0 B10R1.113 CC(=O)c1cc(ccn1)Cl CM10835 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.113 CC(=O)c1cccc(c1)F CM11197 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.113 CC(=O)c1cccc(c1)I CM11219 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.113 CC(C)c1cccc(c1)Br CM12107 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.113 CC(c1cccc(c1)F)N CM13557 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.113 CC(c1cccc(c1)F)O CM13506 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.113 Cc1cccc(c1)C(=S)O CM12849 [0,0,0,0,0,0|1,1,0]=2 8 B10R1.113 Cc1cncc(n1)C(=O)O CM14090 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.113 c1c(cncc1Br)C(=O)O CM14037 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.113 c1c(nc(cn1)Br)C(=O)O CM10659 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.113 c1c(nc(cn1)Cl)C(=O)O CM10658 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.113 c1cc(cc(c1)F)C(=O)O CM12710 [0,0,0,0,0,0|1,0,0]=1 13 B10R1.113 c1cc(cc(c1)F)C(F)F CM12223 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.113 c1cc(cc(c1)N)C(=O)N CM13163 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.113 c1cc(cc(c1)S)C(=O)O CM10051 [0,0,0,0,0,0|0,1,0]=1 16 B10R1.113 c1cc(nc(c1)Cl)C(=O)O CM10033 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.113 c1cnc(cc1C(=O)O)N CM14043 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.113 c1cnc(cc1I)C(=O)O CM10569 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.113 c1cnc(nc1C(=O)O)N CM14051 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.2 CCc1cccc(c1)Br CM12087 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.2 CCc1cccc(c1)N CM11452 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.2 CNc1cccc(c1)O CM10115 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.2 Cc1cccc(c1)CF CM13445 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.2 c1cc(cc(c1)F)C#N CM13067 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.2 c1cc(cc(c1)I)CBr CM13435 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.2 c1cc(cc(c1)I)CN CM10968 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.2 c1cnc(cc1CO)N CM14035 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.6 B(c1ccncc1)(O)O CM10013 [1,0,0,0,0,0|2,0,1]=4 29 B9R1.6 c1cc(c[nH+]c1)C(=N)N CM13840 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.6 c1ccnc(c1)C(=N)N CM13839 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.6 c1cncnc1C(=O)O CM10263 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.21 B(c1ccc(c(c1)O)Cl)(O)O CM10541 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br CM11175 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.21 CC(=O)c1ccc(c(c1)Br)F CM11144 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl CM11181 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F CM11161 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.21 CC(=O)c1ccc(c(c1)F)Br CM11146 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl CM11164 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.21 CC(=O)c1ccc(c(c1)F)O CM11200 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl CM11123 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.21 CC(=O)c1ccc(c(c1)N)F CM11126 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.21 Cc1cc(ccc1Cl)C(=O)Cl CM12596 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.21 Cc1cc(ccc1F)C(=O)C CM11205 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.21 Cc1cc(ccc1F)[N+](=O)[O-] CM13962 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.21 Cc1cc(ccc1I)[N+](=O)[O-] CM10138 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.21 Cc1cc(ccc1O)C(=O)O CM12806 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.21 Cc1cc(ccc1O)[N+](=O)[O-] CM11791 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.21 Cc1ccc(cc1Br)C(=O)O CM12535 [0,1,0,0,0,0|1,0,0]=2 49 B11R1.21 Cc1ccc(cc1Br)[N+](=O)[O-] CM13935 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.21 Cc1ccc(cc1F)C(=O)O CM12766 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.21 Cc1ccc(cc1F)[N+](=O)[O-] CM13961 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.21 Cc1ccc(cc1I)C(=O)Cl CM12824 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.21 Cc1ccc(cc1I)[N+](=O)[O-] CM13969 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O CM14315 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.21 c1cc(c(cc1C(=O)Cl)F)Cl CM12579 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.21 c1cc(c(cc1C(=O)O)Br)Br CM12638 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl CM12462 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.21 c1cc(c(cc1C(=O)O)Br)I CM12518 [0,1,0,0,0,0|1,0,0]=2 59 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Br CM12465 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F CM12575 [0,1,0,0,0,0|1,0,0]=2 61 B11R1.21 c1cc(c(cc1C(=O)O)F)Br CM12500 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.21 c1cc(c(cc1C(=O)O)F)Cl CM12578 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.21 c1cc(c(cc1C(=O)O)F)F CM12108 [0,1,0,0,0,0|1,0,0]=2 64 B11R1.21 c1cc(c(cc1C(=O)O)F)I CM12739 [0,1,0,0,0,0|1,0,0]=2 65 B11R1.21 c1cc(c(cc1C(=O)O)F)N CM12407 [0,1,0,0,0,0|1,0,0]=2 66 B11R1.21 c1cc(c(cc1C(=O)O)F)O CM12721 [0,1,0,0,0,0|1,0,0]=2 67 B11R1.21 c1cc(c(cc1C(=O)O)I)Br CM10859 [0,1,0,0,0,0|1,0,0]=2 68 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl CM10858 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.21 c1cc(c(cc1C(=O)O)I)F CM10861 [0,1,0,0,0,0|1,0,0]=2 70 B11R1.21 c1cc(c(cc1C(=O)O)I)I CM10862 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.21 c1cc(c(cc1C(=O)O)I)N CM12419 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.21 c1cc(c(cc1C(=O)O)N)Cl CM12360 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.21 c1cc(c(cc1C(=O)O)N)N CM13996 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.21 c1cc(c(cc1C(=O)O)O)F CM12724 [0,1,0,0,0,0|0,0,0]=1 75 B11R1.21 c1cc(c(cc1C(=O)O)O)I CM12805 [0,1,0,0,0,0|0,0,0]=1 76 B11R1.21 c1cc(c(cc1C(=O)O)O)N CM12417 [0,1,0,0,0,0|0,0,0]=1 77 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Br)Cl CM12055 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Br)N CM11321 [0,1,0,0,0,0|2,0,1]=4 79 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Cl)N CM11379 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)Br CM12096 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)Cl CM11278 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)F CM12228 [0,1,0,0,0,0|2,0,1]=4 83 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)I CM12268 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)N CM11474 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)O CM11766 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.21 c1cc(c(cc1[N+](=O)[O-])I)N CM11499 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.21 c1cc(c(cc1[N+](=O)[O-])N)Br CM11322 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.21 c1cc(c(cc1[N+](=O)[O-])N)F CM11476 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.21 c1cc(c(cc1[N+](=O)[O-])O)F CM11768 [0,1,0,0,0,0|1,0,1]=3 90 B11R1.23 CCC(=O)c1cccc(c1)N CM11248 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.23 COC(=O)c1cccc(c1)I CM12817 [0,1,0,0,0,0|1,0,0]=2 92 B11R1.23 COC(=O)c1cccc(c1)N CM12344 [0,1,0,0,0,0|1,0,0]=2 93 B11R1.23 COC(=O)c1cccc(c1)O CM12802 [0,1,0,0,0,0|0,0,0]=1 94 B11R1.23 COC(=O)c1cncc(n1)Br CM10424 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.23 COC(=O)c1cncc(n1)Cl CM10425 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.23 c1cc(cc(c1)O)C(=O)CBr CM11149 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.74 B(c1cc(cc(c1)F)F)(O)O CM13566 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br CM11177 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl CM11182 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F CM11162 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.74 CC(=O)c1cc(cc(c1)F)F CM11190 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.74 CC(c1cc(cc(c1)F)F)O CM13505 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.74 Cc1cc(cc(c1)Br)[N+](=O)[O-] CM13938 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.74 Cc1cc(cc(c1)C(=O)O)C CM12703 [0,1,0,0,0,0|1,0,0]=2 105 B11R1.74 Cc1cc(cc(c1)Cl)[N+](=O)[O-] CM13948 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.74 Cc1cc(cc(c1)F)[N+](=O)[O-] CM13965 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.74 Cc1cc(cc(c1)I)[N+](=O)[O-] CM13970 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.74 Cc1cc(cc(c1)N)C(=O)O CM12429 [0,1,0,0,0,0|1,0,0]=2 109 B11R1.74 Cc1cc(cc(c1)[N+](=O)[O-])C CM12257 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.74 Cc1cc(cc(c1)[N+](=O)[O-])N CM11506 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.74 c1c(cc(cc1Br)I)C(=O)O CM12519 [0,1,0,0,0,0|1,0,0]=2 112 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O CM12463 [0,1,0,0,0,0|1,0,0]=2 113 B11R1.74 c1c(cc(cc1Cl)Cl)C(=O)O CM12642 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.74 c1c(cc(cc1Cl)I)C(=O)O CM12587 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.74 c1c(cc(cc1F)Br)C(=O)O CM12495 [0,1,0,0,0,0|1,0,0]=2 116 B11R1.74 c1c(cc(cc1F)Cl)C(=O)O CM12576 [0,1,0,0,0,0|1,0,0]=2 117 B11R1.74 c1c(cc(cc1F)F)C(=O)Cl CM12665 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.74 c1c(cc(cc1F)F)C(=O)O CM12663 [0,1,0,0,0,0|1,0,0]=2 119 B11R1.74 c1c(cc(cc1F)F)C(=O)[O-] CM12662 [0,1,0,0,0,0|1,0,1]=3 120 B11R1.74 c1c(cc(cc1F)F)[N+](=O)[O-] CM12229 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.74 c1c(cc(cc1F)I)C(=O)O CM12740 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.74 c1c(cc(cc1F)I)[N+](=O)[O-] CM12269 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.74 c1c(cc(cc1I)I)C(=O)O CM12694 [0,1,0,0,0,0|1,0,0]=2 124 B11R1.74 c1c(cc(cc1N)F)C(=O)O CM12403 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.74 c1c(cc(cc1N)N)C(=O)O CM12634 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.74 c1c(cc(cc1O)Br)C(=O)O CM10203 [0,1,0,0,0,0|0,0,0]=1 127 B11R1.74 c1c(cc(cc1O)Br)[N+](=O)[O-] CM10189 [0,1,0,0,0,0|1,0,1]=3 128 B11R1.74 c1c(cc(cc1O)I)C(=O)O CM10387 [0,1,0,0,0,0|0,0,0]=1 129 B11R1.74 c1c(cc(cc1[N+](=O)[O-])Br)N CM11325 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.74 c1c(cc(cc1[N+](=O)[O-])F)N CM11479 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.155 Cc1cccc(c1)S(=O)(=O)Cl CM12855 [0,1,0,0,0,0|2,0,1]=4 132 B11R1.155 c1cc(cc(c1)O)C(F)(F)F CM11809 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.159 CC(=O)c1cccc(c1Cl)Cl CM11179 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.159 CC(=O)c1cccc(c1F)Br CM11143 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.159 CC(=O)c1cccc(c1F)F CM10559 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.159 CC(=O)c1cccc(c1N)Br CM11120 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.159 CC(C)c1cccc(c1F)O CM10381 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.159 Cc1c(cccc1Br)[N+](=O)[O-] CM13936 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.159 Cc1c(cccc1Cl)C(=O)O CM12594 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.159 Cc1c(cccc1F)[N+](=O)[O-] CM13963 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.159 Cc1c(cccc1I)C(=O)O CM12823 [0,1,0,0,0,0|1,0,0]=2 142 B11R1.159 Cc1cccc(c1Br)C(=O)O CM12530 [0,1,0,0,0,0|1,0,0]=2 143 B11R1.159 Cc1cccc(c1Br)[N+](=O)[O-] CM13934 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.159 Cc1cccc(c1C)C(=O)Cl CM12700 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.159 Cc1cccc(c1F)C(=O)O CM12758 [0,1,0,0,0,0|1,0,0]=2 146 B11R1.159 Cc1cccc(c1F)[N+](=O)[O-] CM13960 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.159 Cc1cccc(c1I)C(=O)O CM12822 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.159 Cc1cccc(c1N)[N+](=O)[O-] CM11505 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.159 c1cc(c(c(c1)Br)Br)C(=O)O CM12635 [0,1,0,0,0,0|1,0,0]=2 150 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)Cl CM12494 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O CM12493 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.159 c1cc(c(c(c1)Br)F)[N+](=O)[O-] CM12093 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.159 c1cc(c(c(c1)Br)I)[N+](=O)[O-] CM12103 [0,1,0,0,0,0|2,0,1]=4 154 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O CM12347 [0,1,0,0,0,0|1,0,0]=2 155 B11R1.159 c1cc(c(c(c1)Br)O)C(=O)O CM12512 [0,1,0,0,0,0|1,0,0]=2 156 B11R1.159 c1cc(c(c(c1)Br)O)[N+](=O)[O-] CM11661 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O CM10327 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.159 c1cc(c(c(c1)Cl)Br)[N+](=O)[O-] CM10245 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)O CM12640 [0,1,0,0,0,0|1,0,0]=2 160 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)Cl CM12574 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O CM12573 [0,1,0,0,0,0|1,0,0]=2 162 B11R1.159 c1cc(c(c(c1)Cl)F)[N+](=O)[O-] CM12145 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O CM12358 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.159 c1cc(c(c(c1)Cl)N)[N+](=O)[O-] CM10244 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.159 c1cc(c(c(c1)Cl)O)C(=O)O CM12584 [0,1,0,0,0,0|1,0,0]=2 166 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O CM12486 [0,1,0,0,0,0|1,0,0]=2 167 B11R1.159 c1cc(c(c(c1)F)Br)[N+](=O)[O-] CM12089 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.159 c1cc(c(c(c1)F)Cl)C(=O)O CM12572 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.159 c1cc(c(c(c1)F)Cl)[N+](=O)[O-] CM12142 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O CM12654 [0,1,0,0,0,0|1,0,0]=2 171 B11R1.159 c1cc(c(c(c1)F)F)[N+](=O)[O-] CM12225 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O CM12738 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.159 c1cc(c(c(c1)F)I)[N+](=O)[O-] CM12267 [0,1,0,0,0,0|2,0,1]=4 174 B11R1.159 c1cc(c(c(c1)F)N)C(=O)N CM13165 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O CM12394 [0,1,0,0,0,0|1,0,0]=2 176 B11R1.159 c1cc(c(c(c1)F)N)[N+](=O)[O-] CM11477 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.159 c1cc(c(c(c1)F)O)C(=O)O CM12720 [0,1,0,0,0,0|1,0,0]=2 178 B11R1.159 c1cc(c(c(c1)I)F)C(=O)O CM12731 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O CM12402 [0,1,0,0,0,0|1,0,0]=2 180 B11R1.159 c1cc(c(c(c1)O)Br)C(=O)O CM10231 [0,1,0,0,0,0|0,0,0]=1 181 B11R1.159 c1cc(c(c(c1)O)F)C(=O)O CM12713 [0,1,0,0,0,0|0,0,0]=1 182 B11R1.159 c1cc(c(c(c1)O)I)C(=O)O CM10894 [0,1,0,0,0,0|0,0,0]=1 183 B11R1.159 c1cnc(c(c1Cl)Cl)C(=O)O CM10274 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.167 CC(=O)c1cc(ccc1Br)F CM10079 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.167 CC(=O)c1cc(ccc1Cl)F CM11159 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.167 CC(=O)c1cc(ccc1F)Br CM11147 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.167 CC(=O)c1cc(ccc1I)F CM11201 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.167 CC(=O)c1cc(ccc1O)Br CM14330 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.167 Cc1ccc(c(c1)C(=O)N)N CM13166 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br CM12531 [0,1,0,0,0,0|1,0,0]=2 191 B11R1.167 Cc1ccc(c(c1)C(=O)O)C CM12701 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl CM12592 [0,1,0,0,0,0|1,0,0]=2 193 B11R1.167 Cc1ccc(c(c1)C(=O)O)F CM12761 [0,1,0,0,0,0|1,0,0]=2 194 B11R1.167 Cc1ccc(c(c1)C(=O)O)I CM12821 [0,1,0,0,0,0|1,0,0]=2 195 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])F CM13967 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.167 Cc1ccc(cc1C(=O)O)Br CM12537 [0,1,0,0,0,0|1,0,0]=2 197 B11R1.167 Cc1ccc(cc1C(=O)O)F CM10930 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.167 Cc1ccc(cc1C(=O)O)I CM12825 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.167 Cc1ccc(cc1C(=O)O)N CM12431 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.167 Cc1ccc(cc1C(=O)O)O CM10889 [0,1,0,0,0,0|0,0,0]=1 201 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])F CM13966 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])O CM11793 [0,1,0,0,0,0|1,0,1]=3 203 B11R1.167 Cc1ncc(c(n1)C(=O)O)Br CM10692 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.167 c1c(c(nnc1Cl)Cl)C(=O)O CM14087 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.167 c1c(cnc(c1C(=O)N)Cl)Br CM14100 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.167 c1cc(c(cc1Br)C(=O)O)F CM12504 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.167 c1cc(c(cc1Br)C(=O)O)I CM12521 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])N CM11326 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])O CM11662 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.167 c1cc(c(cc1Cl)C(=O)Cl)F CM12580 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])Br CM12049 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])F CM12148 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])N CM11381 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.167 c1cc(c(cc1F)C(=O)O)F CM12658 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.167 c1cc(c(cc1F)C(=O)O)I CM12741 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.167 c1cc(c(cc1F)C(=O)O)N CM12398 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.167 c1cc(c(cc1F)C(=O)O)O CM12725 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.167 c1cc(c(cc1F)C(=O)[O-])F CM12657 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])Br CM12091 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])F CM12226 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])I CM12270 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])O CM11772 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.167 c1cc(c(cc1I)C(=O)O)Br CM12515 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.167 c1cc(c(cc1I)C(=O)O)Cl CM12586 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.167 c1cc(c(cc1I)C(=O)O)F CM12735 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.167 c1cc(c(cc1I)C(=O)O)I CM12693 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.167 c1cc(c(cc1I)[N+](=O)[O-])F CM12266 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.167 c1cc(c(cc1I)[N+](=O)[O-])I CM12237 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.167 c1cc(c(cc1I)[N+](=O)[O-])N CM11500 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.167 c1cc(c(cc1N)C(=O)O)F CM12408 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.167 c1cc(c(cc1N)[N+](=O)[O-])F CM11480 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.167 c1cc(c(cc1O)C(=O)O)Cl CM12583 [0,1,0,0,0,0|0,0,0]=1 233 B11R1.167 c1cc(c(cc1O)C(=O)O)F CM12716 [0,1,0,0,0,0|0,0,0]=1 234 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])Cl CM11696 [0,1,0,0,0,0|1,0,1]=3 235 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])F CM11773 [0,1,0,0,0,0|1,0,1]=3 236 B11R1.167 c1cc(nc(c1N)C(=O)N)Cl CM14027 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.266 B(c1cccc(c1)CC)(O)O CM13568 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.266 CC(=O)c1cccc(c1)C#N CM12899 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.266 COc1cc(ncn1)C(=O)O CM10693 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.266 COc1cncc(n1)C(=O)O CM10660 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.266 c1cc(cc(c1)C(=O)Cl)C#N CM12615 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.266 c1cc(cc(c1)C(=O)O)C#N CM12613 [0,1,0,0,0,0|1,0,0]=2 243 B11R1.266 c1cc(nc(c1)C(=O)N)CO CM13854 [0,1,0,0,0,0|2,0,0]=3 244 B9R1.35 Cn1cc(nc1)C(=O)O CM14072 [0,0,0,0,1,0|3,0,0]=4 245 B9R1.35 Cn1ccc(c1)C(=O)O CM10465 [0,0,0,0,1,0|2,0,0]=3 246 B11R1.157 Cc1cccc(c1)CC(=O)O CM13725 [0,0,0,0,0,1|1,0,0]=2 247 B11R1.157 c1cc(cc(c1)F)CC(=O)O CM13703 [0,0,0,0,0,1|1,0,0]=2 248 B11R1.157 c1cc(cc(c1)I)CC(=O)O CM13719 [0,0,0,0,0,1|1,0,0]=2 249 B8R1.4 c1c(cncc1Br)O CM14470 [2,0,0,0,0,0|2,0,0]=4 250 B8R1.4 c1c(cncc1Cl)O CM10662 [2,0,0,0,0,0|2,0,0]=4 251 B8R1.4 c1c(cncc1F)O CM10665 [2,0,0,0,0,0|2,0,0]=4 252 B8R1.4 c1c(cncc1O)O CM10452 [2,0,0,0,0,0|1,0,0]=3 253 B8R1.4 c1cc(cc(c1)Br)Br CM12169 [2,0,0,0,0,0|2,0,0]=4 254 B8R1.4 c1cc(cc(c1)Br)Cl CM12036 [2,0,0,0,0,0|2,0,0]=4 255 B8R1.4 c1cc(cc(c1)Br)N CM10037 [2,0,0,0,0,0|2,0,0]=4 256 B8R1.4 c1cc(cc(c1)F)N CM11453 [2,0,0,0,0,0|2,0,0]=4 257 B8R1.4 c1cc(cc(c1)F)O CM11748 [2,0,0,0,0,0|1,0,0]=3 258 B8R1.4 c1cc(cc(c1)I)Br CM12100 [2,0,0,0,0,0|2,0,0]=4 259 B8R1.4 c1cc(cc(c1)I)I CM12235 [2,0,0,0,0,0|2,0,0]=4 260 B8R1.4 c1cc(nc(c1)Br)O CM10270 [2,0,0,0,0,0|2,0,0]=4 261 B8R1.4 c1cnc(cc1I)O CM10195 [2,0,0,0,0,0|2,0,0]=4 262 B8R1.4 c1cnc(cc1O)Br CM10678 [2,0,0,0,0,0|2,0,0]=4 263 B10R1.2 CCc1cccc(c1F)O CM10380 [1,1,0,0,0,0|1,0,1]=4 264 B10R1.2 COc1cccc(c1F)O CM10645 [1,1,0,0,0,0|2,0,0]=4 265 B10R1.2 Cc1c(cccc1Cl)C=O CM11895 [1,1,0,0,0,0|1,0,0]=3 266 B10R1.2 Cc1c(cccc1F)C=O CM11971 [1,1,0,0,0,0|1,0,0]=3 267 B10R1.2 Cc1c(ccnc1C=O)Br CM10400 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.2 Cc1cccc(c1Cl)C=O CM11894 [1,1,0,0,0,0|1,0,0]=3 269 B10R1.2 Cc1cccc(c1F)C=O CM11968 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.2 c1cc(c(c(c1)Br)Br)C=O CM14314 [1,1,0,0,0,0|1,0,0]=3 271 B10R1.2 c1cc(c(c(c1)Br)F)C=O CM11840 [1,1,0,0,0,0|1,0,0]=3 272 B10R1.2 c1cc(c(c(c1)Br)O)C=O CM11851 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O CM10328 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.2 c1cc(c(c(c1)Cl)Br)CO CM10340 [1,1,0,0,0,0|1,0,1]=4 275 B10R1.2 c1cc(c(c(c1)Cl)F)C=O CM11878 [1,1,0,0,0,0|1,0,0]=3 276 B10R1.2 c1cc(c(c(c1)Cl)O)C=O CM11885 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.2 c1cc(c(c(c1)F)Br)CO CM13276 [1,1,0,0,0,0|1,0,1]=4 278 B10R1.2 c1cc(c(c(c1)F)Cl)C=O CM11875 [1,1,0,0,0,0|1,0,0]=3 279 B10R1.2 c1cc(c(c(c1)F)F)C=O CM10129 [1,1,0,0,0,0|1,0,0]=3 280 B10R1.2 c1cc(c(c(c1)F)I)C=O CM11954 [1,1,0,0,0,0|1,0,0]=3 281 B10R1.2 c1cc(c(c(c1)F)O)C=O CM10374 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.2 c1cc(c(c(c1)O)Br)C#N CM12975 [1,1,0,0,0,0|1,0,1]=4 283 B10R1.2 c1cc(c(c(c1)O)F)C#N CM10880 [1,1,0,0,0,0|1,0,1]=4 284 B10R1.2 c1cc(c(c(c1)O)F)C=O CM10470 [1,1,0,0,0,0|0,0,0]=2 285 B10R1.2 c1cc(c(c(c1)O)O)C#N CM10875 [1,1,0,0,0,0|1,0,1]=4 286 B10R1.8 COc1cc(cc(c1)Br)O CM11654 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.8 CSc1cc(cc(c1)Br)O CM10825 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.8 Cc1cc(cc(c1)Cl)C=O CM11896 [1,1,0,0,0,0|1,0,0]=3 289 B10R1.8 Cc1cc(cc(c1)F)C=O CM11973 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.8 Cc1cc(cc(c1)N)CO CM13266 [1,1,0,0,0,0|1,0,1]=4 291 B10R1.8 Cc1cc(cc(c1)O)C#N CM10560 [1,1,0,0,0,0|1,0,1]=4 292 B10R1.8 Cc1cc(cc(c1)O)C=O CM10898 [1,1,0,0,0,0|0,0,0]=2 293 B10R1.8 c1c(cc(cc1Cl)Br)C=O CM11828 [1,1,0,0,0,0|1,0,0]=3 294 B10R1.8 c1c(cc(cc1F)Br)C=O CM11841 [1,1,0,0,0,0|1,0,0]=3 295 B10R1.8 c1c(cc(cc1F)Br)CO CM13291 [1,1,0,0,0,0|1,0,1]=4 296 B10R1.8 c1c(cc(cc1F)Cl)C=O CM11880 [1,1,0,0,0,0|1,0,0]=3 297 B10R1.8 c1c(cc(cc1F)F)C=O CM11933 [1,1,0,0,0,0|1,0,0]=3 298 B10R1.8 c1c(cc(cc1F)F)CO CM13504 [1,1,0,0,0,0|1,0,1]=4 299 B10R1.8 c1c(cc(cc1F)I)C=O CM11956 [1,1,0,0,0,0|1,0,0]=3 300 B10R1.8 c1c(cc(cc1O)Cl)C#N CM13011 [1,1,0,0,0,0|1,0,1]=4 301 B10R1.8 c1c(cc(cc1O)F)C=O CM10919 [1,1,0,0,0,0|0,0,0]=2 302 B10R1.10 c1cc(cc(c1)F)CCO CM13507 [1,1,0,0,0,0|1,0,1]=4 303 B10R1.10 c1cc(cc(c1)N)CCO CM10010 [1,1,0,0,0,0|1,0,1]=4 304 B10R1.10 c1cc(cc(c1)O)CNN CM14001 [1,1,0,0,0,0|1,0,1]=4 305 B10R1.30 CCc1cc(ccc1F)O CM10379 [1,1,0,0,0,0|1,0,1]=4 306 B10R1.30 COc1cc(ccc1Cl)O CM10884 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.30 COc1cc(ccc1F)O CM11756 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.30 Cc1ccc(c(c1)C=O)F CM11970 [1,1,0,0,0,0|1,0,0]=3 309 B10R1.30 Cc1ccc(cc1C=O)Br CM11858 [1,1,0,0,0,0|1,0,0]=3 310 B10R1.30 Cc1ccc(cc1C=O)F CM11975 [1,1,0,0,0,0|1,0,0]=3 311 B10R1.30 c1cc(c(cc1Br)C=O)Cl CM11830 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.30 c1cc(c(cc1Br)C=O)F CM11844 [1,1,0,0,0,0|1,0,0]=3 313 B10R1.30 c1cc(c(cc1Br)C=O)I CM11855 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.30 c1cc(c(cc1Br)CO)Cl CM13270 [1,1,0,0,0,0|1,0,1]=4 315 B10R1.30 c1cc(c(cc1Cl)C=O)Br CM14485 [1,1,0,0,0,0|1,0,0]=3 316 B10R1.30 c1cc(c(cc1Cl)C=O)N CM11824 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.30 c1cc(c(cc1F)C=O)Br CM11838 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.30 c1cc(c(cc1F)C=O)Cl CM11877 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.30 c1cc(c(cc1F)C=O)F CM11930 [1,1,0,0,0,0|1,0,0]=3 320 B10R1.30 c1cc(c(cc1F)C=O)I CM11958 [1,1,0,0,0,0|1,0,0]=3 321 B10R1.30 c1cc(c(cc1F)C=O)O CM11952 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.30 c1cc(c(cc1F)CO)Br CM13279 [1,1,0,0,0,0|1,0,1]=4 323 B10R1.30 c1cc(c(cc1I)CO)Br CM13297 [1,1,0,0,0,0|1,0,1]=4 324 B10R1.30 c1cc(c(cc1N)CO)Cl CM13265 [1,1,0,0,0,0|1,0,1]=4 325 B10R1.30 c1cc(c(cc1O)C#N)Br CM12976 [1,1,0,0,0,0|1,0,1]=4 326 B10R1.30 c1cc(c(cc1O)C#N)Cl CM10900 [1,1,0,0,0,0|1,0,1]=4 327 B10R1.30 c1cc(c(cc1O)C#N)F CM10882 [1,1,0,0,0,0|1,0,1]=4 328 B10R1.30 c1cc(c(cc1O)C=O)F CM10372 [1,1,0,0,0,0|0,0,0]=2 329 B10R1.172 COc1cccc(c1)CCl CM10947 [1,1,0,0,0,0|1,0,1]=4 330 B10R1.172 COc1ccnc(c1)C=O CM10390 [1,1,0,0,0,0|1,0,0]=3 331 B10R1.172 c1cc(nc(c1)C=O)C=O CM14110 [1,1,0,0,0,0|1,0,1]=4 332 B10R1.172 c1cc(nc(c1)CO)CO CM14032 [1,1,0,0,0,0|1,0,1]=4 333 B10R1.176 CCc1ccc(c(c1)O)O CM10874 [1,1,0,0,0,0|1,0,1]=4 334 B10R1.176 Cc1cc(ccc1Cl)C=O CM11897 [1,1,0,0,0,0|1,0,0]=3 335 B10R1.176 Cc1cc(ccc1O)C=O CM11993 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.176 Cc1cc(cnc1O)C=O CM10161 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.176 Cc1ccc(cc1C)C=O CM11941 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.176 Cc1ccc(cc1F)C=O CM11972 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.176 c1cc(c(cc1C#N)O)Cl CM10491 [1,1,0,0,0,0|1,0,1]=4 340 B10R1.176 c1cc(c(cc1C#N)O)F CM10881 [1,1,0,0,0,0|1,0,1]=4 341 B10R1.176 c1cc(c(cc1C#N)O)I CM13121 [1,1,0,0,0,0|1,0,1]=4 342 B10R1.176 c1cc(c(cc1C=O)Br)O CM11852 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.176 c1cc(c(cc1C=O)Cl)F CM11879 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.176 c1cc(c(cc1C=O)F)Br CM11843 [1,1,0,0,0,0|1,0,0]=3 345 B10R1.176 c1cc(c(cc1C=O)F)Cl CM11882 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.176 c1cc(c(cc1C=O)F)F CM11932 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.176 c1cc(c(cc1C=O)F)I CM11955 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.176 c1cc(c(cc1C=O)F)O CM11950 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.176 c1cc(c(cc1C=O)I)Br CM10864 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.176 c1cc(c(cc1C=O)I)Cl CM10865 [1,1,0,0,0,0|1,0,0]=3 351 B10R1.176 c1cc(c(cc1C=O)I)F CM10860 [1,1,0,0,0,0|1,0,0]=3 352 B10R1.176 c1cc(c(cc1C=O)I)I CM10863 [1,1,0,0,0,0|1,0,0]=3 353 B10R1.176 c1cc(c(cc1C=O)O)Br CM11854 [1,1,0,0,0,0|0,0,0]=2 354 B10R1.176 c1cc(c(cc1C=O)O)O CM13991 [1,1,0,0,0,0|0,0,0]=2 355 B10R1.176 c1cc(c(cc1CO)F)F CM13379 [1,1,0,0,0,0|1,0,1]=4 356 B10R1.176 c1cc(c(cc1CO)O)I CM13433 [1,1,0,0,0,0|0,0,1]=3 357 B10R1.13 B(c1ccc(cc1)F)(O)O CM13569 [1,1,0,0,0,0|1,0,1]=4 358 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,1,0,0,0,0|1,0,0]=3 360 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.13 c1c(cnc(n1)C(=O)O)Br CM14286 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.13 c1c(cnc(n1)C(=O)O)Cl CM14287 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.13 c1c(cnc(n1)Cl)C(=O)O CM14062 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.13 c1cc(ccc1C(=O)Cl)Br CM12451 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.13 c1cc(ccc1C(=O)Cl)F CM12712 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.13 c1cc(ccc1C(=O)Cl)I CM12820 [1,1,0,0,0,0|1,0,0]=3 371 B10R1.13 c1cc(ccc1C(=O)N)F CM13176 [1,1,0,0,0,0|1,0,0]=3 372 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [1,1,0,0,0,0|0,0,0]=2 373 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [1,1,0,0,0,0|0,0,0]=2 374 B10R1.13 c1cc(ccc1[N+](=O)[O-])Br CM12110 [1,1,0,0,0,0|1,0,1]=4 375 B10R1.13 c1cc(ccc1[N+](=O)[O-])F CM12273 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.13 c1cc(ncc1C(=O)O)N CM10961 [1,1,0,0,0,0|1,0,0]=3 377 B10R1.13 c1cc(ncc1F)C(=O)O CM14030 [1,1,0,0,0,0|1,0,0]=3 378 B10R1.13 c1cc(ncc1I)C(=O)O CM10490 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.15 COC(=O)c1cccnc1 CM10959 [1,1,0,0,0,0|1,0,0]=3 380 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.61 CC(=O)c1ccccc1Br CM11134 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.61 CC(=O)c1ccccc1I CM11218 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.61 c1ccc(c(c1)C(=O)N)I CM13180 [1,1,0,0,0,0|1,0,0]=3 384 B10R1.61 c1ccc(c(c1)C(=O)O)F CM12709 [1,1,0,0,0,0|0,0,0]=2 385 B10R1.61 c1ccc(c(c1)C(=O)O)I CM12818 [1,1,0,0,0,0|0,0,0]=2 386 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F CM12272 [1,1,0,0,0,0|1,0,1]=4 387 B10R1.61 c1cncc(c1Br)C(=O)O CM14036 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.14 COC(=O)c1cc(sc1)Br CM10537 [0,1,0,0,1,0|2,0,0]=4 389 B10R1.59 c1c(c(sc1Br)Cl)C(=O)O CM10463 [0,1,0,0,1,0|2,0,0]=4 390 B12R1.19 Cc1ccc(cc1C)CC(=O)O CM13697 [0,1,0,0,0,1|1,0,0]=3 391 B12R1.19 c1cc(c(cc1CC(=O)O)Br)O CM13658 [0,1,0,0,0,1|1,0,0]=3 392 B12R1.19 c1cc(c(cc1CC(=O)O)F)Cl CM13673 [0,1,0,0,0,1|1,0,0]=3 393 B12R1.19 c1cc(c(cc1CC(=O)O)F)O CM13706 [0,1,0,0,0,1|1,0,0]=3 394 B12R1.50 COC(=O)Cc1cccc(c1)F CM13702 [0,1,0,0,0,1|1,0,0]=3 395 B12R1.50 COC(=O)Cc1cccc(c1)N CM13647 [0,1,0,0,0,1|1,0,0]=3 396 B12R1.101 Cc1cc(cc(c1)CC(=O)O)C CM13698 [0,1,0,0,0,1|1,0,0]=3 397 B12R1.101 c1c(cc(cc1F)Cl)CC(=O)O CM13667 [0,1,0,0,0,1|1,0,0]=3 398 B12R1.101 c1c(cc(cc1F)F)CC(=O)O CM13693 [0,1,0,0,0,1|1,0,0]=3 399 B12R1.127 c1cc(c(cc1Br)CC(=O)O)Br CM13689 [0,1,0,0,0,1|1,0,0]=3 400 B12R1.127 c1cc(c(cc1Br)CC(=O)O)F CM10070 [0,1,0,0,0,1|1,0,0]=3 401 B12R1.224 Cc1cccc(c1C)CC(=O)O CM13696 [0,1,0,0,0,1|1,0,0]=3 402 B12R1.438 CC(=O)Cc1cccc(c1)OC CM11254 [0,1,0,0,0,1|1,0,0]=3 403 B12R1.438 c1cc(cc(c1)C#N)CC(=O)O CM13683 [0,1,0,0,0,1|1,0,0]=3 404 B12R1.48 CC(=O)c1ccc(c(c1)Br)C#N CM12901 [0,2,0,0,0,0|2,0,0]=4 405 B12R1.48 CC(=O)c1ccc(c(c1)F)OC CM11203 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.48 COc1ccc(cc1F)C(=O)Cl CM12751 [0,2,0,0,0,0|2,0,0]=4 407 B12R1.48 COc1ccc(cc1F)C(=O)O CM12750 [0,2,0,0,0,0|1,0,0]=3 408 B12R1.48 Cc1cc(ccc1C#N)C(=O)C CM11174 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.48 Cc1cc(ccc1C#N)C(=O)O CM12630 [0,2,0,0,0,0|1,0,0]=3 410 B12R1.48 c1cc(c(cc1C(=O)O)Br)C=O CM10116 [0,2,0,0,0,0|1,0,0]=3 411 B12R1.48 c1cc(c(cc1C(=O)O)F)C#N CM12623 [0,2,0,0,0,0|1,0,0]=3 412 B12R1.48 c1cc(c(cc1[N+](=O)[O-])O)C=O CM10349 [0,2,0,0,0,0|1,0,1]=4 413 B12R1.56 CC(=O)c1ccc(c(c1)C#N)N CM12900 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.56 CC(=O)c1ccc(c(c1)OC)F CM11204 [0,2,0,0,0,0|1,0,0]=3 415 B12R1.56 CC(=O)c1ccc(c(c1)OC)O CM10957 [0,2,0,0,0,0|1,0,0]=3 416 B12R1.56 CCc1cc(ccc1N)C(=O)O CM12392 [0,2,0,0,0,0|1,0,0]=3 417 B12R1.56 COc1cc(ccc1Br)C(=O)O CM12524 [0,2,0,0,0,0|0,0,0]=2 418 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] CM11659 [0,2,0,0,0,0|1,0,1]=4 419 B12R1.56 COc1cc(ccc1Cl)C(=O)O CM12590 [0,2,0,0,0,0|0,0,0]=2 420 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] CM11693 [0,2,0,0,0,0|1,0,1]=4 421 B12R1.56 COc1cc(ccc1F)C(=O)O CM12753 [0,2,0,0,0,0|0,0,0]=2 422 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] CM11767 [0,2,0,0,0,0|1,0,1]=4 423 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] CM11784 [0,2,0,0,0,0|1,0,1]=4 424 B12R1.56 COc1cc(ccc1N)C(=O)O CM12425 [0,2,0,0,0,0|0,0,0]=2 425 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] CM11601 [0,2,0,0,0,0|1,0,1]=4 426 B12R1.56 c1cc(c(cc1C(=O)O)C#N)O CM10476 [0,2,0,0,0,0|1,0,0]=3 427 B12R1.56 c1cc(c(cc1[N+](=O)[O-])CO)F CM13419 [0,2,0,0,0,0|1,0,1]=4 428 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F CM11140 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.232 CC(=O)c1cc(c(cc1F)F)F CM11233 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)O CM12509 [0,2,0,0,0,0|1,0,0]=3 431 B12R1.232 Cc1cc(c(cc1C(=O)O)Br)C CM10198 [0,2,0,0,0,0|1,0,0]=3 432 B12R1.232 Cc1cc(c(cc1C)N)C(=O)O CM12386 [0,2,0,0,0,0|1,0,0]=3 433 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)O CM12506 [0,2,0,0,0,0|1,0,0]=3 434 B12R1.232 Cc1cc(c(cc1F)C(=O)O)Br CM12508 [0,2,0,0,0,0|1,0,0]=3 435 B12R1.232 Cc1cc(c(cc1I)C(=O)O)O CM12804 [0,2,0,0,0,0|1,0,0]=3 436 B12R1.232 Cc1cc(c(cc1O)C(=O)O)F CM12728 [0,2,0,0,0,0|0,0,0]=2 437 B12R1.232 c1c(c(cc(c1Br)Br)N)C(=O)O CM12366 [0,2,0,0,0,0|1,0,0]=3 438 B12R1.232 c1c(c(cc(c1Br)Cl)F)C(=O)O CM12468 [0,2,0,0,0,0|1,0,0]=3 439 B12R1.232 c1c(c(cc(c1Cl)Cl)N)C(=O)O CM12368 [0,2,0,0,0,0|1,0,0]=3 440 B12R1.232 c1c(c(cc(c1Cl)F)F)C(=O)O CM12570 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.232 c1c(c(cc(c1F)Br)Cl)C(=O)O CM12467 [0,2,0,0,0,0|1,0,0]=3 442 B12R1.232 c1c(c(cc(c1F)Br)F)C(=O)O CM12480 [0,2,0,0,0,0|1,0,0]=3 443 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)Cl CM12645 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O CM12644 [0,2,0,0,0,0|1,0,0]=3 445 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)Cl CM12569 [0,2,0,0,0,0|2,0,0]=4 446 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)O CM12568 [0,2,0,0,0,0|1,0,0]=3 447 B12R1.232 c1c(c(cc(c1F)F)Br)C(=O)O CM12477 [0,2,0,0,0,0|1,0,0]=3 448 B12R1.232 c1c(c(cc(c1F)F)Cl)C(=O)O CM12562 [0,2,0,0,0,0|1,0,0]=3 449 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)Cl CM12881 [0,2,0,0,0,0|2,0,0]=4 450 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O CM12880 [0,2,0,0,0,0|1,0,0]=3 451 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)[O-] CM12879 [0,2,0,0,0,0|1,0,1]=4 452 B12R1.232 c1c(c(cc(c1F)F)N)C(=O)O CM12375 [0,2,0,0,0,0|1,0,0]=3 453 B12R1.232 c1c(c(cc(c1N)Cl)Cl)C(=O)O CM12371 [0,2,0,0,0,0|1,0,0]=3 454 B12R1.232 c1c(c(cc(c1O)Br)F)[N+](=O)[O-] CM11645 [0,2,0,0,0,0|1,0,1]=4 455 B12R1.232 c1c(c(cc(c1O)Cl)Cl)[N+](=O)[O-] CM11720 [0,2,0,0,0,0|1,0,1]=4 456 B12R1.232 c1c(c(cc(c1O)Cl)F)[N+](=O)[O-] CM11685 [0,2,0,0,0,0|1,0,1]=4 457 B12R1.232 c1c(c(cc(c1O)F)F)[N+](=O)[O-] CM11734 [0,2,0,0,0,0|1,0,1]=4 458 B12R1.367 COC(=O)c1ccc(c(c1)Br)I CM12516 [0,2,0,0,0,0|1,0,0]=3 459 B12R1.367 COC(=O)c1ccc(c(c1)F)N CM12406 [0,2,0,0,0,0|1,0,0]=3 460 B12R1.367 COC(=O)c1ccc(c(c1)I)N CM12418 [0,2,0,0,0,0|1,0,0]=3 461 B12R1.367 COC(=O)c1ccc(c(c1)I)O CM10364 [0,2,0,0,0,0|1,0,0]=3 462 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CM12352 [0,2,0,0,0,0|1,0,0]=3 463 B12R1.367 COC(=O)c1ccc(c(c1)N)O CM12415 [0,2,0,0,0,0|1,0,0]=3 464 B12R1.367 COC(=O)c1ccc(c(c1)O)N CM12416 [0,2,0,0,0,0|0,0,0]=2 465 B12R1.367 c1cc(c(cc1C(=O)CCl)F)F CM11157 [0,2,0,0,0,0|2,0,0]=4 466 B12R1.893 CC(=O)c1ccc(c(c1F)F)F CM11230 [0,2,0,0,0,0|2,0,0]=4 467 B12R1.893 Cc1c(c(ccc1C(=O)O)N)C CM12387 [0,2,0,0,0,0|1,0,0]=3 468 B12R1.893 Cc1ccc(c(c1C)N)C(=O)O CM12384 [0,2,0,0,0,0|1,0,0]=3 469 B12R1.893 c1cc(c(c(c1C(=O)Cl)F)F)F CM12873 [0,2,0,0,0,0|2,0,0]=4 470 B12R1.893 c1cc(c(c(c1C(=O)O)Br)F)F CM12473 [0,2,0,0,0,0|1,0,0]=3 471 B12R1.893 c1cc(c(c(c1C(=O)O)Cl)Cl)F CM12643 [0,2,0,0,0,0|1,0,0]=3 472 B12R1.893 c1cc(c(c(c1C(=O)O)F)Cl)F CM12565 [0,2,0,0,0,0|1,0,0]=3 473 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br CM12479 [0,2,0,0,0,0|1,0,0]=3 474 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)F CM12872 [0,2,0,0,0,0|1,0,0]=3 475 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N CM12380 [0,2,0,0,0,0|1,0,0]=3 476 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)O CM12668 [0,2,0,0,0,0|1,0,0]=3 477 B12R1.893 c1cc(c(c(c1C(=O)O)F)O)F CM12670 [0,2,0,0,0,0|0,0,0]=2 478 B12R1.893 c1cc(c(c(c1C(=O)O)N)F)F CM12372 [0,2,0,0,0,0|1,0,0]=3 479 B12R1.893 c1cc(c(c(c1C(=O)O)O)F)F CM12673 [0,2,0,0,0,0|1,0,0]=3 480 B12R1.893 c1cc(c(c(c1C(=O)[O-])F)F)F CM12871 [0,2,0,0,0,0|1,0,1]=4 481 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)Br CM11178 [0,2,0,0,0,0|2,0,0]=4 482 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)N)Cl CM11124 [0,2,0,0,0,0|2,0,0]=4 483 B12R1.1005 Cc1c(cc(cc1F)C(=O)O)N CM12412 [0,2,0,0,0,0|1,0,0]=3 484 B12R1.1005 Cc1c(cc(cc1F)C(=O)O)O CM12729 [0,2,0,0,0,0|0,0,0]=2 485 B12R1.1005 Cc1cc(cc(c1Br)C)C(=O)O CM12485 [0,2,0,0,0,0|1,0,0]=3 486 B12R1.1005 Cc1cc(cc(c1F)F)C(=O)O CM10075 [0,2,0,0,0,0|1,0,0]=3 487 B12R1.1005 Cc1cc(cc(c1N)C)C(=O)O CM12390 [0,2,0,0,0,0|1,0,0]=3 488 B12R1.1005 c1c(cc(c(c1Br)N)Br)C(=O)O CM12367 [0,2,0,0,0,0|1,0,0]=3 489 B12R1.1005 c1c(cc(c(c1Cl)Cl)Cl)C(=O)O CM12870 [0,2,0,0,0,0|1,0,0]=3 490 B12R1.1005 c1c(cc(c(c1Cl)F)Cl)C(=O)O CM12649 [0,2,0,0,0,0|1,0,0]=3 491 B12R1.1005 c1c(cc(c(c1Cl)N)Cl)C(=O)O CM12370 [0,2,0,0,0,0|1,0,0]=3 492 B12R1.1005 c1c(cc(c(c1F)F)Br)C(=O)O CM12478 [0,2,0,0,0,0|1,0,0]=3 493 B12R1.1005 c1c(cc(c(c1F)F)Cl)C(=O)O CM10074 [0,2,0,0,0,0|1,0,0]=3 494 B12R1.1005 c1c(cc(c(c1F)F)F)C(=O)O CM12884 [0,2,0,0,0,0|1,0,0]=3 495 B12R1.1005 c1c(cc(c(c1F)N)F)C(=O)O CM12381 [0,2,0,0,0,0|1,0,0]=3 496 B12R1.1005 c1c(cc(c(c1F)O)F)C(=O)O CM12674 [0,2,0,0,0,0|1,0,0]=3 497 B12R1.1005 c1c(cc(c(c1O)Br)F)[N+](=O)[O-] CM11644 [0,2,0,0,0,0|1,0,1]=4 498 B12R1.17 CCOC(=O)c1cc(cnc1)Br CM14116 [0,2,0,0,0,0|2,0,0]=4 499 B12R1.24 COC(=O)c1cccc(c1F)Br CM12492 [0,2,0,0,0,0|1,0,0]=3 500 B12R1.24 COC(=O)c1cccc(c1F)N CM12401 [0,2,0,0,0,0|1,0,0]=3 501 B12R1.24 COC(=O)c1cccc(c1N)Br CM12346 [0,2,0,0,0,0|1,0,0]=3 502 B12R1.24 COC(=O)c1cccc(c1N)Cl CM12357 [0,2,0,0,0,0|1,0,0]=3 503 B12R1.24 COC(=O)c1cccc(c1N)F CM12393 [0,2,0,0,0,0|1,0,0]=3 504 B12R1.24 COC(=O)c1cccc(c1N)N CM12633 [0,2,0,0,0,0|1,0,0]=3 505 B12R1.24 COC(=O)c1cccc(c1N)O CM12414 [0,2,0,0,0,0|0,0,0]=2 506 B12R1.24 COC(=O)c1cccc(c1O)Br CM12511 [0,2,0,0,0,0|1,0,0]=3 507 B12R1.24 COC(=O)c1cccc(c1O)F CM12719 [0,2,0,0,0,0|1,0,0]=3 508 B12R1.24 Cc1c(cccc1Br)C(=O)OC CM12534 [0,2,0,0,0,0|1,0,0]=3 509 B12R1.24 Cc1c(cccc1N)C(=O)OC CM12427 [0,2,0,0,0,0|1,0,0]=3 510 B12R1.24 Cc1cccc(c1Br)C(=O)OC CM12529 [0,2,0,0,0,0|1,0,0]=3 511 B12R1.24 Cc1cccc(c1F)C(=O)OC CM12757 [0,2,0,0,0,0|1,0,0]=3 512 B12R1.24 c1cc(c(c(c1)F)N)C(=O)C=O CM13865 [0,2,0,0,0,0|1,0,1]=4 513 B12R1.354 COC(=O)c1cc(ccc1Br)F CM12489 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.354 COC(=O)c1cc(ccc1Cl)Br CM12466 [0,2,0,0,0,0|1,0,0]=3 515 B12R1.354 COC(=O)c1cc(ccc1F)Br CM12503 [0,2,0,0,0,0|1,0,0]=3 516 B12R1.354 COC(=O)c1cc(ccc1F)I CM12734 [0,2,0,0,0,0|1,0,0]=3 517 B12R1.354 COC(=O)c1cc(ccc1I)Br CM12520 [0,2,0,0,0,0|1,0,0]=3 518 B12R1.354 COC(=O)c1cc(ccc1N)Br CM12350 [0,2,0,0,0,0|1,0,0]=3 519 B12R1.354 COC(=O)c1cc(ccc1N)F CM12397 [0,2,0,0,0,0|1,0,0]=3 520 B12R1.354 Cc1ccc(cc1C(=O)OC)Br CM12536 [0,2,0,0,0,0|1,0,0]=3 521 B12R1.354 Cc1ccc(cc1C(=O)OC)F CM12768 [0,2,0,0,0,0|1,0,0]=3 522 B12R1.354 Cc1ccc(cc1C(=O)OC)I CM12826 [0,2,0,0,0,0|1,0,0]=3 523 B12R1.354 Cc1ccc(cc1C(=O)OC)O CM12807 [0,2,0,0,0,0|0,0,0]=2 524 B12R1.354 c1cc(c(cc1F)C(=O)CCl)F CM11156 [0,2,0,0,0,0|2,0,0]=4 525 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)Cl CM11250 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.358 COC(=O)c1cc(cc(c1)I)Br CM12517 [0,2,0,0,0,0|1,0,0]=3 527 B12R1.358 Cc1cc(cc(n1)Cl)C(=O)OC CM11010 [0,2,0,0,0,0|2,0,0]=4 528 B12R1.435 COC(=O)c1cccc(c1)C#N CM12614 [0,2,0,0,0,0|1,0,0]=3 529 B12R1.435 COC(=O)c1cccc(c1)CN CM12426 [0,2,0,0,0,0|1,0,0]=3 530 B12R1.435 COC(=O)c1cccc(c1)SCl CM13757 [0,2,0,0,0,0|0,1,0]=3 531 B12R1.435 COC(=O)c1cccc(n1)CO CM13855 [0,2,0,0,0,0|1,0,0]=3 532 B12R1.435 c1cc(cc(c1)C(=O)CBr)C#N CM11137 [0,2,0,0,0,0|2,0,0]=4 533 B12R1.11 COc1cc(cc(c1)Cl)C(=O)O CM10215 [0,2,0,0,0,0|0,0,0]=2 534 B12R1.11 COc1cc(cc(c1)I)C(=O)O CM10399 [0,2,0,0,0,0|0,0,0]=2 535 B12R1.11 COc1cc(cc(c1)N)C(=O)O CM10398 [0,2,0,0,0,0|0,0,0]=2 536 B12R1.11 Cc1cc(cc(c1)C(=O)O)C#N CM12628 [0,2,0,0,0,0|1,0,0]=3 537 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])CO CM13447 [0,2,0,0,0,0|1,0,1]=4 538 B12R1.11 c1c(cc(cc1C(=O)O)Br)C=O CM10142 [0,2,0,0,0,0|0,0,1]=3 539 B12R1.11 c1c(cc(cc1C(=O)O)O)C#N CM10204 [0,2,0,0,0,0|0,0,0]=2 540 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)Cl CM11183 [0,2,0,0,0,0|2,0,0]=4 541 B12R1.511 CC(=O)c1cc(cc(c1F)F)F CM11231 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.511 Cc1cc(c(c(c1)C(=O)O)N)C CM12385 [0,2,0,0,0,0|1,0,0]=3 543 B12R1.511 Cc1cc(c(c(c1)F)F)C(=O)O CM12681 [0,2,0,0,0,0|1,0,0]=3 544 B12R1.511 c1c(cc(c(c1C(=O)O)Br)F)F CM12474 [0,2,0,0,0,0|1,0,0]=3 545 B12R1.511 c1c(cc(c(c1C(=O)O)Cl)F)F CM12561 [0,2,0,0,0,0|1,0,0]=3 546 B12R1.511 c1c(cc(c(c1C(=O)O)F)Cl)Cl CM12648 [0,2,0,0,0,0|1,0,0]=3 547 B12R1.511 c1c(cc(c(c1C(=O)O)F)F)Br CM12482 [0,2,0,0,0,0|1,0,0]=3 548 B12R1.511 c1c(cc(c(c1C(=O)O)F)F)F CM12874 [0,2,0,0,0,0|1,0,0]=3 549 B12R1.511 c1c(cc(c(c1C(=O)O)O)Br)Br CM12639 [0,2,0,0,0,0|1,0,0]=3 550 B12R1.511 c1c(cc(c(c1C(=O)O)O)Cl)Cl CM12653 [0,2,0,0,0,0|1,0,0]=3 551 B12R1.128 c1cc(c(cc1O)S(=O)(=O)[O-])O CM14383 [0,2,0,0,0,0|1,0,1]=4 552 B12R1.436 COc1cccc(c1)S(=O)(=O)Cl CM13641 [0,2,0,0,0,0|1,0,1]=4 553 B12R1.87 COc1c(cccc1F)C(=O)O CM12749 [0,2,0,0,0,0|1,0,0]=3 554 B12R1.440 CC(=O)c1cccc(c1O)C#N CM10368 [0,2,0,0,0,0|2,0,0]=4 555 B12R1.440 CCc1cccc(c1N)C(=O)O CM10234 [0,2,0,0,0,0|1,0,0]=3 556 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] CM11658 [0,2,0,0,0,0|1,0,1]=4 557 B12R1.440 COc1cccc(c1Cl)C(=O)O CM12588 [0,2,0,0,0,0|0,0,0]=2 558 B12R1.440 COc1cccc(c1F)C(=O)O CM12743 [0,2,0,0,0,0|0,0,0]=2 559 B12R1.440 COc1cccc(c1N)C(=O)O CM12420 [0,2,0,0,0,0|0,0,0]=2 560 B12R1.440 COc1cccc(c1N)[N+](=O)[O-] CM11599 [0,2,0,0,0,0|1,0,1]=4 561 B12R1.440 Cc1c(cccc1OC)C(=O)O CM12830 [0,2,0,0,0,0|0,0,0]=2 562 B12R1.440 c1cc(c(c(c1)C(=O)O)F)C#N CM10172 [0,2,0,0,0,0|1,0,0]=3 563 B12R1.440 c1cc(c(c(c1)C(=O)O)F)CO CM10072 [0,2,0,0,0,0|0,0,0]=2 564 B12R1.440 c1cc(c(c(c1)C(=O)O)N)C#N CM10170 [0,2,0,0,0,0|1,0,0]=3 565 B12R1.440 c1cc(c(c(c1)C(=O)O)O)C#N CM10553 [0,2,0,0,0,0|1,0,0]=3 566 B12R1.440 c1cc(c(c(c1)[N+](=O)[O-])F)CO CM13416 [0,2,0,0,0,0|1,0,1]=4 567 B12R1.894 CC(=O)c1c(ccc(c1F)F)F CM11232 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.894 c1cc(c(c(c1F)C(=O)Cl)F)F CM12876 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.894 c1cc(c(c(c1F)C(=O)O)Br)F CM12475 [0,2,0,0,0,0|1,0,0]=3 570 B12R1.894 c1cc(c(c(c1F)C(=O)O)F)Cl CM12566 [0,2,0,0,0,0|1,0,0]=3 571 B12R1.894 c1cc(c(c(c1F)C(=O)O)F)F CM12875 [0,2,0,0,0,0|1,0,0]=3 572 B12R1.894 c1cc(c(c(c1F)Cl)C(=O)O)Cl CM12647 [0,2,0,0,0,0|1,0,0]=3 573 B12R1.894 c1cc(c(c(c1F)F)C(=O)O)Br CM12483 [0,2,0,0,0,0|1,0,0]=3 574 B12R1.894 c1cc(c(c(c1N)C(=O)O)F)F CM12382 [0,2,0,0,0,0|1,0,0]=3 575 B12R1.894 c1cc(c(c(c1N)F)C(=O)O)F CM12378 [0,2,0,0,0,0|1,0,0]=3 576 B12R1.46 COc1ccc(cc1C(=O)O)F CM10931 [0,2,0,0,0,0|1,0,0]=3 577 B12R1.46 c1cc(c(cc1Br)C(=O)O)C#N CM12472 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.453 COc1ccc(c(c1)C(=O)O)Cl CM12589 [0,2,0,0,0,0|0,0,0]=2 579 B12R1.453 COc1ccc(c(c1)C(=O)O)F CM12746 [0,2,0,0,0,0|0,0,0]=2 580 B12R1.453 COc1ccc(c(c1)C(=O)O)N CM12423 [0,2,0,0,0,0|0,0,0]=2 581 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Br CM11663 [0,2,0,0,0,0|1,0,1]=4 582 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])N CM11602 [0,2,0,0,0,0|1,0,1]=4 583 B12R1.453 Cc1ccc(cc1C(=O)O)OC CM12834 [0,2,0,0,0,0|0,0,0]=2 584 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])OC CM11788 [0,2,0,0,0,0|1,0,1]=4 585 B12R1.453 c1cc(c(cc1C#N)C(=O)O)Br CM12469 [0,2,0,0,0,0|1,0,0]=3 586 B12R1.453 c1cc(c(cc1C#N)C(=O)O)F CM12625 [0,2,0,0,0,0|1,0,0]=3 587 B12R1.453 c1cc(c(cc1C#N)C(=O)O)I CM10354 [0,2,0,0,0,0|1,0,0]=3 588 B12R1.453 c1cc(c(cc1CO)[N+](=O)[O-])O CM13434 [0,2,0,0,0,0|1,0,1]=4 589 B12R1.258 CC(=O)c1cccc(c1)C(=O)O CM12340 [0,2,0,0,0,0|0,0,1]=3 590 B12R1.258 CC(=O)c1cccc(c1)[N+](=O)[O-] CM14382 [0,2,0,0,0,0|1,0,1]=4 591 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 CM14303 [0,0,0,1,0,1|2,0,0]=4 592 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 CM14308 [0,0,0,1,0,1|2,0,0]=4 593 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 CM14306 [0,0,0,1,0,1|2,0,0]=4 594 B12R2.202 c1cc2c(c(c1)F)NC(=O)C2 CM14365 [0,0,0,1,0,1|2,0,0]=4 595 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 CM14289 [0,0,0,1,0,1|2,0,0]=4 596 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 CM14364 [0,0,0,1,0,1|2,0,0]=4 597 B12R2.606 c1cc2c(cc1Br)nc(o2)N CM10622 [0,0,0,1,0,1|2,0,0]=4 598 B12R2.606 c1cc2c(cc1F)NC(=O)C2 CM14302 [0,0,0,1,0,1|2,0,0]=4 599 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 CM14374 [0,1,0,1,0,0|2,0,0]=4 600 B12R2.132 c1cc2c(cc1Br)C(=O)CO2 CM10486 [0,1,0,1,0,0|1,0,0]=3 601 B12R2.132 c1cc2c(cc1Br)C(=O)CO2 CM10771 [0,1,0,1,0,0|1,0,0]=3 602 B12R2.132 c1cc2c(cc1Br)C(=O)NC2 CM10602 [0,1,0,1,0,0|2,0,0]=4 603 B12R2.132 c1cc2c(cc1Cl)C(=O)CO2 CM10770 [0,1,0,1,0,0|1,0,0]=3 604 B12R2.196 c1cc2c(c(c1)Br)CCC2=O CM10103 [0,1,0,1,0,0|2,0,0]=4 605 B12R2.196 c1cc2c(c(c1)Cl)CCC2=O CM10362 [0,1,0,1,0,0|2,0,0]=4 606 B12R2.196 c1cc2c(c(c1)F)CCC2=O CM10386 [0,1,0,1,0,0|2,0,0]=4 607 B8R1.11 c1csc(c1C=O)Br CM10421 [1,0,0,0,1,0|2,0,0]=4 608 B8R1.7 c1c(nc[nH]1)C(=O)O CM14067 [1,0,0,0,1,0|2,0,0]=4 609 B8R1.7 c1cn[nH]c1C(=O)O CM11038 [1,0,0,0,1,0|2,0,0]=4 610 B12R1.226 c1cc(cc(c1)Br)C=CC(=O)O CM13573 [0,0,0,0,0,2|1,0,0]=3