0 B10R1.176 CNc1ccc(c(c1)Cl)C CSC000220120 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.176 CNc1ccc(c(c1)Cl)Cl CSC000219944 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.176 CNc1ccc(c(c1)F)Br CSC012285320 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.176 COc1ccc(c(c1)Br)C CSC012349166 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.176 COc1ccc(c(c1)Br)Cl CSC011290771 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.176 COc1ccc(c(c1)Br)I CSC012349170 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.176 COc1ccc(c(c1)C)Br CSC000759875 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.176 COc1ccc(c(c1)C)Cl CSC000170508 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.176 COc1ccc(c(c1)C)F CSC011217415 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.176 COc1ccc(c(c1)Cl)Br CSC000730603 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.176 COc1ccc(c(c1)Cl)C CSC000021920 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.176 COc1ccc(c(c1)Cl)Cl CSC000170311 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.176 COc1ccc(c(c1)Cl)F CSC000006738 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.176 COc1ccc(c(c1)F)Br CSC000753793 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.176 COc1ccc(c(c1)F)C CSC011218487 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.176 COc1ccc(c(c1)F)Cl CSC011215935 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.176 COc1ccc(c(c1)F)F CSC000038840 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.176 CSc1ccc(c(c1)C)C CSC000001060 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.176 CSc1ccc(c(c1)Cl)Cl CSC000116842 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.176 CSc1ccc(c(c1)Cl)F CSC000021471 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.1 CNc1ccc(cc1)Br CSC000219623 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.1 CNc1ccc(cc1)Cl CSC000220157 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.1 COc1ccc(cc1)Br CSC000169945 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.1 COc1ccc(cc1)Cl CSC000169959 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.1 COc1ccc(cc1)I CSC000171711 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 CSc1ccc(cc1)Br CSC000149455 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.1 CSc1ccc(cc1)Cl CSC000150468 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.1 CSc1ccc(cc1)F CSC000000078 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.1 CSc1ccc(cc1)O CSC000211864 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.2 CNc1cccc(c1)Cl CSC000220044 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.2 CNc1cccc(c1)I CSC000221217 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.2 COc1cccc(c1)Br CSC000170001 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.2 COc1cccc(c1)Cl CSC000170018 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.2 COc1cccc(c1)I CSC000171673 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.2 CSc1cccc(c1)Br CSC011215954 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.2 CSc1cccc(c1)Cl CSC000033908 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.2 CSc1cccc(c1)F CSC000067534 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.21 Cc1cc(ccc1Br)C(=O)N CSC011218126 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.21 Cc1cc(ccc1F)C(=O)N CSC011217366 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.21 Cc1ccc(cc1Br)C(=O)N CSC000186401 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.21 Cc1ccc(cc1C)C(=O)N CSC000162321 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.21 Cc1ccc(cc1Cl)C(=O)N CSC011219532 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.21 Cc1ccc(cc1F)C(=O)N CSC000216902 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.21 Cc1ccc(cc1I)C(=O)N CSC000012956 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.21 NC(=O)c1ccc(c(c1)Br)Cl CSC012357840 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.21 NC(=O)c1ccc(c(c1)Br)F CSC011202321 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Br CSC012348002 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Cl CSC000162198 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.21 NC(=O)c1ccc(c(c1)Cl)F CSC011216305 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.21 NC(=O)c1ccc(c(c1)Cl)I CSC012348003 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.21 NC(=O)c1ccc(c(c1)F)Br CSC000686215 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.21 NC(=O)c1ccc(c(c1)F)Cl CSC011202322 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.21 NC(=O)c1ccc(c(c1)F)F CSC000194243 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.279 COc1ccc(cc1Cl)C#N CSC000189300 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.279 COc1ccc(cc1F)C#N CSC011216750 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.279 COc1ccc(cc1I)C#N CSC010089744 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.280 COc1cc(ccc1Br)C#N CSC012356288 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.3 COc1ccc(cc1)SC CSC000007070 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [1,1,0,0,0,0|1,0,0]=3 62 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [1,1,0,0,0,0|1,0,0]=3 64 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [1,1,0,0,0,0|1,0,0]=3 65 B10R1.13 NC(=O)c1ccc(cn1)Br CSC011219284 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.13 NC(=O)c1ccc(cn1)Cl CSC011834066 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.13 NC(=O)c1ccc(cn1)F CSC012180490 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.113 NC(=O)c1cc(ccn1)Cl CSC000229564 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.113 NC(=O)c1cccc(c1)Br CSC000162208 [1,1,0,0,0,0|1,0,0]=3 70 B10R1.113 NC(=O)c1cccc(c1)I CSC000162231 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.113 NC(=O)c1cccc(n1)F CSC011830463 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.113 NC(=O)c1cncc(c1)Br CSC000162242 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.113 NC(=O)c1cncc(c1)F CSC011996012 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.172 COc1cccc(c1)SC CSC000044647 [1,1,0,0,0,0|2,0,0]=4 75 B12R1.1005 Cc1cc(cc(c1F)C)C(=O)N CSC000084231 [0,2,0,0,0,0|2,0,0]=4 76 B12R1.1005 NC(=O)c1cc(c(c(c1)Br)O)Br CSC009813171 [0,2,0,0,0,0|1,0,0]=3 77 B12R1.1005 NC(=O)c1cc(c(c(c1)F)F)F CSC011219797 [0,2,0,0,0,0|2,0,0]=4 78 B12R1.48 COc1ccc(cc1Br)C(=O)N CSC000206422 [0,2,0,0,0,0|1,0,0]=3 79 B12R1.48 COc1ccc(cc1Br)[N+](=O)[O-] CSC011217902 [0,2,0,0,0,0|2,0,0]=4 80 B12R1.48 COc1ccc(cc1C)C(=O)C CSC000693588 [0,2,0,0,0,0|1,0,0]=3 81 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] CSC000068493 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.48 COc1ccc(cc1Cl)[N+](=O)[O-] CSC000000864 [0,2,0,0,0,0|2,0,0]=4 83 B12R1.48 COc1ccc(cc1F)[N+](=O)[O-] CSC000036518 [0,2,0,0,0,0|2,0,0]=4 84 B12R1.48 COc1ccc(cc1I)C(=O)N CSC010363828 [0,2,0,0,0,0|1,0,0]=3 85 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] CSC011218782 [0,2,0,0,0,0|2,0,0]=4 86 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] CSC000038251 [0,2,0,0,0,0|2,0,0]=4 87 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] CSC011217944 [0,2,0,0,0,0|2,0,0]=4 88 B12R1.232 NC(=O)c1cc(c(cc1Cl)Cl)F CSC000223270 [0,2,0,0,0,0|2,0,0]=4 89 B12R1.232 NC(=O)c1cc(c(cc1F)F)F CSC000036233 [0,2,0,0,0,0|2,0,0]=4 90 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F CSC012359898 [0,2,0,0,0,0|2,0,0]=4 91 B12R1.367 CNC(=O)c1ccc(c(c1)C)C CSC000159929 [0,2,0,0,0,0|2,0,0]=4 92 B12R1.367 CNC(=O)c1ccc(c(c1)C)N CSC000739472 [0,2,0,0,0,0|2,0,0]=4 93 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl CSC000159832 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.367 CNC(=O)c1ccc(c(c1)F)F CSC000194207 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.367 CNC(=O)c1ccc(c(c1)N)C CSC000737617 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.367 COC(=O)c1ccc(c(c1)Br)Cl CSC012356255 [0,2,0,0,0,0|2,0,0]=4 97 B12R1.367 COC(=O)c1ccc(c(c1)Br)F CSC000722584 [0,2,0,0,0,0|2,0,0]=4 98 B12R1.367 COC(=O)c1ccc(c(c1)Br)I CSC011294788 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.367 COC(=O)c1ccc(c(c1)C)Br CSC011215878 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.367 COC(=O)c1ccc(c(c1)C)C CSC000149473 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.367 COC(=O)c1ccc(c(c1)C)Cl CSC011217186 [0,2,0,0,0,0|2,0,0]=4 102 B12R1.367 COC(=O)c1ccc(c(c1)C)F CSC000698631 [0,2,0,0,0,0|2,0,0]=4 103 B12R1.367 COC(=O)c1ccc(c(c1)C)O CSC011997373 [0,2,0,0,0,0|1,0,0]=3 104 B12R1.367 COC(=O)c1ccc(c(c1)Cl)Br CSC012359697 [0,2,0,0,0,0|2,0,0]=4 105 B12R1.367 COC(=O)c1ccc(c(c1)Cl)C CSC011219533 [0,2,0,0,0,0|2,0,0]=4 106 B12R1.367 COC(=O)c1ccc(c(c1)Cl)F CSC011997363 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.367 COC(=O)c1ccc(c(c1)Cl)I CSC012356344 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.367 COC(=O)c1ccc(c(c1)Cl)N CSC000704683 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.367 COC(=O)c1ccc(c(c1)F)Br CSC000703229 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.367 COC(=O)c1ccc(c(c1)F)C CSC000216653 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.367 COC(=O)c1ccc(c(c1)F)Cl CSC011216032 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.367 COC(=O)c1ccc(c(c1)F)F CSC000194019 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.367 COC(=O)c1ccc(c(c1)F)I CSC000062896 [0,2,0,0,0,0|2,0,0]=4 114 B12R1.367 COC(=O)c1ccc(c(c1)I)C CSC011218856 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.367 COC(=O)c1ccc(c(c1)I)Cl CSC011294800 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.367 COC(=O)c1ccc(c(c1)I)F CSC012361652 [0,2,0,0,0,0|2,0,0]=4 117 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CSC011450966 [0,2,0,0,0,0|2,0,0]=4 118 B12R1.367 COC(=O)c1ccc(c(c1)N)I CSC011290891 [0,2,0,0,0,0|2,0,0]=4 119 B12R1.367 COC(=O)c1ccc(c(c1)O)Br CSC011934688 [0,2,0,0,0,0|1,0,0]=3 120 B12R1.367 COC(=O)c1ccc(c(c1)O)C CSC000736511 [0,2,0,0,0,0|1,0,0]=3 121 B12R1.367 Cc1ccc(cc1Br)C(=O)NN CSC000188075 [0,2,0,0,0,0|2,0,0]=4 122 B12R1.367 Cc1ccc(cc1C)C(=O)NN CSC000189846 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.367 Cc1ccc(cc1Cl)C(=O)NN CSC011823865 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.367 NNC(=O)c1ccc(c(c1)Br)Cl CSC011219835 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.367 NNC(=O)c1ccc(c(c1)Cl)Br CSC011217245 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.367 NNC(=O)c1ccc(c(c1)Cl)Cl CSC000187931 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.367 NNC(=O)c1ccc(c(c1)F)F CSC000194116 [0,2,0,0,0,0|2,0,0]=4 128 B12R1.893 NC(=O)c1ccc(c(c1F)Cl)F CSC000081360 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.893 NC(=O)c1ccc(c(c1F)F)F CSC011216183 [0,2,0,0,0,0|2,0,0]=4 130 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F CSC012348134 [0,2,0,0,0,0|2,0,0]=4 131 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C CSC000153705 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.19 CC(=O)Nc1ccc(c(c1)C)N CSC011203061 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O CSC012186693 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br CSC000187747 [0,2,0,0,0,0|2,0,0]=4 135 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F CSC000155749 [0,2,0,0,0,0|2,0,0]=4 136 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O CSC011215158 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br CSC011219590 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F CSC000155707 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C CSC000154840 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C CSC012148147 [0,2,0,0,0,0|1,0,0]=3 141 B12R1.19 CC(=O)Oc1ccc(c(c1)C)C CSC000002428 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.19 CC(=O)Oc1ccc(c(c1)Cl)Cl CSC000002395 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.19 CC(=O)Oc1ccc(c(c1)F)Cl CSC010725880 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.19 Cc1ccc(cc1C)CC(=O)N CSC000162019 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.19 Cc1ccc(cc1Cl)NC(=O)N CSC000222810 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.19 Cc1ccc(cc1F)NC(=O)N CSC000238967 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.19 NC(=O)Nc1ccc(c(c1)Cl)Cl CSC000222805 [0,2,0,0,0,0|2,0,0]=4 148 B12R1.19 NC(=O)Nc1ccc(c(c1)Cl)F CSC000238935 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.19 NC(=O)Nc1ccc(c(c1)F)Cl CSC000717728 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.19 NC(=O)Nc1ccc(c(c1)F)F CSC000239066 [0,2,0,0,0,0|2,0,0]=4 151 B12R1.288 CNCc1ccc(c(c1)O)OC CSC000188468 [0,2,0,0,0,0|1,0,1]=4 152 B12R1.78 CCc1ccc(c(c1)OC)OC CSC000076490 [0,2,0,0,0,0|1,0,1]=4 153 B12R1.78 COc1ccc(c(c1)OC)OC CSC000036765 [0,2,0,0,0,0|2,0,0]=4 154 B12R2.44 COc1ccc2c(c1)OCO2 CSC000005814 [0,1,0,1,0,0|2,0,0]=4