0 B9R1.6 CN(C)c1cncnc1 CM10165 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 c1cc(c[nH+]c1)C(=N)N CM13840 [0,0,0,0,0,0|1,0,1]=2 2 B9R1.6 c1ccnc(c1)C(=N)N CM13839 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 c1cncnc1C(=O)O CM10263 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.2 COc1cccnc1 CM10357 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [0,1,0,0,0,0|3,0,0]=4 6 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [0,1,0,0,0,0|2,0,0]=3 7 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [0,1,0,0,0,0|2,0,0]=3 8 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [0,1,0,0,0,0|1,0,0]=2 10 B10R1.13 CC(c1ccc(cc1)Cl)N CM13559 [0,1,0,0,0,0|2,0,1]=4 11 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [0,1,0,0,0,0|1,0,0]=2 13 B10R1.13 c1c(cnc(n1)Cl)C(=O)O CM14062 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.13 c1c(cnc(n1)N)[N+](=O)[O-] CM14370 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.13 c1cc(ccc1C(=O)Cl)Br CM12451 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.13 c1cc(ccc1C(=O)Cl)F CM12712 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.13 c1cc(ccc1C(=O)Cl)I CM12820 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.13 c1cc(ccc1C(=O)N)F CM13176 [0,1,0,0,0,0|1,0,0]=2 19 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.13 c1cc(ccc1[N+](=O)[O-])Br CM12110 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.13 c1cc(ccc1[N+](=O)[O-])F CM12273 [0,1,0,0,0,0|3,0,0]=4 23 B10R1.13 c1cc(ncc1C(=O)O)N CM10961 [0,1,0,0,0,0|1,0,0]=2 24 B10R1.13 c1cc(ncc1F)C(=O)O CM14030 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.13 c1cc(ncc1I)C(=O)O CM10490 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.13 c1cc(ncc1[N+](=O)[O-])Cl CM13851 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.15 COC(=O)c1cccnc1 CM10959 [0,1,0,0,0,0|1,0,0]=2 28 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.15 c1ccc(cc1)C(C#N)N CM11081 [0,1,0,0,0,0|2,0,1]=4 30 B10R1.61 CC(=O)c1ccccc1Br CM11134 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.61 CC(=O)c1ccccc1I CM11218 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.61 Cc1c(cccn1)[N+](=O)[O-] CM14024 [0,1,0,0,0,0|2,0,0]=3 33 B10R1.61 c1ccc(c(c1)C(=O)N)I CM13180 [0,1,0,0,0,0|1,0,0]=2 34 B10R1.61 c1ccc(c(c1)C(=O)O)F CM12709 [0,1,0,0,0,0|2,0,0]=3 35 B10R1.61 c1ccc(c(c1)C(=O)O)I CM12818 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F CM12272 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.61 c1cncc(c1Br)C(=O)O CM14036 [0,1,0,0,0,0|1,0,0]=2 38 B10R1.113 CC(=O)c1cc(ccn1)Cl CM10835 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.113 CC(=O)c1cccc(c1)F CM11197 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.113 CC(=O)c1cccc(c1)I CM11219 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.113 CC(c1cccc(c1)F)N CM13557 [0,1,0,0,0,0|2,0,1]=4 42 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [0,1,0,0,0,0|2,0,0]=3 43 B10R1.113 Cc1cccc(c1)C(=S)O CM12849 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.113 Cc1cncc(n1)C(=O)O CM14090 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.113 c1c(cncc1Br)C(=O)O CM14037 [0,1,0,0,0,0|1,0,0]=2 46 B10R1.113 c1c(nc(cn1)Br)C(=O)O CM10659 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.113 c1c(nc(cn1)Cl)C(=O)O CM10658 [0,1,0,0,0,0|2,0,0]=3 48 B10R1.113 c1cc(cc(c1)F)C(=O)O CM12710 [0,1,0,0,0,0|2,0,0]=3 49 B10R1.113 c1cc(cc(c1)N)C(=O)N CM13163 [0,1,0,0,0,0|1,0,0]=2 50 B10R1.113 c1cc(cc(c1)S)C(=O)O CM10051 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.113 c1cc(nc(c1)Cl)C(=O)O CM10033 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.113 c1cnc(cc1C(=O)O)N CM14043 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.113 c1cnc(cc1I)C(=O)O CM10569 [0,1,0,0,0,0|3,0,0]=4 54 B8R1.7 c1c(nc[nH]1)C(=O)O CM14067 [0,0,0,0,1,0|2,0,0]=3 55 B8R1.7 c1cn[nH]c1C(=O)O CM11038 [0,0,0,0,1,0|2,0,0]=3 56 B7R1.3 c1c(cncn1)Br CM14047 [2,0,0,0,0,0|2,0,0]=4 57 B7R1.3 c1cc(cnc1)F CM13853 [2,0,0,0,0,0|1,0,0]=3 58 B9R1.1 C=Cc1ccc(nc1)Br CM10147 [1,1,0,0,0,0|1,0,0]=3 59 B9R1.1 COc1ccc(nc1)Br CM10454 [1,1,0,0,0,0|2,0,0]=4 60 B9R1.1 c1c(cnc(n1)N)C=O CM10089 [1,1,0,0,0,0|1,0,0]=3 61 B9R1.1 c1cc(ccc1C=O)F CM11946 [1,1,0,0,0,0|1,0,0]=3 62 B9R1.1 c1cc(ccc1C=O)I CM11996 [1,1,0,0,0,0|1,0,0]=3 63 B9R1.1 c1cc(ccc1NN)F CM13799 [1,1,0,0,0,0|2,0,0]=4 64 B9R1.1 c1cc(ncc1C=O)Br CM13843 [1,1,0,0,0,0|0,0,0]=2 65 B9R1.2 c1cc(cc(c1)I)CN CM10968 [1,1,0,0,0,0|1,0,1]=4 66 B9R1.8 c1ccc(cc1)CNN CM14002 [1,1,0,0,0,0|1,0,1]=4 67 B9R1.8 c1ccc(cc1)CNO CM10002 [1,1,0,0,0,0|1,0,1]=4 68 B9R1.15 COc1cccnc1Br CM14120 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.15 COc1cccnc1N CM10903 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.15 COc1cnccc1N CM10329 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.15 Cc1ccncc1C=O CM10260 [1,1,0,0,0,0|0,0,0]=2 72 B9R1.15 c1ccc(c(c1)C=O)I CM11995 [1,1,0,0,0,0|1,0,0]=3 73 B9R1.15 c1ccc(c(c1)CN)F CM13538 [1,1,0,0,0,0|1,0,1]=4 74 B9R1.15 c1ccc(c(c1)NN)Br CM13792 [1,1,0,0,0,0|2,0,0]=4 75 B9R1.15 c1cncc(c1O)C#N CM10064 [1,1,0,0,0,0|0,0,2]=4 76 B9R1.35 Cn1cc(nc1)C(=O)O CM14072 [0,1,0,0,1,0|2,0,0]=4 77 B9R1.35 Cn1ccc(c1)C(=O)O CM10465 [0,1,0,0,1,0|1,0,1]=4 78 B11R1.20 CC(=O)Cc1ccc(cc1)Cl CM10951 [0,1,0,0,0,1|2,0,0]=4 79 B11R1.20 CC(=O)Cc1ccc(cc1)F CM10927 [0,1,0,0,0,1|2,0,0]=4 80 B11R1.20 CC(=O)Oc1ccc(cc1)F CM12027 [0,1,0,0,0,1|2,0,0]=4 81 B11R1.20 c1cc(ccc1CC(=O)O)F CM13704 [0,1,0,0,0,1|2,0,0]=4 82 B11R1.20 c1cc(ccc1F)[ClH]C(=O)[O-] CM13921 [0,1,0,0,0,1|2,0,0]=4 83 B11R1.20 c1cc(ccc1[ClH]C(=O)[O-])Br CM13923 [0,1,0,0,0,1|2,0,0]=4 84 B11R1.86 CC(=O)Cc1ccccc1Cl CM10944 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.86 CC(=O)Cc1ccccc1F CM10960 [0,1,0,0,0,1|2,0,0]=4 86 B11R1.157 Cc1cccc(c1)CC(=O)O CM13725 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.157 c1cc(cc(c1)F)CC(=O)O CM13703 [0,1,0,0,0,1|2,0,0]=4 88 B11R1.157 c1cc(cc(c1)I)CC(=O)O CM13719 [0,1,0,0,0,1|2,0,0]=4 89 B11R1.3 c1cc(ccc1CBr)C(=O)O CM10952 [0,2,0,0,0,0|2,0,0]=4 90 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br CM11175 [0,2,0,0,0,0|2,0,0]=4 91 B11R1.21 CC(=O)c1ccc(c(c1)Br)F CM11144 [0,2,0,0,0,0|2,0,0]=4 92 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl CM11181 [0,2,0,0,0,0|2,0,0]=4 93 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F CM11161 [0,2,0,0,0,0|2,0,0]=4 94 B11R1.21 CC(=O)c1ccc(c(c1)F)Br CM11146 [0,2,0,0,0,0|2,0,0]=4 95 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl CM11164 [0,2,0,0,0,0|2,0,0]=4 96 B11R1.21 CC(=O)c1ccc(c(c1)F)O CM11200 [0,2,0,0,0,0|2,0,0]=4 97 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl CM11123 [0,2,0,0,0,0|2,0,0]=4 98 B11R1.21 CC(=O)c1ccc(c(c1)N)F CM11126 [0,2,0,0,0,0|2,0,0]=4 99 B11R1.21 Cc1cc(ccc1Cl)C(=O)Cl CM12596 [0,2,0,0,0,0|2,0,0]=4 100 B11R1.21 Cc1cc(ccc1F)C(=O)C CM11205 [0,2,0,0,0,0|2,0,0]=4 101 B11R1.21 Cc1cc(ccc1O)C(=O)O CM12806 [0,2,0,0,0,0|2,0,0]=4 102 B11R1.21 Cc1ccc(cc1Br)C(=O)O CM12535 [0,2,0,0,0,0|2,0,0]=4 103 B11R1.21 Cc1ccc(cc1F)C(=O)O CM12766 [0,2,0,0,0,0|2,0,0]=4 104 B11R1.21 Cc1ccc(cc1I)C(=O)Cl CM12824 [0,2,0,0,0,0|2,0,0]=4 105 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O CM14315 [0,2,0,0,0,0|1,0,0]=3 106 B11R1.21 c1cc(c(cc1C(=O)Cl)F)Cl CM12579 [0,2,0,0,0,0|2,0,0]=4 107 B11R1.21 c1cc(c(cc1C(=O)O)Br)Br CM12638 [0,2,0,0,0,0|2,0,0]=4 108 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl CM12462 [0,2,0,0,0,0|2,0,0]=4 109 B11R1.21 c1cc(c(cc1C(=O)O)Br)I CM12518 [0,2,0,0,0,0|2,0,0]=4 110 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Br CM12465 [0,2,0,0,0,0|2,0,0]=4 111 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F CM12575 [0,2,0,0,0,0|2,0,0]=4 112 B11R1.21 c1cc(c(cc1C(=O)O)F)Br CM12500 [0,2,0,0,0,0|2,0,0]=4 113 B11R1.21 c1cc(c(cc1C(=O)O)F)Cl CM12578 [0,2,0,0,0,0|2,0,0]=4 114 B11R1.21 c1cc(c(cc1C(=O)O)F)F CM12108 [0,2,0,0,0,0|2,0,0]=4 115 B11R1.21 c1cc(c(cc1C(=O)O)F)I CM12739 [0,2,0,0,0,0|2,0,0]=4 116 B11R1.21 c1cc(c(cc1C(=O)O)F)N CM12407 [0,2,0,0,0,0|2,0,0]=4 117 B11R1.21 c1cc(c(cc1C(=O)O)F)O CM12721 [0,2,0,0,0,0|2,0,0]=4 118 B11R1.21 c1cc(c(cc1C(=O)O)I)Br CM10859 [0,2,0,0,0,0|2,0,0]=4 119 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl CM10858 [0,2,0,0,0,0|2,0,0]=4 120 B11R1.21 c1cc(c(cc1C(=O)O)I)F CM10861 [0,2,0,0,0,0|2,0,0]=4 121 B11R1.21 c1cc(c(cc1C(=O)O)I)I CM10862 [0,2,0,0,0,0|2,0,0]=4 122 B11R1.21 c1cc(c(cc1C(=O)O)I)N CM12419 [0,2,0,0,0,0|2,0,0]=4 123 B11R1.21 c1cc(c(cc1C(=O)O)N)Cl CM12360 [0,2,0,0,0,0|2,0,0]=4 124 B11R1.21 c1cc(c(cc1C(=O)O)N)N CM13996 [0,2,0,0,0,0|2,0,0]=4 125 B11R1.21 c1cc(c(cc1C(=O)O)O)F CM12724 [0,2,0,0,0,0|2,0,0]=4 126 B11R1.21 c1cc(c(cc1C(=O)O)O)I CM12805 [0,2,0,0,0,0|2,0,0]=4 127 B11R1.21 c1cc(c(cc1C(=O)O)O)N CM12417 [0,2,0,0,0,0|2,0,0]=4 128 B11R1.22 COC(=O)c1ccc(cc1)N CM12345 [0,2,0,0,0,0|2,0,0]=4 129 B11R1.22 COC(=O)c1cnc(cn1)O CM14417 [0,2,0,0,0,0|2,0,0]=4 130 B11R1.22 COC(=O)c1cnc(nc1)Br CM10434 [0,2,0,0,0,0|2,0,0]=4 131 B11R1.22 COC(=O)c1cnc(nc1)Cl CM14061 [0,2,0,0,0,0|2,0,0]=4 132 B11R1.22 COC(=O)c1cnc(nc1)N CM10696 [0,2,0,0,0,0|2,0,0]=4 133 B11R1.22 c1cc(ccc1C(=NO)N)F CM12026 [0,2,0,0,0,0|1,0,1]=4 134 B11R1.22 c1cc(ccc1C(=O)CBr)Br CM11176 [0,2,0,0,0,0|2,0,0]=4 135 B11R1.22 c1cc(ccc1C(=O)CBr)Cl CM11135 [0,2,0,0,0,0|2,0,0]=4 136 B11R1.22 c1cc(ccc1C(=O)CBr)F CM11141 [0,2,0,0,0,0|2,0,0]=4 137 B11R1.22 c1cc(ccc1C(=O)CN)Br CM11121 [0,2,0,0,0,0|1,0,0]=3 138 B11R1.22 c1cc(ccc1C(=O)NN)Cl CM13812 [0,2,0,0,0,0|1,0,0]=3 139 B11R1.166 CC(=O)c1ccc(cc1Br)N CM11122 [0,2,0,0,0,0|2,0,0]=4 140 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl CM11180 [0,2,0,0,0,0|2,0,0]=4 141 B11R1.166 CC(=O)c1ccc(cc1Cl)F CM11158 [0,2,0,0,0,0|2,0,0]=4 142 B11R1.166 CC(=O)c1ccc(cc1Cl)O CM11165 [0,2,0,0,0,0|2,0,0]=4 143 B11R1.166 CC(=O)c1ccc(cc1F)Br CM11145 [0,2,0,0,0,0|2,0,0]=4 144 B11R1.166 CC(=O)c1ccc(cc1F)Cl CM11163 [0,2,0,0,0,0|2,0,0]=4 145 B11R1.166 CC(=O)c1ccc(cc1N)F CM10552 [0,2,0,0,0,0|2,0,0]=4 146 B11R1.166 CC(=O)c1ccc(cc1O)Br CM14016 [0,2,0,0,0,0|2,0,0]=4 147 B11R1.166 CC(=O)c1ccc(cc1O)Cl CM14015 [0,2,0,0,0,0|2,0,0]=4 148 B11R1.166 CC(=O)c1ccc(cc1O)F CM14014 [0,2,0,0,0,0|2,0,0]=4 149 B11R1.166 CC(=O)c1ccc(cc1O)N CM11128 [0,2,0,0,0,0|2,0,0]=4 150 B11R1.166 Cc1c(ccc(n1)Cl)[N+](=O)[O-] CM14118 [0,2,0,0,0,0|2,0,0]=4 151 B11R1.166 Cc1cc(ccc1C(=O)O)F CM12767 [0,2,0,0,0,0|2,0,0]=4 152 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])Cl CM11007 [0,2,0,0,0,0|2,0,0]=4 153 B11R1.166 Cc1ccc(c(c1)C)C(=O)O CM10965 [0,2,0,0,0,0|2,0,0]=4 154 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O CM12591 [0,2,0,0,0,0|2,0,0]=4 155 B11R1.166 Cc1ccc(c(c1)F)C(=O)O CM10021 [0,2,0,0,0,0|2,0,0]=4 156 B11R1.166 Cc1ccc(c(c1)N)C(=O)O CM12428 [0,2,0,0,0,0|2,0,0]=4 157 B11R1.166 Cc1ccc(c(n1)C)[N+](=O)[O-] CM14042 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.166 c1c(nc(c(n1)C(=O)O)Cl)Cl CM10151 [0,2,0,0,0,0|2,0,0]=4 159 B11R1.166 c1cc(c(cc1Br)Br)C(=O)N CM13171 [0,2,0,0,0,0|1,0,0]=3 160 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O CM12636 [0,2,0,0,0,0|2,0,0]=4 161 B11R1.166 c1cc(c(cc1Br)F)C(=O)O CM12499 [0,2,0,0,0,0|2,0,0]=4 162 B11R1.166 c1cc(c(cc1Br)N)C(=O)O CM12349 [0,2,0,0,0,0|2,0,0]=4 163 B11R1.166 c1cc(c(cc1Br)O)C(=O)O CM12513 [0,2,0,0,0,0|2,0,0]=4 164 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O CM12458 [0,2,0,0,0,0|2,0,0]=4 165 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O CM12577 [0,2,0,0,0,0|2,0,0]=4 166 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N CM13164 [0,2,0,0,0,0|1,0,0]=3 167 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O CM12359 [0,2,0,0,0,0|2,0,0]=4 168 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O CM12585 [0,2,0,0,0,0|2,0,0]=4 169 B11R1.166 c1cc(c(cc1F)Br)C(=O)O CM12488 [0,2,0,0,0,0|2,0,0]=4 170 B11R1.166 c1cc(c(cc1F)F)C(=O)O CM12655 [0,2,0,0,0,0|2,0,0]=4 171 B11R1.166 c1cc(c(cc1F)N)C(=O)O CM12396 [0,2,0,0,0,0|2,0,0]=4 172 B11R1.166 c1cc(c(cc1F)O)C(=O)O CM10955 [0,2,0,0,0,0|2,0,0]=4 173 B11R1.166 c1cc(c(cc1I)F)C(=O)O CM12733 [0,2,0,0,0,0|2,0,0]=4 174 B11R1.166 c1cc(c(cc1N)Cl)C(=O)O CM12361 [0,2,0,0,0,0|2,0,0]=4 175 B11R1.166 c1cc(c(cc1N)F)C(=O)O CM12405 [0,2,0,0,0,0|2,0,0]=4 176 B11R1.166 c1cc(c(cc1O)I)C(=O)O CM10163 [0,2,0,0,0,0|2,0,0]=4 177 B11R1.166 c1cc(nc(c1[N+](=O)[O-])N)Cl CM13993 [0,2,0,0,0,0|2,0,0]=4 178 B11R1.16 CCOC(=O)c1cccnc1 CM10029 [0,2,0,0,0,0|1,0,0]=3 179 B11R1.23 CCC(=O)c1cccc(c1)N CM11248 [0,2,0,0,0,0|2,0,0]=4 180 B11R1.23 COC(=O)c1cccc(c1)I CM12817 [0,2,0,0,0,0|2,0,0]=4 181 B11R1.23 COC(=O)c1cccc(c1)N CM12344 [0,2,0,0,0,0|2,0,0]=4 182 B11R1.23 COC(=O)c1cccc(c1)O CM12802 [0,2,0,0,0,0|2,0,0]=4 183 B11R1.23 COC(=O)c1cncc(n1)Br CM10424 [0,2,0,0,0,0|2,0,0]=4 184 B11R1.23 COC(=O)c1cncc(n1)Cl CM10425 [0,2,0,0,0,0|2,0,0]=4 185 B11R1.23 c1cc(cc(c1)O)C(=O)CBr CM11149 [0,2,0,0,0,0|2,0,0]=4 186 B11R1.53 CC(=O)c1cccnc1OC CM10529 [0,2,0,0,0,0|1,0,0]=3 187 B11R1.53 COc1c(nccn1)C(=O)O CM10657 [0,2,0,0,0,0|2,0,0]=4 188 B11R1.53 c1ccc(c(c1)C#N)C(=O)O CM12612 [0,2,0,0,0,0|2,0,0]=4 189 B11R1.156 CC(=O)c1c(cccc1Cl)F CM11160 [0,2,0,0,0,0|2,0,0]=4 190 B11R1.156 CC(=O)c1c(cccc1F)F CM11189 [0,2,0,0,0,0|2,0,0]=4 191 B11R1.156 CC(=O)c1c(cccc1F)O CM11199 [0,2,0,0,0,0|2,0,0]=4 192 B11R1.156 Cc1cccc(c1C(=O)Cl)F CM12764 [0,2,0,0,0,0|2,0,0]=4 193 B11R1.156 Cc1cccc(c1C(=O)O)Br CM12533 [0,2,0,0,0,0|2,0,0]=4 194 B11R1.156 Cc1cccc(c1C(=O)O)C CM12702 [0,2,0,0,0,0|2,0,0]=4 195 B11R1.156 Cc1cccc(c1C(=O)O)Cl CM12593 [0,2,0,0,0,0|2,0,0]=4 196 B11R1.156 Cc1cccc(c1C(=O)O)F CM12763 [0,2,0,0,0,0|2,0,0]=4 197 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Br CM12637 [0,2,0,0,0,0|2,0,0]=4 198 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Cl CM12460 [0,2,0,0,0,0|2,0,0]=4 199 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F CM12491 [0,2,0,0,0,0|2,0,0]=4 200 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)N CM12351 [0,2,0,0,0,0|2,0,0]=4 201 B11R1.156 c1cc(c(c(c1)F)C(=O)Cl)F CM12660 [0,2,0,0,0,0|2,0,0]=4 202 B11R1.156 c1cc(c(c(c1)F)C(=O)N)F CM13172 [0,2,0,0,0,0|1,0,0]=3 203 B11R1.156 c1cc(c(c(c1)F)C(=O)O)F CM12659 [0,2,0,0,0,0|2,0,0]=4 204 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N CM12400 [0,2,0,0,0,0|2,0,0]=4 205 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O CM10856 [0,2,0,0,0,0|2,0,0]=4 206 B11R1.156 c1cc(c(c(c1)I)C(=O)Cl)F CM12737 [0,2,0,0,0,0|2,0,0]=4 207 B11R1.156 c1cc(c(c(c1)I)C(=O)N)Cl CM13169 [0,2,0,0,0,0|1,0,0]=3 208 B11R1.156 c1cc(c(c(c1)I)C(=O)O)F CM12736 [0,2,0,0,0,0|2,0,0]=4 209 B11R1.156 c1cnc(c(c1Br)[N+](=O)[O-])Br CM11002 [0,2,0,0,0,0|2,0,0]=4 210 B11R1.156 c1cnc(c(c1Cl)[N+](=O)[O-])Cl CM13852 [0,2,0,0,0,0|2,0,0]=4 211 B11R1.159 CC(=O)c1cccc(c1Cl)Cl CM11179 [0,2,0,0,0,0|2,0,0]=4 212 B11R1.159 CC(=O)c1cccc(c1F)Br CM11143 [0,2,0,0,0,0|2,0,0]=4 213 B11R1.159 CC(=O)c1cccc(c1F)F CM10559 [0,2,0,0,0,0|2,0,0]=4 214 B11R1.159 CC(=O)c1cccc(c1N)Br CM11120 [0,2,0,0,0,0|2,0,0]=4 215 B11R1.159 Cc1c(cccc1Cl)C(=O)O CM12594 [0,2,0,0,0,0|2,0,0]=4 216 B11R1.159 Cc1c(cccc1I)C(=O)O CM12823 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.159 Cc1cccc(c1Br)C(=O)O CM12530 [0,2,0,0,0,0|2,0,0]=4 218 B11R1.159 Cc1cccc(c1C)C(=O)Cl CM12700 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.159 Cc1cccc(c1F)C(=O)O CM12758 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.159 Cc1cccc(c1I)C(=O)O CM12822 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.159 Cc1cncc(c1Cl)[N+](=O)[O-] CM10233 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.159 Cc1cncc(c1N)[N+](=O)[O-] CM10212 [0,2,0,0,0,0|2,0,0]=4 223 B11R1.159 c1c(c(c(cn1)Br)N)[N+](=O)[O-] CM10992 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.159 c1cc(c(c(c1)Br)Br)C(=O)O CM12635 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)Cl CM12494 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O CM12493 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O CM12347 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.159 c1cc(c(c(c1)Br)O)C(=O)O CM12512 [0,2,0,0,0,0|2,0,0]=4 229 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O CM10327 [0,2,0,0,0,0|2,0,0]=4 230 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)O CM12640 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)Cl CM12574 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O CM12573 [0,2,0,0,0,0|2,0,0]=4 233 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O CM12358 [0,2,0,0,0,0|2,0,0]=4 234 B11R1.159 c1cc(c(c(c1)Cl)O)C(=O)O CM12584 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O CM12486 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.159 c1cc(c(c(c1)F)Cl)C(=O)O CM12572 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O CM12654 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O CM12738 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.159 c1cc(c(c(c1)F)N)C(=O)N CM13165 [0,2,0,0,0,0|1,0,0]=3 240 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O CM12394 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.159 c1cc(c(c(c1)F)O)C(=O)O CM12720 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.159 c1cc(c(c(c1)I)F)C(=O)O CM12731 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O CM12402 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.159 c1cc(c(c(c1)O)Br)C(=O)O CM10231 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.159 c1cc(c(c(c1)O)F)C(=O)O CM12713 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.159 c1cc(c(c(c1)O)I)C(=O)O CM10894 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.167 CC(=O)c1cc(ccc1Br)F CM10079 [0,2,0,0,0,0|2,0,0]=4 248 B11R1.167 CC(=O)c1cc(ccc1Cl)F CM11159 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.167 CC(=O)c1cc(ccc1F)Br CM11147 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.167 CC(=O)c1cc(ccc1I)F CM11201 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.167 CC(=O)c1cc(ccc1O)Br CM14330 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.167 Cc1ccc(c(c1)C(=O)N)N CM13166 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br CM12531 [0,2,0,0,0,0|2,0,0]=4 254 B11R1.167 Cc1ccc(c(c1)C(=O)O)C CM12701 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl CM12592 [0,2,0,0,0,0|2,0,0]=4 256 B11R1.167 Cc1ccc(c(c1)C(=O)O)F CM12761 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.167 Cc1ccc(c(c1)C(=O)O)I CM12821 [0,2,0,0,0,0|2,0,0]=4 258 B11R1.167 Cc1ccc(cc1C(=O)O)Br CM12537 [0,2,0,0,0,0|2,0,0]=4 259 B11R1.167 Cc1ccc(cc1C(=O)O)F CM10930 [0,2,0,0,0,0|2,0,0]=4 260 B11R1.167 Cc1ccc(cc1C(=O)O)I CM12825 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.167 Cc1ccc(cc1C(=O)O)N CM12431 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.167 Cc1ccc(cc1C(=O)O)O CM10889 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.167 c1c(c(nnc1Cl)Cl)C(=O)O CM14087 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.167 c1c(cnc(c1C(=O)N)Cl)Br CM14100 [0,2,0,0,0,0|0,0,0]=2 265 B11R1.167 c1c(cnc(c1[N+](=O)[O-])Cl)Br CM14038 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.167 c1cc(c(cc1Br)C(=O)O)F CM12504 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.167 c1cc(c(cc1Br)C(=O)O)I CM12521 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.167 c1cc(c(cc1Cl)C(=O)Cl)F CM12580 [0,2,0,0,0,0|2,0,0]=4 269 B11R1.167 c1cc(c(cc1F)C(=O)O)F CM12658 [0,2,0,0,0,0|2,0,0]=4 270 B11R1.167 c1cc(c(cc1F)C(=O)O)I CM12741 [0,2,0,0,0,0|2,0,0]=4 271 B11R1.167 c1cc(c(cc1F)C(=O)O)N CM12398 [0,2,0,0,0,0|2,0,0]=4 272 B11R1.167 c1cc(c(cc1F)C(=O)O)O CM12725 [0,2,0,0,0,0|2,0,0]=4 273 B11R1.167 c1cc(c(cc1F)C(=O)[O-])F CM12657 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.167 c1cc(c(cc1I)C(=O)O)Br CM12515 [0,2,0,0,0,0|2,0,0]=4 275 B11R1.167 c1cc(c(cc1I)C(=O)O)Cl CM12586 [0,2,0,0,0,0|2,0,0]=4 276 B11R1.167 c1cc(c(cc1I)C(=O)O)F CM12735 [0,2,0,0,0,0|2,0,0]=4 277 B11R1.167 c1cc(c(cc1I)C(=O)O)I CM12693 [0,2,0,0,0,0|2,0,0]=4 278 B11R1.167 c1cc(c(cc1N)C(=O)O)F CM12408 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.167 c1cc(c(cc1O)C(=O)O)Cl CM12583 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.167 c1cc(c(cc1O)C(=O)O)F CM12716 [0,2,0,0,0,0|2,0,0]=4 281 B11R1.167 c1cc(nc(c1N)C(=O)N)Cl CM14027 [0,2,0,0,0,0|2,0,0]=4 282 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br CM11177 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl CM11182 [0,2,0,0,0,0|2,0,0]=4 284 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F CM11162 [0,2,0,0,0,0|2,0,0]=4 285 B11R1.74 CC(=O)c1cc(cc(c1)F)F CM11190 [0,2,0,0,0,0|2,0,0]=4 286 B11R1.74 Cc1cc(cc(c1)C(=O)O)C CM12703 [0,2,0,0,0,0|2,0,0]=4 287 B11R1.74 Cc1cc(cc(c1)N)C(=O)O CM12429 [0,2,0,0,0,0|2,0,0]=4 288 B11R1.74 c1c(cc(cc1Br)I)C(=O)O CM12519 [0,2,0,0,0,0|2,0,0]=4 289 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O CM12463 [0,2,0,0,0,0|2,0,0]=4 290 B11R1.74 c1c(cc(cc1Cl)Cl)C(=O)O CM12642 [0,2,0,0,0,0|2,0,0]=4 291 B11R1.74 c1c(cc(cc1Cl)I)C(=O)O CM12587 [0,2,0,0,0,0|2,0,0]=4 292 B11R1.74 c1c(cc(cc1F)Br)C(=O)O CM12495 [0,2,0,0,0,0|2,0,0]=4 293 B11R1.74 c1c(cc(cc1F)Cl)C(=O)O CM12576 [0,2,0,0,0,0|2,0,0]=4 294 B11R1.74 c1c(cc(cc1F)F)C(=O)Cl CM12665 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.74 c1c(cc(cc1F)F)C(=O)O CM12663 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.74 c1c(cc(cc1F)F)C(=O)[O-] CM12662 [0,2,0,0,0,0|2,0,0]=4 297 B11R1.74 c1c(cc(cc1F)I)C(=O)O CM12740 [0,2,0,0,0,0|2,0,0]=4 298 B11R1.74 c1c(cc(cc1I)I)C(=O)O CM12694 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.74 c1c(cc(cc1N)F)C(=O)O CM12403 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.74 c1c(cc(cc1N)N)C(=O)O CM12634 [0,2,0,0,0,0|2,0,0]=4 301 B11R1.74 c1c(cc(cc1O)Br)C(=O)O CM10203 [0,2,0,0,0,0|2,0,0]=4 302 B11R1.74 c1c(cc(cc1O)I)C(=O)O CM10387 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.266 CC(=O)c1cccc(c1)C#N CM12899 [0,2,0,0,0,0|2,0,0]=4 304 B11R1.266 COc1cncc(n1)C(=O)O CM10660 [0,2,0,0,0,0|2,0,0]=4 305 B11R1.266 c1cc(cc(c1)C(=O)Cl)C#N CM12615 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.266 c1cc(cc(c1)C(=O)O)C#N CM12613 [0,2,0,0,0,0|2,0,0]=4 307 B11R1.266 c1cc(nc(c1)C(=O)N)CO CM13854 [0,2,0,0,0,0|2,0,0]=4 308 B11R2.10 c1cncc2c1sc(n2)N CM10620 [0,0,0,1,0,1|0,1,0]=3 309 B11R2.1 Cc1c2ccccc2[nH]n1 CM10785 [0,1,0,1,0,0|2,0,0]=4 310 B11R2.1 c1cc2c(n[nH]c2nc1)N CM10550 [0,1,0,1,0,0|1,0,0]=3 311 B11R2.1 c1ccc2c(c1)CNC2=O CM10840 [0,1,0,1,0,0|1,0,0]=3 312 B11R2.1 c1ccc2c(c1)c(=O)[nH][nH]2 CM10841 [0,1,0,1,0,0|1,0,0]=3 313 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br CM10098 [0,1,0,1,0,0|2,0,0]=4 314 B7R1.1 c1c(nc[nH]1)C=O CM14068 [1,0,0,0,1,0|1,0,0]=3 315 B7R1.1 c1cc([nH]c1)C=O CM13861 [1,0,0,0,1,0|0,0,1]=3 316 B11R1.91 CC(=O)COc1ccccc1 CM11227 [0,0,0,0,0,2|2,0,0]=4