0 B10R1.25 CNc1ccc(cc1C)Cl CSC011806183 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.25 CNc1ccc(cc1Cl)Cl CSC000220404 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.25 COc1ccc(cc1Br)Br CSC000170007 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.25 COc1ccc(cc1Br)C CSC000186399 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.25 COc1ccc(cc1Br)F CSC000171694 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.25 COc1ccc(cc1C)Br CSC011219705 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.25 COc1ccc(cc1C)Cl CSC000170507 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.25 COc1ccc(cc1C)F CSC011216167 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.25 COc1ccc(cc1Cl)Br CSC000149647 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.25 COc1ccc(cc1Cl)C CSC011933932 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.25 COc1ccc(cc1Cl)Cl CSC000170024 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.25 COc1ccc(cc1Cl)F CSC000170253 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.25 COc1ccc(cc1F)Cl CSC011218554 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.25 COc1ccc(cc1I)C CSC011263220 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.25 CSc1ccc(cc1C)C CSC000001076 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.25 CSc1ccc(cc1Cl)Cl CSC000076917 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.25 CSc1ccc(cc1F)F CSC000017874 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.1 CNc1ccc(cc1)Br CSC000219623 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.1 CNc1ccc(cc1)Cl CSC000220157 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.1 COc1ccc(cc1)Br CSC000169945 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 COc1ccc(cc1)Cl CSC000169959 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.1 COc1ccc(cc1)I CSC000171711 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.1 CSc1ccc(cc1)Br CSC000149455 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.1 CSc1ccc(cc1)Cl CSC000150468 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.1 CSc1ccc(cc1)F CSC000000078 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 CSc1ccc(cc1)O CSC000211864 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.15 CNc1ccccc1Cl CSC000219374 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.15 COc1ccccc1Br CSC000174000 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.15 COc1ccccc1Cl CSC000169952 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.15 COc1ccccc1I CSC000210334 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.15 CSc1ccccc1Br CSC000230855 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.15 CSc1ccccc1Cl CSC000000335 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.15 CSc1ccccc1F CSC000000233 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.15 CSc1ccccc1O CSC011216402 [1,0,0,0,0,0|2,0,0]=3 34 B11R1.37 CNc1cc(ccc1OC)C CSC000220787 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.37 COc1cc(ccc1C#N)Br CSC000694671 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.37 COc1ccc(cc1OC)C CSC000171720 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.37 COc1ccc(cc1OC)Cl CSC000739261 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.81 CCOc1ccc(cc1Br)C CSC000230997 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.81 CCOc1ccc(cc1C)C CSC000174096 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.81 CCSc1ccc(cc1C)C CSC000006292 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.166 Cc1cc(ccc1C(=O)N)Br CSC011327924 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.166 Cc1cc(ccc1C(=O)N)F CSC011997080 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.166 Cc1ccc(c(c1)C)C(=O)N CSC000162304 [0,1,0,0,0,0|1,0,0]=2 44 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)N CSC012178794 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.166 Cc1ccc(c(c1)F)C(=O)N CSC000686557 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.166 Cc1ncc(c(n1)C)C(=O)N CSC009824503 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.166 NC(=O)c1ccc(cc1Br)Br CSC012769498 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.166 NC(=O)c1ccc(cc1Br)Cl CSC012347284 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.166 NC(=O)c1ccc(cc1Cl)Cl CSC000162194 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.166 NC(=O)c1ccc(cc1Cl)F CSC000162332 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.166 NC(=O)c1ccc(cc1Cl)I CSC000060398 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.166 NC(=O)c1ccc(cc1F)Br CSC000216903 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.166 NC(=O)c1ccc(cc1F)Cl CSC000216909 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.166 NC(=O)c1ccc(cc1F)F CSC000162284 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.166 NC(=O)c1ccc(cc1O)Cl CSC000192836 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.166 NC(=O)c1ccc(cc1O)O CSC011933943 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.166 NC(=O)c1ncc(cc1F)F CSC000042384 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.279 COc1ccc(c(c1)C)C#N CSC011934301 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.279 COc1ccc(c(c1)Cl)C#N CSC011218975 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.279 COc1ccc(c(c1)F)C#N CSC000687259 [0,1,0,0,0,0|2,0,1]=4 61 B11R1.464 CNc1c(cc(cc1C)C)C CSC011806176 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.1 CCSc1ccc(cc1)C CSC000006686 [1,1,0,0,0,0|1,0,1]=4 63 B10R1.1 CSCc1ccc(cc1)C CSC000051358 [1,1,0,0,0,0|0,1,1]=4 64 B10R1.3 COc1ccc(cc1)SC CSC000007070 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.3 CSc1ccc(cc1)C#N CSC000188601 [1,1,0,0,0,0|1,0,1]=4 66 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.13 NC(=O)c1ccc(cn1)Br CSC011219284 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.13 NC(=O)c1ccc(cn1)Cl CSC011834066 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.13 NC(=O)c1ccc(cn1)F CSC012180490 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.176 CNc1ccc(c(c1)Cl)C CSC000220120 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.176 COc1ccc(c(c1)Br)C CSC012349166 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.176 COc1ccc(c(c1)Cl)C CSC000021920 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.176 COc1ccc(c(c1)F)C CSC011218487 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.176 CSc1ccc(c(c1)C)C CSC000001060 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.20 COc1ccccc1SC CSC000037525 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.61 CS(=O)c1ccccc1F CSC011216808 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [1,1,0,0,0,0|1,0,0]=3 85 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [1,1,0,0,0,0|1,0,0]=3 86 B10R1.61 NC(=O)c1cccnc1F CSC012002233 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.61 NC(=O)c1ccncc1F CSC000698873 [1,1,0,0,0,0|2,0,0]=4 88 B10R1.61 NC(=O)c1ncccc1Cl CSC000099198 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.61 NC(=O)c1ncccc1F CSC009850871 [1,1,0,0,0,0|2,0,0]=4 90 B10R1.194 Cc1csc(c1Cl)C(=O)N CSC011996362 [0,1,0,0,1,0|2,0,0]=4 91 B12R1.57 COc1cc(ccc1C(=O)C)Br CSC000709911 [0,2,0,0,0,0|1,0,0]=3 92 B12R1.57 COc1cc(ccc1C(=O)N)C CSC000026189 [0,2,0,0,0,0|0,0,0]=2 93 B12R1.57 COc1cc(ccc1C(=O)N)Cl CSC011533113 [0,2,0,0,0,0|1,0,0]=3 94 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Br CSC009817168 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl CSC000707587 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F CSC000170614 [0,2,0,0,0,0|2,0,0]=4 97 B12R1.78 CCc1ccc(c(c1)OC)OC CSC000076490 [0,2,0,0,0,0|2,0,0]=4 98 B12R1.78 COc1ccc(c(c1)OC)C#N CSC000188243 [0,2,0,0,0,0|1,0,1]=4 99 B12R1.78 COc1ccc(c(c1)OC)OC CSC000036765 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.112 CCOc1ccc(cc1OC)C CSC000006307 [0,2,0,0,0,0|1,0,1]=4 101 B12R1.69 Cc1ccc(c(c1)Br)OCC=C CSC000241584 [0,2,0,0,0,0|2,0,0]=4 102 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br CSC000151919 [0,2,0,0,0,0|2,0,0]=4 103 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl CSC012022070 [0,2,0,0,0,0|2,0,0]=4 104 B12R1.233 CC(=O)Nc1ccc(cc1Br)F CSC011215554 [0,2,0,0,0,0|2,0,0]=4 105 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl CSC000154214 [0,2,0,0,0,0|2,0,0]=4 106 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br CSC000154779 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl CSC000154243 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F CSC000155642 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.233 CC(=O)Nc1ccc(cc1F)C CSC000152019 [0,2,0,0,0,0|1,0,0]=3 110 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl CSC000155771 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.233 CC(=O)Nc1ccc(cc1F)F CSC000155514 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.233 CC(=O)Nc1ccc(cc1F)I CSC000027682 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl CSC010293595 [0,2,0,0,0,0|1,0,0]=3 114 B12R1.233 CC(=O)Nc1ncc(cc1Br)C CSC009816786 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.233 Cc1cc(ccc1NC(=O)N)Cl CSC011226012 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.233 Cc1cc(ccc1NC(=O)N)F CSC000239003 [0,2,0,0,0,0|2,0,0]=4 117 B12R1.233 Cc1ccc(c(c1)Br)NC(=O)N CSC011208876 [0,2,0,0,0,0|1,0,0]=3 118 B12R1.233 Cc1ccc(c(c1)Cl)NC(=O)N CSC011248226 [0,2,0,0,0,0|1,0,0]=3 119 B12R1.233 NC(=O)Cc1ccc(cc1Br)F CSC010883721 [0,2,0,0,0,0|2,0,0]=4 120 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl CSC000162283 [0,2,0,0,0,0|2,0,0]=4 121 B12R1.233 NC(=O)Cc1ccc(cc1Cl)F CSC000034102 [0,2,0,0,0,0|2,0,0]=4 122 B12R1.233 NC(=O)Nc1ccc(cc1Cl)Cl CSC011208882 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.233 NC(=O)Nc1ccc(cc1F)Br CSC011208892 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.233 NC(=O)Nc1ccc(cc1F)F CSC000222808 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.1703 CNC(=O)c1ccc(cc1C)C CSC000159917 [0,2,0,0,0,0|1,0,0]=3 126 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br CSC011372354 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C CSC000188180 [0,2,0,0,0,0|1,0,0]=3 128 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl CSC000159828 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.1703 CNC(=O)c1ccc(cc1Cl)N CSC000742945 [0,2,0,0,0,0|2,0,0]=4 130 B12R1.1703 CNC(=O)c1ccc(cc1F)Br CSC000233932 [0,2,0,0,0,0|2,0,0]=4 131 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl CSC011190852 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.1703 CNC(=O)c1ccc(cc1F)F CSC000159900 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.1703 COC(=O)c1ccc(cc1Br)Br CSC012357387 [0,2,0,0,0,0|2,0,0]=4 134 B12R1.1703 COC(=O)c1ccc(cc1Br)C CSC012340597 [0,2,0,0,0,0|1,0,0]=3 135 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CSC012359205 [0,2,0,0,0,0|2,0,0]=4 136 B12R1.1703 COC(=O)c1ccc(cc1Br)F CSC000204356 [0,2,0,0,0,0|2,0,0]=4 137 B12R1.1703 COC(=O)c1ccc(cc1C)C CSC000149307 [0,2,0,0,0,0|1,0,0]=3 138 B12R1.1703 COC(=O)c1ccc(cc1C)Cl CSC012000500 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.1703 COC(=O)c1ccc(cc1C)F CSC011997371 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.1703 COC(=O)c1ccc(cc1Cl)C CSC012179639 [0,2,0,0,0,0|1,0,0]=3 141 B12R1.1703 COC(=O)c1ccc(cc1Cl)Cl CSC000150782 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.1703 COC(=O)c1ccc(cc1Cl)F CSC000149744 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.1703 COC(=O)c1ccc(cc1Cl)I CSC000060724 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.1703 COC(=O)c1ccc(cc1F)C CSC000697821 [0,2,0,0,0,0|1,0,0]=3 145 B12R1.1703 COC(=O)c1ccc(cc1F)Cl CSC000216677 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.1703 COC(=O)c1ccc(cc1F)F CSC000149155 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.1703 COC(=O)c1ccc(cc1F)I CSC010244672 [0,2,0,0,0,0|2,0,0]=4 148 B12R1.1703 COC(=O)c1ccc(cc1F)N CSC000688129 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.1703 COC(=O)c1ccc(cc1F)O CSC011999631 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.1703 COC(=O)c1ccc(cc1N)Cl CSC000170103 [0,2,0,0,0,0|2,0,0]=4 151 B12R1.1703 COC(=O)c1ccc(cc1N)F CSC000740600 [0,2,0,0,0,0|2,0,0]=4 152 B12R1.1703 COC(=O)c1ccc(cc1N)I CSC010172136 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.1703 COC(=O)c1ccc(cc1O)F CSC011216117 [0,2,0,0,0,0|1,0,0]=3 154 B12R1.1703 Cc1cc(ccc1C(=O)NN)Cl CSC011996896 [0,2,0,0,0,0|2,0,0]=4 155 B12R1.1703 Cc1ccc(c(c1)C)C(=O)NN CSC000189823 [0,2,0,0,0,0|1,0,0]=3 156 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)NN CSC000187075 [0,2,0,0,0,0|1,0,0]=3 157 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN CSC000193368 [0,2,0,0,0,0|0,0,0]=2 158 B12R1.1703 NNC(=O)c1ccc(cc1Br)F CSC000203923 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.1703 NNC(=O)c1ccc(cc1Cl)Br CSC000751675 [0,2,0,0,0,0|2,0,0]=4 160 B12R1.1703 NNC(=O)c1ccc(cc1F)Br CSC009812619 [0,2,0,0,0,0|2,0,0]=4 161 B12R1.1703 NNC(=O)c1ccc(cc1F)F CSC000189803 [0,2,0,0,0,0|2,0,0]=4 162 B12R1.126 Cc1ccc(c(c1)C)S(=O)(=O)C CSC000048139 [0,2,0,0,0,0|2,0,0]=4 163 B12R1.232 NC(=O)c1cc(c(cc1Cl)Cl)F CSC000223270 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.232 NC(=O)c1cc(c(cc1F)F)F CSC000036233 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.452 COc1ccc(c(c1)Br)C(=O)N CSC009815664 [0,2,0,0,0,0|1,0,0]=3 166 B12R1.452 COc1ccc(c(c1)C)C(=O)N CSC009868328 [0,2,0,0,0,0|1,0,0]=3 167 B12R1.452 COc1ccc(c(c1)F)C(=O)C CSC000211433 [0,2,0,0,0,0|1,0,0]=3 168 B12R1.452 COc1ccc(c(c1)F)C(=O)N CSC000198184 [0,2,0,0,0,0|1,0,0]=3 169 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] CSC011299423 [0,2,0,0,0,0|2,0,0]=4 170 B12R1.893 NC(=O)c1ccc(c(c1F)Cl)F CSC000081360 [0,2,0,0,0,0|2,0,0]=4 171 B12R1.893 NC(=O)c1ccc(c(c1F)F)F CSC011216183 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.1000 Cc1cc(c(c(c1)C)C(=O)N)C CSC011200860 [0,2,0,0,0,0|1,0,0]=3 173 B12R1.1000 NC(=O)c1c(cc(cc1F)F)F CSC011218477 [0,2,0,0,0,0|2,0,0]=4 174 B12R1.288 CNCc1ccc(c(c1)O)OC CSC000188468 [0,2,0,0,0,0|2,0,0]=4 175 B12R2.44 COc1ccc2c(c1)OCO2 CSC000005814 [0,1,0,1,0,0|2,0,0]=4