cl CM12251 [0,1,0,0,0,0|2,0,0]=3 74 B9R1.69 Cc1ccc(cc1C)F CM12256 [0,1,0,0,0,0|2,0,0]=3 75 B9R1.69 Cc1ccc(cc1Cl)F CM13940 [0,1,0,0,0,0|3,0,0]=4 76 B9R1.69 Cc1ccc(cc1F)Br CM13928 [0,1,0,0,0,0|3,0,0]=4 77 B9R1.69 Cc1ccc(cc1F)Cl CM13941 [0,1,0,0,0,0|3,0,0]=4 78 B9R1.69 Cc1ccc(cc1F)F CM13955 [0,1,0,0,0,0|3,0,0]=4 79 B9R1.69 Cc1ccc(cc1F)I CM13959 [0,1,0,0,0,0|3,0,0]=4 80 B9R1.69 Cc1ccc(cc1F)N CM11465 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.69 Cc1ccc(cc1N)O CM11593 [0,1,0,0,0,0|3,0,0]=4 82 B9R1.69 Cc1ccc(cc1O)F CM11764 [0,1,0,0,0,0|3,0,0]=4 83 B9R1.69 Cc1ccc(cc1O)N CM11597 [0,1,0,0,0,0|3,0,0]=4 84 B9R1.69 Cc1ccc(cc1O)O CM10187 [0,1,0,0,0,0|3,0,0]=4 85 B9R1.69 Cc1cnc(c(n1)Cl)C CM11071 [0,1,0,0,0,0|1,0,0]=2 86 B9R1.69 Cc1cnc(c(n1)N)C CM11070 [0,1,0,0,0,0|1,0,0]=2 87 B9R1.69 c1c(cnc(c1Br)Cl)Cl CM14040 [0,1,0,0,0,0|3,0,0]=4 88 B9R1.69 c1c(cnc(c1Cl)Br)N CM10914 [0,1,0,0,0,0|3,0,0]=4 89 B9R1.69 c1c(cnc(c1Cl)Br)O CM10915 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.69 c1c(cnc(c1Cl)Cl)I CM10911 [0,1,0,0,0,0|3,0,0]=4 91 B9R1.69 c1c(cnc(c1F)Br)Cl CM10984 [0,1,0,0,0,0|3,0,0]=4 92 B9R1.69 c1c(cnc(c1F)Cl)Br CM10994 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.69 c1c(cnc(c1F)N)Cl CM10993 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.69 c1c(cnc(c1N)N)Br CM13844 [0,1,0,0,0,0|3,0,0]=4 95 B9R1.69 c1c(nc(c(n1)Br)Cl)N CM10655 [0,1,0,0,0,0|2,0,0]=3 96 B9R1.69 c1c(nc(c(n1)Br)N)Cl CM10429 [0,1,0,0,0,0|2,0,0]=3 97 B7R1.4 Cc1cscc1Br CM10703 [0,0,0,0,1,0|3,0,0]=4 98 B7R1.4 Cn1c(cnn1)I CM10199 [0,0,0,0,1,0|3,0,0]=4 99 B7R1.4 Cn1ccnc1Br CM10422 [0,0,0,0,1,0|2,0,0]=3 100 B7R1.4 Cn1ccnc1I CM10200 [0,0,0,0,1,0|2,0,0]=3 101 B7R1.4 c1csc(c1Br)Cl CM10917 [0,0,0,0,1,0|3,0,0]=4 102 B8R1.2 COc1cccnc1 CM10357 [1,1,0,0,0,0|1,0,0]=3 103 B8R1.3 Cc1ccc(=O)[nH]n1 CM11032 [1,1,0,0,0,0|2,0,0]=4 104 B8R1.3 Cc1ccc(cn1)N CM14483 [1,1,0,0,0,0|1,0,0]=3 105 B8R1.3 Cc1ccc(nn1)Br CM11114 [1,1,0,0,0,0|2,0,0]=4 106 B8R1.3 Cc1ncc(cn1)Br CM10466 [1,1,0,0,0,0|2,0,0]=4 107 B8R1.3 c1c(ncc(n1)Br)F CM10435 [1,1,0,0,0,0|1,0,0]=3 108 B8R1.3 c1c(ncc(n1)Cl)Cl CM10433 [1,1,0,0,0,0|1,0,0]=3 109 B8R1.3 c1cc(ncc1Br)Br CM14111 [1,1,0,0,0,0|2,0,0]=4 110 B8R1.3 c1cc(ncc1Br)F CM14457 [1,1,0,0,0,0|2,0,0]=4 111 B8R1.3 c1cc(ncc1F)Br CM14029 [1,1,0,0,0,0|2,0,0]=4 112 B8R1.3 c1cc(ncc1N)Cl CM13842 [1,1,0,0,0,0|2,0,0]=4 113 B8R1.4 Cc1cccc(n1)Br CM14044 [1,1,0,0,0,0|1,0,0]=3 114 B8R1.4 Cc1ccnc(n1)Cl CM13850 [1,1,0,0,0,0|2,0,0]=4 115 B8R1.4 c1c(cncc1Br)F CM14471 [1,1,0,0,0,0|2,0,0]=4 116 B8R1.4 c1c(cncc1Br)N CM14469 [1,1,0,0,0,0|2,0,0]=4 117 B8R1.4 c1c(cncc1Br)O CM14470 [1,1,0,0,0,0|2,0,0]=4 118 B8R1.4 c1c(cncc1Cl)O CM10662 [1,1,0,0,0,0|2,0,0]=4 119 B8R1.4 c1c(cncc1F)O CM10665 [1,1,0,0,0,0|2,0,0]=4 120 B8R1.4 c1c(cncc1O)O CM10452 [1,1,0,0,0,0|2,0,0]=4 121 B8R1.4 c1cc(nc(c1)Br)O CM10270 [1,1,0,0,0,0|2,0,0]=4 122 B8R1.4 c1cnc(cc1Br)N CM14041 [1,1,0,0,0,0|2,0,0]=4 123 B8R1.4 c1cnc(cc1Cl)Cl CM14034 [1,1,0,0,0,0|2,0,0]=4 124 B8R1.4 c1cnc(cc1I)Cl CM14039 [1,1,0,0,0,0|2,0,0]=4 125 B8R1.4 c1cnc(cc1I)O CM10195 [1,1,0,0,0,0|2,0,0]=4 126 B8R1.4 c1cnc(cc1O)Br CM10678 [1,1,0,0,0,0|2,0,0]=4 127 B8R1.11 c1csc(c1CO)Br CM10090 [0,1,0,0,1,0|2,0,0]=4 128 B10R1.2 Cc1c(cccc1Cl)SC CM10023 [0,2,0,0,0,0|2,0,0]=4 129 B10R1.2 Cc1c(cccc1OC)N CM11591 [0,2,0,0,0,0|2,0,0]=4 130 B10R1.2 Cc1c(ccnc1C=O)Br CM10400 [0,2,0,0,0,0|1,0,1]=4 131 B10R1.2 Cc1cccc(c1C)CBr CM13401 [0,2,0,0,0,0|2,0,0]=4 132 B10R1.2 Cc1cccc(c1C)OC CM11740 [0,2,0,0,0,0|2,0,0]=4 133 B10R1.119 Cc1c([n+](ccc1Br)[O-])C CM10391 [0,2,0,0,0,0|1,0,1]=4 134 B10R1.119 Cc1c(c(ccc1F)Br)C CM12078 [0,2,0,0,0,0|2,0,0]=4 135 B10R1.119 Cc1c(c(ccc1N)F)C CM11441 [0,2,0,0,0,0|2,0,0]=4 136 B10R1.119 Cc1c(c(ccc1O)F)C CM11743 [0,2,0,0,0,0|2,0,0]=4 137 B10R1.20 CNc1c(cccn1)CO CM14403 [0,2,0,0,0,0|1,0,0]=3 138 B10R1.20 COc1ccccc1CCl CM13440 [0,2,0,0,0,0|2,0,0]=4 139 B10R1.20 COc1cccnc1C#N CM14023 [0,2,0,0,0,0|1,0,1]=4 140 B10R1.20 c1ccc(c(c1)CO)CO CM13268 [0,2,0,0,0,0|2,0,0]=4 141 B10R1.25 COc1c(cc(cn1)Br)Br CM10171 [0,2,0,0,0,0|2,0,0]=4 142 B10R1.25 COc1c(cc(cn1)Br)F CM10081 [0,2,0,0,0,0|2,0,0]=4 143 B10R1.25 Cc1cc(ccc1CN)Br CM10182 [0,2,0,0,0,0|2,0,0]=4 144 B10R1.25 Cc1cc(ccc1CN)O CM10123 [0,2,0,0,0,0|2,0,0]=4 145 B10R1.25 Cc1cc(ccc1CO)Br CM13303 [0,2,0,0,0,0|2,0,0]=4 146 B10R1.25 Cc1cc(ccc1OC)N CM11595 [0,2,0,0,0,0|2,0,0]=4 147 B10R1.30 COc1c(ccc(n1)Br)N CM10431 [0,2,0,0,0,0|2,0,0]=4 148 B10R1.30 COc1c(ncc(n1)Br)Br CM10345 [0,2,0,0,0,0|1,0,0]=3 149 B10R1.30 COc1c(ncc(n1)Br)N CM10344 [0,2,0,0,0,0|1,0,0]=3 150 B10R1.30 COc1cc(cnc1Br)I CM10904 [0,2,0,0,0,0|2,0,0]=4 151 B10R1.30 COc1cc(cnc1I)I CM10902 [0,2,0,0,0,0|2,0,0]=4 152 B10R1.30 Cc1ccc(cc1CBr)F CM13415 [0,2,0,0,0,0|2,0,0]=4 153 B10R1.61 Cc1c(cccn1)[N+](=O)[O-] CM14024 [0,2,0,0,0,0|2,0,0]=4 154 B10R1.118 Cc1c(cc(c(n1)N)Br)Br CM10971 [0,2,0,0,0,0|2,0,0]=4 155 B10R1.118 Cc1cc(c(cc1C)Cl)N CM11354 [0,2,0,0,0,0|2,0,0]=4 156 B10R1.118 Cc1cc(c(cc1C)F)C CM12329 [0,2,0,0,0,0|2,0,0]=4 157 B10R1.118 Cc1cc(c(cc1C)N)N CM12163 [0,2,0,0,0,0|2,0,0]=4 158 B10R1.176 Cc1cc(cnc1N)C#N CM10975 [0,2,0,0,0,0|2,0,0]=4 159 B10R1.176 Cc1cc(cnc1O)C=O CM10161 [0,2,0,0,0,0|2,0,0]=4 160 B10R1.176 Cc1ccc(cc1C)C=O CM11941 [0,2,0,0,0,0|2,0,0]=4 161 B10R2.7 c1ccc2c(c1)CNC2 CM10320 [0,1,0,1,0,0|2,0,0]=4 162 B6R1.2 Cc1cc[nH]n1 CM14373 [1,0,0,0,1,0|1,0,0]=3 163 B6R1.2 Cn1cnnc1 CM10040 [1,0,0,0,1,0|2,0,0]=4 164 B6R1.2 c1c(cn[nH]1)Br CM10025 [1,0,0,0,1,0|2,0,0]=4 165 B6R1.2 c1c(nc[nH]1)Br CM14070 [1,0,0,0,1,0|1,0,1]=4 166 B6R1.2 c1c(ncs1)Br CM10700 [1,0,0,0,1,0|2,0,0]=4 167 B6R1.2 c1c(scn1)Br CM10418 [1,0,0,0,1,0|2,0,0]=4 168 B6R1.2 c1c(scn1)I CM10701 [1,0,0,0,1,0|2,0,0]=4 169 B6R1.2 c1conc1N CM10019 [1,0,0,0,1,0|2,0,0]=4