0 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.13 NC(=O)c1ccc(cn1)Br CSC011219284 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 NC(=O)c1ccc(cn1)Cl CSC011834066 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 NC(=O)c1ccc(cn1)F CSC012180490 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.3 CCc1ccc(cc1)C(=O)N CSC000162293 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.3 CNc1ccc(cc1)C(=O)N CSC000220534 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.3 COc1ccc(cn1)C(=O)N CSC000234233 [0,1,0,0,0,0|1,0,2]=4 14 B11R1.3 NC(=O)c1ccc(cc1)C=C CSC000123571 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.21 Cc1cc(ccc1Br)C(=O)N CSC011218126 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.21 Cc1cc(ccc1F)C(=O)N CSC011217366 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.21 Cc1ccc(cc1Br)C(=O)N CSC000186401 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.21 Cc1ccc(cc1C)C(=O)N CSC000162321 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.21 Cc1ccc(cc1Cl)C(=O)N CSC011219532 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.21 Cc1ccc(cc1F)C(=O)N CSC000216902 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.21 Cc1ccc(cc1I)C(=O)N CSC000012956 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.21 NC(=O)c1ccc(c(c1)Br)Cl CSC012357840 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.21 NC(=O)c1ccc(c(c1)Br)F CSC011202321 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Br CSC012348002 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Cl CSC000162198 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.21 NC(=O)c1ccc(c(c1)Cl)F CSC011216305 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.21 NC(=O)c1ccc(c(c1)Cl)I CSC012348003 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.21 NC(=O)c1ccc(c(c1)F)Br CSC000686215 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.21 NC(=O)c1ccc(c(c1)F)Cl CSC011202322 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.21 NC(=O)c1ccc(c(c1)F)F CSC000194243 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.22 CNC(=O)c1ccc(cc1)C CSC000159850 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.22 CNC(=O)c1ccc(cc1)Cl CSC000159809 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.22 CNC(=O)c1ccc(cc1)F CSC000159806 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.22 COC(=O)C1=NNC(=O)CC1 CSC000148103 [0,1,0,0,0,0|1,0,2]=4 35 B11R1.22 COC(=O)c1cc[n+](cc1)[O-] CSC000000494 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.22 COC(=O)c1ccc(cc1)Cl CSC000150334 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.22 COC(=O)c1ccc(cc1)F CSC000150329 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.22 COC(=O)c1ccc(cn1)Br CSC000697650 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.22 COC(=O)c1ccc(cn1)Cl CSC000743185 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.22 COC(=O)c1ccc(cn1)F CSC012017284 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.22 COC(=O)c1ccc(nc1)C CSC000740734 [0,1,0,0,0,0|1,0,1]=3 42 B11R1.22 COC(=O)c1ccc(nc1)F CSC011934332 [0,1,0,0,0,0|1,0,1]=3 43 B11R1.22 COC(=O)c1cnc(cn1)C CSC000149074 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.22 Cc1ccc(cn1)C(=O)NN CSC011193134 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.22 NNC(=O)c1ccc(cc1)I CSC000189773 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.22 NNC(=O)c1ccc(cc1)N CSC000186298 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.166 Cc1cc(ccc1C(=O)N)Br CSC011327924 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.166 Cc1cc(ccc1C(=O)N)F CSC011997080 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.166 Cc1ccc(c(c1)C)C(=O)N CSC000162304 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)N CSC012178794 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.166 Cc1ccc(c(c1)F)C(=O)N CSC000686557 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.166 NC(=O)c1ccc(cc1Br)Br CSC012769498 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.166 NC(=O)c1ccc(cc1Br)Cl CSC012347284 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.166 NC(=O)c1ccc(cc1Cl)Cl CSC000162194 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.166 NC(=O)c1ccc(cc1Cl)F CSC000162332 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.166 NC(=O)c1ccc(cc1Cl)I CSC000060398 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.166 NC(=O)c1ccc(cc1F)Br CSC000216903 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.166 NC(=O)c1ccc(cc1F)Cl CSC000216909 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.166 NC(=O)c1ccc(cc1F)F CSC000162284 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.166 NC(=O)c1ccc(cc1O)Cl CSC000192836 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.166 NC(=O)c1ccc(cc1O)O CSC011933943 [0,1,0,0,0,0|2,0,1]=4 62 B9R1.35 Cc1csc(c1)C(=O)N CSC000068353 [0,0,0,0,1,0|3,0,0]=4 63 B9R1.35 NC(=O)c1cc(c[nH]1)Br CSC000229580 [0,0,0,0,1,0|3,0,0]=4 64 B9R1.35 NC(=O)c1cc(cs1)Br CSC009812991 [0,0,0,0,1,0|3,0,0]=4 65 B9R1.35 NC(=O)c1ccc(o1)Br CSC000162236 [0,0,0,0,1,0|3,0,0]=4 66 B9R1.35 NC(=O)c1ccc(s1)Cl CSC000162217 [0,0,0,0,1,0|3,0,0]=4 67 B11R1.20 CC(=O)Nc1ccc(cc1)Br CSC000153570 [0,0,0,0,0,1|3,0,0]=4 68 B11R1.20 CC(=O)Nc1ccc(cc1)Cl CSC000154020 [0,0,0,0,0,1|3,0,0]=4 69 B11R1.20 CC(=O)Oc1ccc(cc1)Br CSC009811594 [0,0,0,0,0,1|3,0,0]=4 70 B11R1.20 CC(=O)Oc1ccc(cc1)C CSC000001885 [0,0,0,0,0,1|3,0,0]=4 71 B11R1.20 CC(=O)Oc1ccc(cc1)Cl CSC000001863 [0,0,0,0,0,1|3,0,0]=4 72 B11R1.20 CC(=O)Oc1ccc(cc1)F CSC000001924 [0,0,0,0,0,1|3,0,0]=4 73 B11R1.20 Cc1ccc(cc1)CC(=O)N CSC000206417 [0,0,0,0,0,1|3,0,0]=4 74 B11R1.20 NC(=O)Cc1ccc(cc1)Br CSC000162331 [0,0,0,0,0,1|3,0,0]=4 75 B11R1.20 NC(=O)Cc1ccc(cc1)F CSC000162278 [0,0,0,0,0,1|3,0,0]=4 76 B11R1.20 NC(=O)Cc1ccc(cc1)O CSC000020825 [0,0,0,0,0,1|2,0,1]=4 77 B11R1.20 NC(=O)Nc1ccc(cc1)Br CSC000198584 [0,0,0,0,0,1|3,0,0]=4 78 B11R1.20 NC(=O)Nc1ccc(cc1)F CSC000222807 [0,0,0,0,0,1|3,0,0]=4 79 B10R1.15 ONC(=O)c1cccnc1 CSC000190125 [1,1,0,0,0,0|0,0,1]=3 80 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.61 NC(=O)c1cccnc1F CSC012002233 [1,1,0,0,0,0|1,0,1]=4 84 B10R1.113 NC(=O)c1cccc(c1)Br CSC000162208 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.113 NC(=O)c1cccc(c1)I CSC000162231 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.113 NC(=O)c1cncc(c1)Br CSC000162242 [1,1,0,0,0,0|1,0,1]=4 87 B10R1.113 NC(=O)c1cncc(c1)F CSC011996012 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.14 COC(=O)c1cc(c[nH]1)Br CSC000205823 [0,1,0,0,1,0|2,0,0]=4 89 B10R1.14 COC(=O)c1cc(c[nH]1)F CSC000100949 [0,1,0,0,1,0|2,0,0]=4 90 B10R1.14 COC(=O)c1cc(co1)Br CSC009992624 [0,1,0,0,1,0|2,0,0]=4 91 B10R1.14 COC(=O)c1cc(cs1)Br CSC009815473 [0,1,0,0,1,0|2,0,0]=4 92 B10R1.14 COC(=O)c1cc(cs1)C CSC000040733 [0,1,0,0,1,0|2,0,0]=4 93 B10R1.14 COC(=O)c1ccc(o1)C CSC000151062 [0,1,0,0,1,0|2,0,0]=4 94 B10R1.14 COC(=O)c1ccc(o1)Cl CSC000191419 [0,1,0,0,1,0|2,0,0]=4 95 B10R1.14 COC(=O)c1ccc(s1)Br CSC000148107 [0,1,0,0,1,0|2,0,0]=4 96 B10R1.14 COC(=O)c1ccc(s1)C CSC000150765 [0,1,0,0,1,0|2,0,0]=4 97 B10R1.14 COC(=O)c1ccc(s1)Cl CSC000148076 [0,1,0,0,1,0|2,0,0]=4 98 B10R1.14 COC(=O)c1coc(c1)C CSC012017277 [0,1,0,0,1,0|2,0,0]=4 99 B10R1.14 COC(=O)c1csc(c1)Br CSC000692058 [0,1,0,0,1,0|2,0,0]=4 100 B10R1.58 NC(=O)c1cc(c([nH]1)Cl)Cl CSC000026179 [0,1,0,0,1,0|2,0,0]=4 101 B12R1.49 COC(=O)Cc1ccc(cc1)Br CSC000149743 [0,1,0,0,0,1|2,0,0]=4 102 B12R1.49 COC(=O)Cc1ccc(cc1)C CSC000204387 [0,1,0,0,0,1|2,0,0]=4 103 B12R1.49 COC(=O)Cc1ccc(cc1)F CSC000148989 [0,1,0,0,0,1|2,0,0]=4 104 B12R1.49 COC(=O)Cc1ccc(cc1)I CSC012356276 [0,1,0,0,0,1|2,0,0]=4 105 B12R1.49 COC(=O)Cc1ccc(cc1)O CSC000211648 [0,1,0,0,0,1|1,0,1]=4 106 B12R1.49 COC(=O)Cc1ccc(nc1)C CSC000050249 [0,1,0,0,0,1|1,0,1]=4 107 B12R1.49 Cc1ccc(cc1)NC(=O)CO CSC000246325 [0,1,0,0,0,1|2,0,0]=4 108 B12R1.5 CCc1ccc(cc1)C(=O)OC CSC000149224 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.5 CNc1ccc(cc1)C(=O)OC CSC000220287 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.5 COC(=O)c1ccc(cc1)C#N CSC000148855 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.5 COC(=O)c1ccc(cc1)C=C CSC000061247 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.5 COC(=O)c1ccc(cc1)CO CSC000151488 [0,2,0,0,0,0|1,0,1]=4 113 B12R1.5 COC(=O)c1ccc(cc1)OC CSC000150779 [0,2,0,0,0,0|1,0,1]=4 114 B12R1.5 COC(=O)c1ccc(cc1)SC CSC000175311 [0,2,0,0,0,0|1,1,0]=4 115 B12R1.5 COC(=O)c1ccc(nc1)OC CSC000181318 [0,2,0,0,0,0|0,0,2]=4 116 B12R1.256 NC(=O)c1ccc(cc1)C(=O)N CSC000175741 [0,2,0,0,0,0|2,0,0]=4 117 B12R1.256 NC(=O)c1ccc(cc1)[N+](=O)[O-] CSC000162182 [0,2,0,0,0,0|2,0,0]=4 118 B12R1.256 NC(=O)c1ccc(nc1)C(=O)N CSC000056232 [0,2,0,0,0,0|1,0,1]=4 119 B12R1.367 COC(=O)c1ccc(=O)n(c1)C CSC000054066 [0,2,0,0,0,0|0,0,0]=2 120 B12R1.367 COC(=O)c1ccc(=O)n(n1)C CSC011315517 [0,2,0,0,0,0|1,0,0]=3 121 B12R1.367 COC(=O)c1ccc(c(c1)Br)Cl CSC012356255 [0,2,0,0,0,0|2,0,0]=4 122 B12R1.367 COC(=O)c1ccc(c(c1)Br)F CSC000722584 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.367 COC(=O)c1ccc(c(c1)Br)I CSC011294788 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.367 COC(=O)c1ccc(c(c1)C)Br CSC011215878 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.367 COC(=O)c1ccc(c(c1)C)C CSC000149473 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.367 COC(=O)c1ccc(c(c1)C)Cl CSC011217186 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.367 COC(=O)c1ccc(c(c1)C)F CSC000698631 [0,2,0,0,0,0|2,0,0]=4 128 B12R1.367 COC(=O)c1ccc(c(c1)C)O CSC011997373 [0,2,0,0,0,0|1,0,1]=4 129 B12R1.367 COC(=O)c1ccc(c(c1)Cl)Br CSC012359697 [0,2,0,0,0,0|2,0,0]=4 130 B12R1.367 COC(=O)c1ccc(c(c1)Cl)C CSC011219533 [0,2,0,0,0,0|2,0,0]=4 131 B12R1.367 COC(=O)c1ccc(c(c1)Cl)F CSC011997363 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.367 COC(=O)c1ccc(c(c1)Cl)I CSC012356344 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.367 COC(=O)c1ccc(c(c1)Cl)N CSC000704683 [0,2,0,0,0,0|2,0,0]=4 134 B12R1.367 COC(=O)c1ccc(c(c1)F)Br CSC000703229 [0,2,0,0,0,0|2,0,0]=4 135 B12R1.367 COC(=O)c1ccc(c(c1)F)C CSC000216653 [0,2,0,0,0,0|2,0,0]=4 136 B12R1.367 COC(=O)c1ccc(c(c1)F)Cl CSC011216032 [0,2,0,0,0,0|2,0,0]=4 137 B12R1.367 COC(=O)c1ccc(c(c1)F)F CSC000194019 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.367 COC(=O)c1ccc(c(c1)F)I CSC000062896 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.367 COC(=O)c1ccc(c(c1)I)C CSC011218856 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.367 COC(=O)c1ccc(c(c1)I)Cl CSC011294800 [0,2,0,0,0,0|2,0,0]=4 141 B12R1.367 COC(=O)c1ccc(c(c1)I)F CSC012361652 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CSC011450966 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.367 COC(=O)c1ccc(c(c1)N)I CSC011290891 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.367 COC(=O)c1ccc(c(c1)O)Br CSC011934688 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.367 COC(=O)c1ccc(c(c1)O)C CSC000736511 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.893 Cc1c(ccc(=O)n1C)[N+](=O)[O-] CSC010890742 [0,2,0,0,0,0|1,0,1]=4 147 B12R1.1005 Cn1cc(cc(c1=O)Br)[N+](=O)[O-] CSC010285682 [0,2,0,0,0,0|1,0,1]=4 148 B12R1.16 CCOC(=O)c1ccc(cc1)Br CSC000169895 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.16 CCOC(=O)c1ccc(cc1)Cl CSC000169919 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.16 CCOC(=O)c1ccc(cc1)F CSC000169906 [0,2,0,0,0,0|2,0,0]=4 151 B12R1.16 CCOC(=O)c1ccc(cc1)I CSC000170077 [0,2,0,0,0,0|2,0,0]=4 152 B12R1.16 CCOC(=O)c1ccc(nc1)C CSC011213257 [0,2,0,0,0,0|1,0,1]=4 153 B12R1.16 CCOC(=O)c1ccc(nc1)F CSC012183745 [0,2,0,0,0,0|1,0,1]=4 154 B12R1.1703 COC(=O)c1ccc(cc1Br)Br CSC012357387 [0,2,0,0,0,0|2,0,0]=4 155 B12R1.1703 COC(=O)c1ccc(cc1Br)C CSC012340597 [0,2,0,0,0,0|2,0,0]=4 156 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CSC012359205 [0,2,0,0,0,0|2,0,0]=4 157 B12R1.1703 COC(=O)c1ccc(cc1Br)F CSC000204356 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.1703 COC(=O)c1ccc(cc1C)C CSC000149307 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.1703 COC(=O)c1ccc(cc1C)Cl CSC012000500 [0,2,0,0,0,0|2,0,0]=4 160 B12R1.1703 COC(=O)c1ccc(cc1C)F CSC011997371 [0,2,0,0,0,0|2,0,0]=4 161 B12R1.1703 COC(=O)c1ccc(cc1Cl)C CSC012179639 [0,2,0,0,0,0|2,0,0]=4 162 B12R1.1703 COC(=O)c1ccc(cc1Cl)Cl CSC000150782 [0,2,0,0,0,0|2,0,0]=4 163 B12R1.1703 COC(=O)c1ccc(cc1Cl)F CSC000149744 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.1703 COC(=O)c1ccc(cc1Cl)I CSC000060724 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.1703 COC(=O)c1ccc(cc1F)C CSC000697821 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.1703 COC(=O)c1ccc(cc1F)Cl CSC000216677 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.1703 COC(=O)c1ccc(cc1F)F CSC000149155 [0,2,0,0,0,0|2,0,0]=4 168 B12R1.1703 COC(=O)c1ccc(cc1F)I CSC010244672 [0,2,0,0,0,0|2,0,0]=4 169 B12R1.1703 COC(=O)c1ccc(cc1F)N CSC000688129 [0,2,0,0,0,0|2,0,0]=4 170 B12R1.1703 COC(=O)c1ccc(cc1F)O CSC011999631 [0,2,0,0,0,0|1,0,1]=4 171 B12R1.1703 COC(=O)c1ccc(cc1N)Cl CSC000170103 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.1703 COC(=O)c1ccc(cc1N)F CSC000740600 [0,2,0,0,0,0|2,0,0]=4 173 B12R1.1703 COC(=O)c1ccc(cc1N)I CSC010172136 [0,2,0,0,0,0|2,0,0]=4 174 B12R1.1703 COC(=O)c1ccc(cc1O)F CSC011216117 [0,2,0,0,0,0|2,0,0]=4 175 B12R1.21 OC(=O)COc1ccc(cc1)Br CSC000182358 [0,0,0,0,0,2|2,0,0]=4