0 B10R1.13 B(c1ccc(cc1)C)(O)O AS07183 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.13 B(c1ccc(cc1)Cl)(O)O AS04983 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 B(c1ccc(cc1)F)(O)O AS04986 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 B(c1ccc(cc1)O)(O)O AS06272 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 B(c1ccc(cc1)S)(O)O AS06762 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 CC(=C)c1ccc(cc1)O AS06541 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.13 CC(=O)c1ccc(cc1)Br AS01178 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.13 CC(=O)c1ccc(cc1)Cl AS05257 [0,0,0,0,0,0|1,0,2]=3 8 B10R1.13 CC(=O)c1ccc(cc1)F AS01160 [0,0,0,0,0,0|1,0,2]=3 9 B10R1.13 CC(=O)c1ccc(cc1)I AS04012 [0,0,0,0,0,0|1,0,2]=3 10 B10R1.13 CC(=O)c1ccc(cc1)N AS01150 [0,0,0,0,0,0|1,0,2]=3 11 B10R1.13 CC(=O)c1ccc(cc1)O AS01158 [0,0,0,0,0,0|1,0,2]=3 12 B10R1.13 CC(=O)c1ccc(nc1)Cl AS05261 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.13 CC(=O)c1ccc(nc1)O AS04944 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.13 CC(C)c1ccc(cc1)I AS02289 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.13 CC(C)c1ccc(cc1)S AS00078 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.13 CC(c1ccc(cc1)Br)N AS03462 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.13 CC(c1ccc(cc1)Br)O AS03465 [0,0,0,0,0,0|1,0,0]=1 18 B10R1.13 CC(c1ccc(cc1)Cl)Br AS06898 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.13 CC(c1ccc(cc1)Cl)N AS02836 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 CC(c1ccc(cc1)Cl)O AS02839 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.13 CC(c1ccc(cc1)F)O AS00895 [0,0,0,0,0,0|1,0,0]=1 22 B10R1.13 CN(C)c1ccc(cc1)Cl AS05322 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.13 CN(C)c1ccc(cc1)O AS06531 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.13 Cc1ccc(cc1)C(=O)C AS01165 [0,0,0,0,0,0|0,0,2]=2 25 B10R1.13 Cc1ccc(cc1)C(=O)Cl AS00020 [0,0,0,0,0,0|1,0,2]=3 26 B10R1.13 Cc1ccc(cc1)C(=O)N AS05901 [0,0,0,0,0,0|1,0,2]=3 27 B10R1.13 Cc1ccc(cc1)C(=O)O AS00864 [0,0,0,0,0,0|1,0,1]=2 28 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] AS01013 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] AS04952 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.13 c1cc(ccc1C(=N)N)N AS01794 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.13 c1cc(ccc1C(=N)N)N AS01988 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.13 c1cc(ccc1C(=O)Cl)I AS00009 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.13 c1cc(ccc1C(=O)N)Br AS00920 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.13 c1cc(ccc1C(=O)N)Cl AS02680 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.13 c1cc(ccc1C(=O)N)F AS00831 [0,0,0,0,0,0|2,0,2]=4 36 B10R1.13 c1cc(ccc1C(=O)O)Br AS00815 [0,0,0,0,0,0|2,0,1]=3 37 B10R1.13 c1cc(ccc1C(=O)O)Cl AS00806 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.13 c1cc(ccc1C(=O)O)F AS00747 [0,0,0,0,0,0|2,0,1]=3 39 B10R1.13 c1cc(ccc1C(=O)O)I AS02218 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.13 c1cc(ccc1C(=O)O)N AS00762 [0,0,0,0,0,0|2,0,1]=3 41 B10R1.13 c1cc(ccc1C(=O)[O-])F AS00778 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.13 c1cc(ccc1C(=S)N)Cl AS06630 [0,0,0,0,0,0|2,1,1]=4 43 B10R1.13 c1cc(ccc1C(F)F)Br AS05635 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] AS00442 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.13 c1cc(ccc1[N+](=O)[O-])Br AS05660 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.13 c1cc(ccc1[N+](=O)[O-])F AS00083 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.13 c1cc(ccc1[N+](=O)[O-])O AS00220 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.13 c1cc(ncc1C(=O)O)F AS04828 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.13 c1cc(ncc1Cl)C(=O)O AS04938 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.13 c1cc(ncc1F)C(=O)O AS04870 [0,0,0,0,0,0|3,0,1]=4 51 B9R1.1 C#Cc1ccc(cc1)F AS00454 [1,0,0,0,0,0|1,0,2]=4 52 B9R1.1 C#Cc1ccc(cc1)N AS04615 [1,0,0,0,0,0|1,0,2]=4 53 B9R1.1 C=Cc1ccc(cc1)Br AS03806 [1,0,0,0,0,0|1,0,2]=4 54 B9R1.1 C=Cc1ccc(cc1)F AS03795 [1,0,0,0,0,0|1,0,2]=4 55 B9R1.1 CCc1ccc(cc1)Br AS03254 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.1 CCc1ccc(cc1)F AS04424 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.1 CCc1ccc(cc1)I AS02159 [1,0,0,0,0,0|1,0,0]=2 58 B9R1.1 CNc1ccc(cc1)I AS05390 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.1 COc1ccc(cc1)Br AS02358 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.1 COc1ccc(cc1)Cl AS01802 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.1 COc1ccc(cc1)F AS02586 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.1 COc1ccc(cc1)I AS02208 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.1 COc1ccc(cc1)O AS04576 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.1 COc1ccc(cn1)Br AS03404 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.1 COc1ccc(cn1)F AS04877 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.1 COc1ccc(nc1)Br AS04912 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CSc1ccc(cc1)Br AS04293 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.1 CSc1ccc(cc1)Cl AS04289 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.1 CSc1ccc(cc1)F AS04286 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 CSc1ccc(cc1)N AS04283 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.1 Cc1ccc(cc1)C#N AS03761 [1,0,0,0,0,0|1,0,1]=3 72 B9R1.1 Cc1ccc(cc1)C=O AS02824 [1,0,0,0,0,0|0,0,2]=3 73 B9R1.1 Cc1ccc(cc1)CCl AS00637 [1,0,0,0,0,0|1,0,0]=2 74 B9R1.1 Cc1ccc(cc1)SC AS04302 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.1 Cc1ccc(nc1)C#N AS04709 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.1 c1cc(ccc1C#N)Br AS03698 [1,0,0,0,0,0|2,0,1]=4 77 B9R1.1 c1cc(ccc1C#N)Cl AS02369 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.1 c1cc(ccc1C#N)F AS03736 [1,0,0,0,0,0|2,0,1]=4 79 B9R1.1 c1cc(ccc1C#N)I AS03752 [1,0,0,0,0,0|2,0,1]=4 80 B9R1.1 c1cc(ccc1C#N)N AS02646 [1,0,0,0,0,0|2,0,1]=4 81 B9R1.1 c1cc(ccc1C#N)O AS02647 [1,0,0,0,0,0|2,0,1]=4 82 B9R1.1 c1cc(ccc1C=O)Br AS02893 [1,0,0,0,0,0|1,0,2]=4 83 B9R1.1 c1cc(ccc1C=O)Cl AS02986 [1,0,0,0,0,0|1,0,2]=4 84 B9R1.1 c1cc(ccc1C=O)F AS02846 [1,0,0,0,0,0|1,0,2]=4 85 B9R1.1 c1cc(ccc1C=O)F AS03001 [1,0,0,0,0,0|1,0,2]=4 86 B9R1.1 c1cc(ccc1C=O)I AS03916 [1,0,0,0,0,0|1,0,2]=4 87 B9R1.1 c1cc(ccc1C=O)N AS06990 [1,0,0,0,0,0|1,0,2]=4 88 B9R1.1 c1cc(ccc1C=O)O AS02994 [1,0,0,0,0,0|1,0,2]=4 89 B9R1.1 c1cc(ccc1CBr)Br AS02044 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.1 c1cc(ccc1CBr)Cl AS02046 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.1 c1cc(ccc1CBr)F AS00664 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.1 c1cc(ccc1CBr)I AS00645 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.1 c1cc(ccc1CCl)Br AS00646 [1,0,0,0,0,0|2,0,0]=3 94 B9R1.1 c1cc(ccc1CCl)F AS00660 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.1 c1cc(ccc1CCl)F AS02054 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.1 c1cc(ccc1CN)Br AS02268 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.1 c1cc(ccc1CN)Br AS03103 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.1 c1cc(ccc1CN)Br AS06970 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.1 c1cc(ccc1CN)Cl AS00379 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.1 c1cc(ccc1CN)Cl AS02689 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.1 c1cc(ccc1CN)F AS00834 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.1 c1cc(ccc1CN)F AS01938 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.1 c1cc(ccc1CN)I AS02223 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.1 c1cc(ccc1CN)I AS02301 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.1 c1cc(ccc1CO)Br AS03954 [1,0,0,0,0,0|1,0,0]=2 106 B9R1.1 c1cc(ccc1CO)Cl AS03965 [1,0,0,0,0,0|1,0,0]=2 107 B9R1.1 c1cc(ccc1CO)F AS03978 [1,0,0,0,0,0|1,0,0]=2 108 B9R1.1 c1cc(ccc1CO)I AS00604 [1,0,0,0,0,0|1,0,0]=2 109 B9R1.1 c1cc(ccc1CO)I AS03987 [1,0,0,0,0,0|1,0,0]=2 110 B9R1.1 c1cc(ccc1CO)N AS00548 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.1 c1cc(ccc1CO)O AS00576 [1,0,0,0,0,0|1,0,0]=2 112 B9R1.1 c1cc(ccc1NN)Br AS02015 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.1 c1cc(ccc1NN)Cl AS04469 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.1 c1cc(ccc1NN)F AS02961 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.1 c1cc(ccc1OS)I AS02948 [1,0,0,0,0,0|2,1,0]=4 116 B9R1.6 c1ccc(cc1)C(=O)Cl AS00010 [1,0,0,0,0,0|1,0,2]=4 117 B9R1.6 c1ccc(cc1)C(=O)O AS04617 [1,0,0,0,0,0|1,0,1]=3 118 B9R1.6 c1ccc(cc1)C(=O)[O-] AS01250 [1,0,0,0,0,0|1,0,2]=4 119 B9R1.6 c1ccc(cc1)[N+](=O)[O-] AS01461 [1,0,0,0,0,0|2,0,1]=4 120 B11R1.3 CC(=O)c1ccc(cc1)C#N AS05151 [0,1,0,0,0,0|0,0,3]=4 121 B11R1.3 CC(C)c1ccc(cc1)C#C AS06788 [0,1,0,0,0,0|1,0,1]=3 122 B11R1.3 CC(C)c1ccc(cc1)NN AS02450 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.3 CC(C)c1ccc(cc1)OC AS01008 [0,1,0,0,0,0|1,0,0]=2 124 B11R1.3 CC(c1ccc(cc1)OC)N AS04622 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.3 CCc1ccc(cc1)C(=O)C AS03877 [0,1,0,0,0,0|0,0,2]=3 126 B11R1.3 CCc1ccc(cc1)C(C)N AS00822 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.3 CN(C)c1ccc(cc1)C#N AS02379 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.3 CN(C)c1ccc(cc1)C=O AS02845 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.3 CN(C)c1ccc(cc1)OC AS04610 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] AS04616 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.3 COc1ccc(cc1)C(=O)Cl AS00015 [0,1,0,0,0,0|1,0,2]=4 132 B11R1.3 COc1ccc(cc1)C(=O)O AS00727 [0,1,0,0,0,0|1,0,1]=3 133 B11R1.3 COc1ccc(cc1)C(=O)O AS03913 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] AS01804 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.3 COc1ccc(cn1)C(=O)O AS01298 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.3 CSc1ccc(cc1)[N+](=O)[O-] AS04280 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.3 C[C@H](c1ccc(cc1)OC)N AS04502 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.3 c1cc(ccc1C(=O)O)NN AS06885 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.3 c1cc(ccc1C(=O)O)NN AS06946 [0,1,0,0,0,0|2,0,1]=4 140 B11R1.3 c1cc(ccc1C=O)C(=O)O AS00836 [0,1,0,0,0,0|1,0,2]=4 141 B11R1.3 c1cc(ccc1CBr)C(=O)O AS00835 [0,1,0,0,0,0|1,0,1]=3 142 B11R1.3 c1cc(ccc1CBr)[N+](=O)[O-] AS00716 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.3 c1cc(ccc1CCl)C(=O)O AS00731 [0,1,0,0,0,0|1,0,1]=3 144 B11R1.3 c1cc(ccc1CCl)[N+](=O)[O-] AS02053 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.3 c1cc(ccc1CN)C(=O)O AS06858 [0,1,0,0,0,0|1,0,1]=3 146 B11R1.3 c1cc(ccc1CO)[N+](=O)[O-] AS00573 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.19 CC(C)(C)c1ccc(cc1)Br AS03466 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.19 CC(C)(C)c1ccc(cc1)I AS05654 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.19 CC(C)(C)c1ccc(cc1)O AS00221 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.19 C[Si](C)(C)c1ccc(cc1)F AS05757 [0,1,0,0,0,0|2,1,0]=4 151 B11R1.19 Cc1ccc(cc1)C(F)(F)F AS01764 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.19 c1cc(ccc1C(F)(F)F)Br AS03098 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.19 c1cc(ccc1C(F)(F)F)Br AS07163 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.19 c1cc(ccc1C(F)(F)F)Cl AS01028 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.19 c1cc(ccc1C(F)(F)F)F AS01030 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.19 c1cc(ccc1C(F)(F)F)I AS01032 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.19 c1cc(ccc1C(F)(F)F)N AS05404 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.19 c1cc(ccc1C(F)(F)F)O AS01417 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.19 c1cc(ccc1N)S(=O)(=O)O AS01575 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.21 B(c1ccc(c(c1)C)F)(O)O AS04987 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.21 B(c1ccc(c(c1)Cl)F)(O)O AS04982 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.21 B(c1ccc(c(c1)F)F)(O)O AS04988 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.21 B(c1ccc(c(c1)O)Cl)(O)O AS06563 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br AS03854 [0,1,0,0,0,0|1,0,2]=4 165 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl AS05101 [0,1,0,0,0,0|1,0,2]=4 166 B11R1.21 CC(=O)c1ccc(c(c1)Br)F AS01132 [0,1,0,0,0,0|1,0,2]=4 167 B11R1.21 CC(=O)c1ccc(c(c1)Br)N AS05067 [0,1,0,0,0,0|1,0,2]=4 168 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl AS03863 [0,1,0,0,0,0|1,0,2]=4 169 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F AS01148 [0,1,0,0,0,0|1,0,2]=4 170 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O AS05145 [0,1,0,0,0,0|1,0,2]=4 171 B11R1.21 CC(=O)c1ccc(c(c1)F)Br AS05111 [0,1,0,0,0,0|1,0,2]=4 172 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl AS01173 [0,1,0,0,0,0|1,0,2]=4 173 B11R1.21 CC(=O)c1ccc(c(c1)F)F AS01192 [0,1,0,0,0,0|1,0,2]=4 174 B11R1.21 CC(=O)c1ccc(c(c1)F)N AS01172 [0,1,0,0,0,0|1,0,2]=4 175 B11R1.21 CC(=O)c1ccc(c(c1)F)O AS01203 [0,1,0,0,0,0|1,0,2]=4 176 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl AS05249 [0,1,0,0,0,0|1,0,2]=4 177 B11R1.21 CC(=O)c1ccc(c(c1)N)F AS04017 [0,1,0,0,0,0|1,0,2]=4 178 B11R1.21 CC(=O)c1ccc(c(c1)O)F AS03881 [0,1,0,0,0,0|1,0,2]=4 179 B11R1.21 CC(C)c1ccc(c(c1)Br)N AS00906 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.21 CC(c1ccc(c(c1)Cl)Cl)N AS02891 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.21 CC(c1ccc(c(c1)F)F)N AS00801 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.21 Cc1cc(ccc1Br)C(=O)C AS03824 [0,1,0,0,0,0|1,0,2]=4 183 B11R1.21 Cc1cc(ccc1Br)C(=O)C AS05124 [0,1,0,0,0,0|1,0,2]=4 184 B11R1.21 Cc1cc(ccc1Br)C(=O)O AS02483 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.21 Cc1cc(ccc1Cl)C(=O)C AS03848 [0,1,0,0,0,0|1,0,2]=4 186 B11R1.21 Cc1cc(ccc1Cl)C(=O)O AS00788 [0,1,0,0,0,0|2,0,1]=4 187 B11R1.21 Cc1cc(ccc1F)C(=O)C AS05267 [0,1,0,0,0,0|1,0,2]=4 188 B11R1.21 Cc1cc(ccc1F)C(=O)O AS01875 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.21 Cc1cc(ccc1I)C(=O)O AS02265 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.21 Cc1cc(ccc1N)C(=O)O AS01122 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.21 Cc1cc(ccc1O)C(=O)C AS04503 [0,1,0,0,0,0|1,0,2]=4 192 B11R1.21 Cc1cc(ccc1O)C(=O)O AS00899 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.21 Cc1ccc(cc1Br)C(=O)C AS03823 [0,1,0,0,0,0|0,0,2]=3 194 B11R1.21 Cc1ccc(cc1Br)C(=O)N AS03422 [0,1,0,0,0,0|1,0,2]=4 195 B11R1.21 Cc1ccc(cc1Br)C(=O)O AS02482 [0,1,0,0,0,0|1,0,1]=3 196 B11R1.21 Cc1ccc(cc1Br)[N+](=O)[O-] AS03442 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.21 Cc1ccc(cc1C)C(=O)C AS03873 [0,1,0,0,0,0|0,0,2]=3 198 B11R1.21 Cc1ccc(cc1C)C(=O)O AS00741 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.21 Cc1ccc(cc1C)C(C)N AS00809 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.21 Cc1ccc(cc1C)[N+](=O)[O-] AS07070 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.21 Cc1ccc(cc1Cl)C(=O)O AS00790 [0,1,0,0,0,0|1,0,1]=3 202 B11R1.21 Cc1ccc(cc1F)C(=O)C AS05187 [0,1,0,0,0,0|0,0,2]=3 203 B11R1.21 Cc1ccc(cc1F)C(=O)O AS02484 [0,1,0,0,0,0|1,0,1]=3 204 B11R1.21 Cc1ccc(cc1F)[N+](=O)[O-] AS00243 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.21 Cc1ccc(cc1I)C(=O)C AS03923 [0,1,0,0,0,0|0,0,2]=3 206 B11R1.21 Cc1ccc(cc1I)C(=O)N AS02259 [0,1,0,0,0,0|1,0,2]=4 207 B11R1.21 Cc1ccc(cc1I)C(=O)O AS02264 [0,1,0,0,0,0|1,0,1]=3 208 B11R1.21 Cc1ccc(cc1I)[N+](=O)[O-] AS02277 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.21 Cc1ccc(cc1N)C(C)C AS05395 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.21 Cc1ccc(cc1N)[N+](=O)[O-] AS06937 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.21 Cc1ccc(cc1O)C(=O)C AS05196 [0,1,0,0,0,0|0,0,2]=3 212 B11R1.21 Cc1ccc(cc1O)C(=O)O AS01294 [0,1,0,0,0,0|1,0,1]=3 213 B11R1.21 Cc1ccc(cc1O)C(C)C AS07190 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.21 c1cc(c(cc1C(=O)O)Br)Br AS03516 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl AS00750 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.21 c1cc(c(cc1C(=O)O)Br)F AS00969 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.21 c1cc(c(cc1C(=O)O)Br)I AS03364 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.21 c1cc(c(cc1C(=O)O)Br)I AS04475 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.21 c1cc(c(cc1C(=O)O)Br)N AS00983 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Cl AS00789 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F AS00963 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.21 c1cc(c(cc1C(=O)O)Cl)N AS00982 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.21 c1cc(c(cc1C(=O)O)F)Br AS00972 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.21 c1cc(c(cc1C(=O)O)F)Cl AS02731 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.21 c1cc(c(cc1C(=O)O)F)F AS00851 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.21 c1cc(c(cc1C(=O)O)F)N AS00977 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.21 c1cc(c(cc1C(=O)O)F)O AS01857 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.21 c1cc(c(cc1C(=O)O)I)Br AS06467 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl AS06466 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.21 c1cc(c(cc1C(=O)O)I)F AS02183 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.21 c1cc(c(cc1C(=O)O)I)F AS06468 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.21 c1cc(c(cc1C(=O)O)I)I AS06469 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.21 c1cc(c(cc1C(=O)O)N)Br AS00868 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.21 c1cc(c(cc1C(=O)O)N)Cl AS00844 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.21 c1cc(c(cc1C(=O)O)N)F AS00976 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.21 c1cc(c(cc1C(=O)O)N)N AS04450 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.21 c1cc(c(cc1C(=O)O)N)O AS00843 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.21 c1cc(c(cc1C(=O)O)O)Br AS06643 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.21 c1cc(c(cc1C(=O)O)O)F AS01859 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.21 c1cc(c(cc1C(=O)O)O)N AS00858 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.22 CCC(=O)c1ccc(cc1)Br AS03828 [0,1,0,0,0,0|1,0,2]=4 242 B11R1.22 CCC(=O)c1ccc(cc1)Cl AS03849 [0,1,0,0,0,0|1,0,2]=4 243 B11R1.22 CCC(=O)c1ccc(cc1)F AS03904 [0,1,0,0,0,0|1,0,2]=4 244 B11R1.22 COC(=O)c1ccc(cc1)Br AS03617 [0,1,0,0,0,0|1,0,2]=4 245 B11R1.22 COC(=O)c1ccc(cc1)Cl AS02923 [0,1,0,0,0,0|1,0,2]=4 246 B11R1.22 COC(=O)c1ccc(cc1)F AS01318 [0,1,0,0,0,0|1,0,2]=4 247 B11R1.22 COC(=O)c1ccc(cc1)I AS02318 [0,1,0,0,0,0|1,0,2]=4 248 B11R1.22 COC(=O)c1ccc(cc1)O AS01626 [0,1,0,0,0,0|1,0,2]=4 249 B11R1.22 Cc1ccc(cc1)C(=O)CN AS05091 [0,1,0,0,0,0|0,0,2]=3 250 B11R1.22 Cc1ccc(cc1)C(=O)OC AS01339 [0,1,0,0,0,0|0,0,2]=3 251 B11R1.22 c1cc(ccc1C(=NO)N)F AS05619 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.22 c1cc(ccc1C(=O)CBr)Br AS05097 [0,1,0,0,0,0|1,0,2]=4 253 B11R1.22 c1cc(ccc1C(=O)CBr)Cl AS01180 [0,1,0,0,0,0|1,0,2]=4 254 B11R1.22 c1cc(ccc1C(=O)CBr)I AS05120 [0,1,0,0,0,0|1,0,2]=4 255 B11R1.22 c1cc(ccc1C(=O)CBr)N AS05064 [0,1,0,0,0,0|1,0,2]=4 256 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS04020 [0,1,0,0,0,0|1,0,2]=4 257 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS05102 [0,1,0,0,0,0|1,0,2]=4 258 B11R1.22 c1cc(ccc1C(=O)CCl)Cl AS05154 [0,1,0,0,0,0|1,0,2]=4 259 B11R1.22 c1cc(ccc1C(=O)CCl)O AS05143 [0,1,0,0,0,0|1,0,2]=4 260 B11R1.22 c1cc(ccc1C(=O)CN)Br AS05065 [0,1,0,0,0,0|1,0,2]=4 261 B11R1.22 c1cc(ccc1C(=O)CN)Cl AS05073 [0,1,0,0,0,0|1,0,2]=4 262 B11R1.22 c1cc(ccc1C(=O)CN)F AS05082 [0,1,0,0,0,0|1,0,2]=4 263 B11R1.22 c1cc(ccc1C(CO)O)Br AS06515 [0,1,0,0,0,0|1,0,0]=2 264 B11R1.166 B(c1ccc(cc1C)C)(O)O AS04994 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.166 B(c1ccc(cc1C)O)(O)O AS07187 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.166 B(c1ccc(cc1Cl)Cl)(O)O AS04992 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.166 B(c1ccc(cc1Cl)F)(O)O AS04981 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 B(c1ccc(cc1F)Cl)(O)O AS06029 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.166 B(c1ccc(cc1F)I)(O)O AS04985 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.166 CC(=O)c1ccc(cc1Br)Br AS03852 [0,1,0,0,0,0|1,0,2]=4 271 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01149 [0,1,0,0,0,0|1,0,2]=4 272 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01174 [0,1,0,0,0,0|1,0,2]=4 273 B11R1.166 CC(=O)c1ccc(cc1Br)N AS05248 [0,1,0,0,0,0|1,0,2]=4 274 B11R1.166 CC(=O)c1ccc(cc1Br)O AS05117 [0,1,0,0,0,0|1,0,2]=4 275 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl AS03861 [0,1,0,0,0,0|1,0,2]=4 276 B11R1.166 CC(=O)c1ccc(cc1Cl)F AS04025 [0,1,0,0,0,0|1,0,2]=4 277 B11R1.166 CC(=O)c1ccc(cc1Cl)N AS05072 [0,1,0,0,0,0|1,0,2]=4 278 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05144 [0,1,0,0,0,0|1,0,2]=4 279 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05258 [0,1,0,0,0,0|1,0,2]=4 280 B11R1.166 CC(=O)c1ccc(cc1F)Br AS01131 [0,1,0,0,0,0|1,0,2]=4 281 B11R1.166 CC(=O)c1ccc(cc1F)Cl AS04005 [0,1,0,0,0,0|1,0,2]=4 282 B11R1.166 CC(=O)c1ccc(cc1F)F AS01190 [0,1,0,0,0,0|1,0,2]=4 283 B11R1.166 CC(=O)c1ccc(cc1F)O AS01200 [0,1,0,0,0,0|1,0,2]=4 284 B11R1.166 CC(=O)c1ccc(cc1N)F AS06564 [0,1,0,0,0,0|1,0,2]=4 285 B11R1.166 CC(=O)c1ccc(cc1O)Cl AS05146 [0,1,0,0,0,0|1,0,2]=4 286 B11R1.166 CC(=O)c1ccc(cc1O)F AS01201 [0,1,0,0,0,0|1,0,2]=4 287 B11R1.166 CC(=O)c1ccc(cc1O)N AS05250 [0,1,0,0,0,0|1,0,2]=4 288 B11R1.166 CC(=O)c1ccc(cc1O)O AS01140 [0,1,0,0,0,0|1,0,2]=4 289 B11R1.166 CC(C)c1ccc(cc1O)O AS07039 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.166 CC(c1ccc(cc1Cl)Cl)N AS02890 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.166 CC(c1ccc(cc1F)F)N AS00800 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.166 C[C@H](c1ccc(cc1F)Br)N AS06792 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.166 Cc1cc(ccc1C(=O)C)Cl AS05148 [0,1,0,0,0,0|1,0,2]=4 294 B11R1.166 Cc1cc(ccc1C(=O)C)F AS01144 [0,1,0,0,0,0|1,0,2]=4 295 B11R1.166 Cc1cc(ccc1C(=O)C)F AS03900 [0,1,0,0,0,0|1,0,2]=4 296 B11R1.166 Cc1cc(ccc1C(=O)C)O AS04594 [0,1,0,0,0,0|1,0,2]=4 297 B11R1.166 Cc1cc(ccc1C(=O)O)Br AS01811 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.166 Cc1cc(ccc1C(=O)O)Cl AS00772 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.166 Cc1cc(ccc1C(=O)O)F AS01874 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.166 Cc1cc(ccc1C(=O)O)F AS04999 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O AS00875 [0,1,0,0,0,0|1,0,1]=3 302 B11R1.166 Cc1ccc(c(c1)C)C(=O)Cl AS00021 [0,1,0,0,0,0|1,0,2]=4 303 B11R1.166 Cc1ccc(c(c1)C)C(=O)O AS03894 [0,1,0,0,0,0|1,0,1]=3 304 B11R1.166 Cc1ccc(c(c1)C)C(F)F AS05714 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O AS00152 [0,1,0,0,0,0|1,0,1]=3 306 B11R1.166 Cc1ccc(c(c1)Cl)[N+](=O)[O-] AS02916 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.166 Cc1ccc(c(c1)F)C(=O)O AS00764 [0,1,0,0,0,0|1,0,1]=3 308 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] AS02078 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.166 Cc1ccc(c(c1)I)[N+](=O)[O-] AS02093 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.166 Cc1ccc(c(c1)N)C(=O)O AS00771 [0,1,0,0,0,0|1,0,1]=3 311 B11R1.166 Cc1ccc(c(c1)N)[N+](=O)[O-] AS02089 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.166 Cc1ccc(c(c1)O)C(=O)C AS05195 [0,1,0,0,0,0|0,0,2]=3 313 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O AS03514 [0,1,0,0,0,0|2,0,1]=4 314 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O AS01793 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O AS03132 [0,1,0,0,0,0|2,0,1]=4 316 B11R1.166 c1cc(c(cc1Br)F)C(=O)O AS03290 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.166 c1cc(c(cc1Br)I)C(=O)O AS00147 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.166 c1cc(c(cc1Br)N)C(=O)O AS00990 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.166 c1cc(c(cc1Br)O)C(=O)O AS00769 [0,1,0,0,0,0|2,0,1]=4 320 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O AS03128 [0,1,0,0,0,0|2,0,1]=4 321 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O AS00780 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O AS02730 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.166 c1cc(c(cc1Cl)I)C(=O)O AS03067 [0,1,0,0,0,0|2,0,1]=4 324 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O AS00756 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O AS02762 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.166 c1cc(c(cc1F)Br)C(=O)O AS00970 [0,1,0,0,0,0|2,0,1]=4 327 B11R1.166 c1cc(c(cc1F)Cl)C(=O)O AS00965 [0,1,0,0,0,0|2,0,1]=4 328 B11R1.166 c1cc(c(cc1F)F)C(=O)O AS00811 [0,1,0,0,0,0|2,0,1]=4 329 B11R1.166 c1cc(c(cc1F)I)C(=O)O AS00944 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.166 c1cc(c(cc1F)N)C(=O)O AS00975 [0,1,0,0,0,0|2,0,1]=4 331 B11R1.166 c1cc(c(cc1F)O)C(=O)O AS01858 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.166 c1cc(c(cc1I)Cl)C(=O)O AS03064 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.166 c1cc(c(cc1I)F)C(=O)O AS01860 [0,1,0,0,0,0|2,0,1]=4 334 B11R1.166 c1cc(c(cc1I)O)C(=O)O AS02196 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.166 c1cc(c(cc1N)F)C(=O)O AS01776 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.166 c1cc(c(cc1O)F)C(=O)O AS01854 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.166 c1cc(c(cc1O)I)C(=O)O AS06293 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.166 c1cc(c(cc1O)O)C(=O)O AS00962 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.20 CC(=O)Cc1ccc(cc1)F AS05241 [0,0,0,0,0,1|1,0,2]=4 340 B11R1.20 CC(=O)Nc1ccc(cc1)Br AS00912 [0,0,0,0,0,1|1,0,2]=4 341 B11R1.20 CC(=O)Nc1ccc(cc1)Cl AS02675 [0,0,0,0,0,1|1,0,2]=4 342 B11R1.20 CC(=O)Nc1ccc(cc1)F AS00825 [0,0,0,0,0,1|1,0,2]=4 343 B11R1.20 CC(=O)Nc1ccc(cc1)I AS02201 [0,0,0,0,0,1|1,0,2]=4 344 B11R1.20 CC(=O)Oc1ccc(cc1)Cl AS07036 [0,0,0,0,0,1|1,0,2]=4 345 B11R1.20 CC(=O)Oc1ccc(cc1)F AS02347 [0,0,0,0,0,1|1,0,2]=4 346 B11R1.20 CC(C)Cc1ccc(cc1)Br AS05659 [0,0,0,0,0,1|2,0,0]=3 347 B11R1.20 CC(C)Oc1ccc(cc1)N AS05394 [0,0,0,0,0,1|2,0,0]=3 348 B11R1.20 CC(Oc1ccc(cc1)Br)Cl AS03451 [0,0,0,0,0,1|2,0,0]=3 349 B11R1.20 Cc1ccc(cc1)NC(=O)C AS00879 [0,0,0,0,0,1|0,0,2]=3 350 B11R1.20 c1cc(ccc1CC(=O)O)Br AS00507 [0,0,0,0,0,1|2,0,1]=4 351 B11R1.20 c1cc(ccc1CC(=O)O)Cl AS05024 [0,0,0,0,0,1|2,0,1]=4 352 B11R1.20 c1cc(ccc1CC(=O)O)F AS00530 [0,0,0,0,0,1|2,0,1]=4 353 B11R1.20 c1cc(ccc1CC(=O)O)I AS00544 [0,0,0,0,0,1|2,0,1]=4 354 B11R1.20 c1cc(ccc1N)OC(F)F AS00470 [0,0,0,0,0,1|3,0,0]=4 355 B11R1.20 c1cc(ccc1OC(F)F)Br AS03208 [0,0,0,0,0,1|3,0,0]=4 356 B11R1.20 c1cc(ccc1OC(F)F)Cl AS02695 [0,0,0,0,0,1|3,0,0]=4 357 B11R1.20 c1cc(ccc1OC(F)F)I AS02511 [0,0,0,0,0,1|3,0,0]=4 358 B8R1.2 COc1ccccc1 AS04310 [2,0,0,0,0,0|1,0,0]=3 359 B8R1.2 COc1ccccc1 AS06877 [2,0,0,0,0,0|1,0,0]=3 360 B8R1.2 COc1ccccn1 AS01009 [2,0,0,0,0,0|2,0,0]=4 361 B8R1.2 COc1cccnc1 AS01010 [2,0,0,0,0,0|2,0,0]=4 362 B8R1.2 COc1ccncc1 AS04953 [2,0,0,0,0,0|2,0,0]=4 363 B8R1.2 CSc1ccccc1 AS04279 [2,0,0,0,0,0|1,0,0]=3 364 B8R1.2 c1ccc(cc1)C#N AS02370 [2,0,0,0,0,0|1,0,1]=4 365 B8R1.2 c1ccc(cc1)CBr AS02048 [2,0,0,0,0,0|1,0,0]=3 366 B8R1.2 c1ccc(cc1)CO AS04466 [2,0,0,0,0,0|0,0,0]=2 367 B8R1.2 c1ccc(cc1)N=O AS01444 [2,0,0,0,0,0|1,0,1]=4 368 B8R1.3 Cc1ccc(cc1)C AS00254 [2,0,0,0,0,0|0,0,0]=2 369 B8R1.3 Cc1ccc(cc1)F AS00305 [2,0,0,0,0,0|1,0,0]=3 370 B8R1.3 Cc1ccc(cc1)I AS02294 [2,0,0,0,0,0|1,0,0]=3 371 B8R1.3 Cc1ccc(cc1)N AS06931 [2,0,0,0,0,0|1,0,0]=3 372 B8R1.3 Cc1ccc(cn1)F AS04876 [2,0,0,0,0,0|2,0,0]=4 373 B8R1.3 Cc1ccc(nc1)Br AS04906 [2,0,0,0,0,0|2,0,0]=4 374 B8R1.3 Cc1ccc(nc1)F AS04850 [2,0,0,0,0,0|2,0,0]=4 375 B8R1.3 c1cc(ccc1Br)Br AS05688 [2,0,0,0,0,0|2,0,0]=4 376 B8R1.3 c1cc(ccc1Br)I AS03362 [2,0,0,0,0,0|2,0,0]=4 377 B8R1.3 c1cc(ccc1Cl)Br AS06959 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.3 c1cc(ccc1Cl)Cl AS06944 [2,0,0,0,0,0|2,0,0]=4 379 B8R1.3 c1cc(ccc1Cl)I AS03063 [2,0,0,0,0,0|2,0,0]=4 380 B8R1.3 c1cc(ccc1F)Br AS00255 [2,0,0,0,0,0|2,0,0]=4 381 B8R1.3 c1cc(ccc1F)Cl AS02729 [2,0,0,0,0,0|2,0,0]=4 382 B8R1.3 c1cc(ccc1F)F AS00245 [2,0,0,0,0,0|2,0,0]=4 383 B8R1.3 c1cc(ccc1F)I AS02180 [2,0,0,0,0,0|2,0,0]=4 384 B8R1.3 c1cc(ccc1F)S AS04129 [2,0,0,0,0,0|1,1,0]=4 385 B8R1.3 c1cc(ccc1I)I AS00081 [2,0,0,0,0,0|2,0,0]=4 386 B8R1.3 c1cc(ccc1N)Br AS00914 [2,0,0,0,0,0|2,0,0]=4 387 B8R1.3 c1cc(ccc1N)Cl AS02971 [2,0,0,0,0,0|2,0,0]=4 388 B8R1.3 c1cc(ccc1N)Cl AS06958 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.3 c1cc(ccc1N)F AS00828 [2,0,0,0,0,0|2,0,0]=4 390 B8R1.3 c1cc(ccc1N)F AS01509 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.3 c1cc(ccc1N)I AS00432 [2,0,0,0,0,0|2,0,0]=4 392 B8R1.3 c1cc(ccc1N)N AS00466 [2,0,0,0,0,0|2,0,0]=4 393 B8R1.3 c1cc(ccc1N)O AS04549 [2,0,0,0,0,0|1,0,0]=3 394 B8R1.3 c1cc(ccc1N)S AS04134 [2,0,0,0,0,0|1,1,0]=4 395 B8R1.3 c1cc(ccc1O)Cl AS00215 [2,0,0,0,0,0|1,0,0]=3 396 B8R1.3 c1cc(ccc1O)F AS00216 [2,0,0,0,0,0|1,0,0]=3 397 B8R1.3 c1cc(ccc1O)O AS00174 [2,0,0,0,0,0|1,0,0]=3 398 B8R1.3 c1cc(ccc1S)Cl AS04130 [2,0,0,0,0,0|1,1,0]=4 399 B8R1.3 c1cc(ncc1Cl)O AS04939 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.3 c1cc(ncc1F)O AS04872 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.3 c1cc(ncc1O)F AS04834 [2,0,0,0,0,0|2,0,0]=4 402 B10R1.1 CCOc1ccc(cc1)Br AS03448 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.1 CCOc1ccc(cc1)F AS02638 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.1 CCOc1ccc(cc1)I AS02282 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.1 Cc1ccc(cc1)CC#N AS01373 [1,1,0,0,0,0|0,0,1]=3 406 B10R1.1 Cc1ccc(cc1)CC#N AS06119 [1,1,0,0,0,0|0,0,1]=3 407 B10R1.1 Cc1ccc(cc1)CCBr AS06761 [1,1,0,0,0,0|0,0,0]=2 408 B10R1.1 Cc1ccc(cc1)CCN AS00487 [1,1,0,0,0,0|0,0,0]=2 409 B10R1.1 Cc1ccc(cc1)CCO AS00590 [1,1,0,0,0,0|0,0,0]=2 410 B10R1.1 c1cc(ccc1C=NO)Br AS00917 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.1 c1cc(ccc1C=NO)F AS00303 [1,1,0,0,0,0|1,0,1]=4 412 B10R1.1 c1cc(ccc1CC#N)Br AS01643 [1,1,0,0,0,0|1,0,1]=4 413 B10R1.1 c1cc(ccc1CC#N)Cl AS01379 [1,1,0,0,0,0|1,0,1]=4 414 B10R1.1 c1cc(ccc1CC#N)F AS01640 [1,1,0,0,0,0|1,0,1]=4 415 B10R1.1 c1cc(ccc1CC#N)I AS01647 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.1 c1cc(ccc1CCBr)Cl AS06011 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.1 c1cc(ccc1CCBr)F AS00126 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.1 c1cc(ccc1CCBr)F AS01797 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.1 c1cc(ccc1CCCl)Cl AS06010 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.1 c1cc(ccc1CCN)Br AS06806 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.1 c1cc(ccc1CCN)Cl AS00485 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.1 c1cc(ccc1CCN)F AS00493 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.1 c1cc(ccc1CCO)Br AS00568 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.1 c1cc(ccc1CCO)Cl AS06008 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.1 c1cc(ccc1CCO)F AS00589 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.1 c1cc(ccc1CCO)N AS00567 [1,1,0,0,0,0|1,0,0]=3 427 B10R1.1 c1cc(ccc1CCO)O AS00553 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.3 CCc1ccc(cc1)OC AS02574 [1,1,0,0,0,0|0,0,0]=2 429 B10R1.3 COc1ccc(cc1)C#N AS02378 [1,1,0,0,0,0|1,0,1]=4 430 B10R1.3 COc1ccc(cc1)C=O AS02988 [1,1,0,0,0,0|0,0,2]=4 431 B10R1.3 COc1ccc(cc1)CCl AS02049 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.3 COc1ccc(cc1)CN AS00371 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.3 COc1ccc(cc1)OC AS06962 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.3 COc1ccc(cc1)SC AS04296 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.3 CSc1ccc(cc1)CN AS06024 [1,1,0,0,0,0|1,0,0]=3 436 B10R1.3 c1cc(ccc1CBr)C#N AS00649 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.3 c1cc(ccc1CBr)CBr AS00653 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.3 c1cc(ccc1CN)C#N AS05785 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.3 c1cc(ccc1CO)CBr AS05951 [1,1,0,0,0,0|0,0,0]=2 440 B10R1.3 c1cc(ccc1CO)CO AS00556 [1,1,0,0,0,0|0,0,0]=2 441 B10R1.25 COc1ccc(cc1Br)Br AS03501 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.25 COc1ccc(cc1Br)Cl AS03118 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.25 COc1ccc(cc1Br)F AS01624 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.25 COc1ccc(cc1Br)I AS03354 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.25 COc1ccc(cc1Br)N AS03267 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.25 COc1ccc(cc1Br)N AS03385 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.25 COc1ccc(cc1Cl)Br AS03121 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.25 COc1ccc(cc1Cl)Cl AS02854 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.25 COc1ccc(cc1Cl)F AS02722 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.25 COc1ccc(cc1Cl)I AS03054 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.25 COc1ccc(cc1Cl)N AS02789 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.25 COc1ccc(cc1F)Br AS03274 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.25 COc1ccc(cc1F)Cl AS02726 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.25 COc1ccc(cc1F)F AS02507 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.25 COc1ccc(cc1F)N AS03264 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.25 COc1ccc(cc1F)N AS04085 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.25 COc1ccc(cc1F)O AS04432 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.25 COc1ccc(cc1I)Br AS03356 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.25 COc1ccc(cc1I)Cl AS03057 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.25 COc1ccc(cc1I)I AS02516 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.25 COc1ccc(cc1I)N AS02234 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.25 COc1ccc(cc1I)N AS02235 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.25 COc1ccc(cc1N)F AS04087 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.25 COc1ccc(cc1N)I AS05428 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.25 COc1ccc(cc1N)N AS04137 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.25 COc1ccc(cc1N)N AS04209 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.25 COc1ccc(cc1O)F AS00192 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.25 CSc1ccc(cc1Br)Cl AS04512 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.25 CSc1ccc(cc1F)F AS04305 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.25 Cc1cc(ccc1CN)Br AS06015 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.25 Cc1cc(ccc1CN)F AS00849 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.25 Cc1cc(ccc1CN)O AS06507 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.25 Cc1cc(ccc1CO)Br AS05952 [1,1,0,0,0,0|1,0,0]=3 474 B10R1.25 Cc1cc(ccc1CO)F AS00602 [1,1,0,0,0,0|1,0,0]=3 475 B10R1.25 Cc1cc(ccc1OC)Br AS03407 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.25 Cc1cc(ccc1OC)Cl AS02809 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.25 Cc1cc(ccc1OC)F AS04149 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.25 Cc1cc(ccc1OC)I AS02251 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.25 Cc1cc(ccc1OC)N AS00453 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.25 Cc1ccc(c(c1)Br)C=O AS06927 [1,1,0,0,0,0|0,0,2]=4 481 B10R1.25 Cc1ccc(c(c1)Br)OC AS03405 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.25 Cc1ccc(c(c1)C)CCl AS00710 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.25 Cc1ccc(c(c1)C)NN AS03280 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.25 Cc1ccc(c(c1)C)OC AS02541 [1,1,0,0,0,0|1,0,0]=3 485 B10R1.25 Cc1ccc(c(c1)Cl)C#N AS01650 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.25 Cc1ccc(c(c1)Cl)C=O AS06929 [1,1,0,0,0,0|0,0,2]=4 487 B10R1.25 Cc1ccc(c(c1)Cl)NN AS01996 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.25 Cc1ccc(c(c1)Cl)OC AS02799 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.25 Cc1ccc(c(c1)F)C#N AS01680 [1,1,0,0,0,0|1,0,1]=4 490 B10R1.25 Cc1ccc(c(c1)F)C=O AS01466 [1,1,0,0,0,0|0,0,2]=4 491 B10R1.25 Cc1ccc(c(c1)I)OC AS02092 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.25 Cc1ccc(c(c1)N)C#N AS01609 [1,1,0,0,0,0|1,0,1]=4 493 B10R1.25 c1cc(c(cc1Br)Br)CO AS03971 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.25 c1cc(c(cc1Br)F)CBr AS00654 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.25 c1cc(c(cc1Br)F)CN AS01929 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.25 c1cc(c(cc1Br)F)CN AS03304 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.25 c1cc(c(cc1Br)F)CO AS03958 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.25 c1cc(c(cc1Br)N)CO AS01411 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.25 c1cc(c(cc1Br)O)CO AS05949 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.25 c1cc(c(cc1Cl)Br)CBr AS06264 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.25 c1cc(c(cc1Cl)Cl)CBr AS00003 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.25 c1cc(c(cc1Cl)Cl)CCl AS02062 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.25 c1cc(c(cc1Cl)Cl)CO AS00605 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.25 c1cc(c(cc1Cl)F)CCl AS00670 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.25 c1cc(c(cc1Cl)F)CN AS02308 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.25 c1cc(c(cc1Cl)F)CN AS02739 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.25 c1cc(c(cc1Cl)F)CO AS00595 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.25 c1cc(c(cc1F)Br)CBr AS00655 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.25 c1cc(c(cc1F)Br)CN AS03302 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.25 c1cc(c(cc1F)Br)CO AS03955 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.25 c1cc(c(cc1F)Cl)CBr AS00679 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.25 c1cc(c(cc1F)Cl)CCl AS00671 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.25 c1cc(c(cc1F)Cl)CN AS02307 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.25 c1cc(c(cc1F)Cl)CN AS02737 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.25 c1cc(c(cc1F)Cl)CO AS03966 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.25 c1cc(c(cc1F)F)CBr AS00700 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.25 c1cc(c(cc1F)F)CCl AS00685 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.25 c1cc(c(cc1F)F)CN AS01933 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.25 c1cc(c(cc1F)F)CO AS00610 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.176 CCc1ccc(c(c1)Br)Br AS03544 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.176 CCc1ccc(c(c1)Br)Cl AS03141 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.176 CCc1ccc(c(c1)Br)I AS03255 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.176 CCc1ccc(c(c1)Br)N AS03249 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.176 CCc1ccc(c(c1)Br)N AS03250 [1,1,0,0,0,0|1,0,0]=3 525 B10R1.176 CCc1ccc(c(c1)N)O AS06527 [1,1,0,0,0,0|1,0,0]=3 526 B10R1.176 CCc1ccc(c(c1)O)Cl AS02714 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.176 CCc1ccc(c(c1)O)O AS06481 [1,1,0,0,0,0|1,0,0]=3 528 B10R1.176 CNc1ccc(c(c1)Cl)Cl AS05344 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.176 COc1ccc(c(c1)Br)Br AS03504 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.176 COc1ccc(c(c1)Br)Cl AS01807 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.176 COc1ccc(c(c1)Br)F AS05445 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.176 COc1ccc(c(c1)Br)N AS04059 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.176 COc1ccc(c(c1)Br)O AS03403 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.176 COc1ccc(c(c1)Cl)Br AS02951 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.176 COc1ccc(c(c1)Cl)Cl AS02857 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.176 COc1ccc(c(c1)Cl)F AS02724 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.176 COc1ccc(c(c1)Cl)I AS06281 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.176 COc1ccc(c(c1)Cl)N AS05414 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.176 COc1ccc(c(c1)Cl)O AS00233 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.176 COc1ccc(c(c1)F)Br AS01368 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.176 COc1ccc(c(c1)F)Br AS04321 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.176 COc1ccc(c(c1)F)Cl AS02727 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.176 COc1ccc(c(c1)F)F AS02508 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.176 COc1ccc(c(c1)F)O AS02618 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.176 COc1ccc(c(c1)I)Br AS03357 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.176 COc1ccc(c(c1)I)Cl AS03058 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.176 COc1ccc(c(c1)I)N AS05431 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.176 COc1ccc(c(c1)N)Br AS03386 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.176 COc1ccc(c(c1)N)Br AS03666 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.176 COc1ccc(c(c1)N)Br AS04115 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.176 COc1ccc(c(c1)N)Cl AS02788 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.176 COc1ccc(c(c1)N)Cl AS04068 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.176 COc1ccc(c(c1)N)F AS05424 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.176 COc1ccc(c(c1)N)N AS05476 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.176 COc1ccc(c(c1)N)N AS05477 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.176 Cc1cc(ccc1Br)OC AS01021 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.176 Cc1cc(ccc1Cl)OC AS02810 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.176 Cc1cc(ccc1F)CN AS01941 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.176 Cc1cc(ccc1F)CN AS02008 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.176 Cc1cc(ccc1F)OC AS02627 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.176 Cc1cc(ccc1N)OC AS00349 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.176 Cc1ccc(cc1Br)C#N AS02383 [1,1,0,0,0,0|1,0,1]=4 563 B10R1.176 Cc1ccc(cc1Br)C#N AS04683 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.176 Cc1ccc(cc1Br)C=O AS02205 [1,1,0,0,0,0|0,0,2]=4 565 B10R1.176 Cc1ccc(cc1Br)OC AS05453 [1,1,0,0,0,0|1,0,0]=3 566 B10R1.176 Cc1ccc(cc1C)C=O AS05590 [1,1,0,0,0,0|0,0,2]=4 567 B10R1.176 Cc1ccc(cc1C)CCl AS00712 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.176 Cc1ccc(cc1C)CN AS06971 [1,1,0,0,0,0|1,0,0]=3 569 B10R1.176 Cc1ccc(cc1C)CO AS00594 [1,1,0,0,0,0|0,0,0]=2 570 B10R1.176 Cc1ccc(cc1C)NN AS07068 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.176 Cc1ccc(cc1C)OC AS02544 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.176 Cc1ccc(cc1Cl)C=O AS02998 [1,1,0,0,0,0|0,0,2]=4 573 B10R1.176 Cc1ccc(cc1Cl)CN AS00381 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.176 Cc1ccc(cc1Cl)OC AS02808 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.176 Cc1ccc(cc1F)C#N AS01683 [1,1,0,0,0,0|1,0,1]=4 576 B10R1.176 Cc1ccc(cc1F)C#N AS02711 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.176 Cc1ccc(cc1F)CN AS06972 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.176 Cc1ccc(cc1F)NN AS02007 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.176 Cc1ccc(cc1F)OC AS02625 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.176 Cc1ccc(cc1I)C#N AS03757 [1,1,0,0,0,0|1,0,1]=4 581 B10R1.176 Cc1ccc(cc1N)C#N AS01610 [1,1,0,0,0,0|1,0,1]=4 582 B10R1.176 Cc1ccc(cc1N)OC AS05433 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.176 c1cc(c(cc1CBr)Br)F AS00658 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.176 c1cc(c(cc1CBr)Cl)Cl AS01830 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.176 c1cc(c(cc1CBr)Cl)F AS00678 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.176 c1cc(c(cc1CBr)F)Cl AS00677 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.176 c1cc(c(cc1CBr)F)F AS00702 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.176 c1cc(c(cc1CCl)Cl)Cl AS02061 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.176 c1cc(c(cc1CCl)Cl)F AS00674 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.176 c1cc(c(cc1CCl)F)Cl AS00673 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.176 c1cc(c(cc1CCl)F)F AS00687 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.176 c1cc(c(cc1CN)Br)F AS00377 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.176 c1cc(c(cc1CN)Cl)Cl AS06021 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.176 c1cc(c(cc1CN)Cl)F AS01931 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.176 c1cc(c(cc1CN)Cl)F AS02952 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.176 c1cc(c(cc1CN)F)Cl AS02305 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.176 c1cc(c(cc1CN)F)Cl AS02740 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.176 c1cc(c(cc1CN)F)F AS01934 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.176 c1cc(c(cc1CO)Br)Br AS03972 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.176 c1cc(c(cc1CO)Cl)Cl AS00608 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.176 c1cc(c(cc1CO)F)Cl AS03968 [1,1,0,0,0,0|1,0,0]=3 602 B10R1.176 c1cc(c(cc1CO)F)F AS00612 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.176 c1cc(c(cc1CO)O)I AS05984 [1,1,0,0,0,0|1,0,0]=3 604 B10R1.15 CC(CBr)c1ccccc1 AS03467 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.15 CCC(=O)c1ccccc1 AS01141 [1,1,0,0,0,0|0,0,2]=4 606 B10R1.15 CCC(C)c1ccccc1 AS05667 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.15 c1ccc(cc1)C(=NO)N AS06646 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.15 c1ccc(cc1)C(=O)CBr AS01145 [1,1,0,0,0,0|0,0,2]=4 609 B10R1.15 c1ccc(cc1)C(=O)CCl AS01163 [1,1,0,0,0,0|0,0,2]=4 610 B10R1.28 c1ccc(cc1)C(Cl)(Cl)Cl AS02920 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.28 c1ccc(cc1)C(F)(F)F AS01270 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.28 c1ccc(cc1)C(F)(F)F AS06968 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.61 B(c1ccccc1Br)(O)O AS04470 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.61 CC(=O)c1ccccc1Br AS01164 [1,1,0,0,0,0|0,0,2]=4 615 B10R1.61 CC(=O)c1ccccc1Cl AS01142 [1,1,0,0,0,0|0,0,2]=4 616 B10R1.61 CC(=O)c1ccccc1F AS01129 [1,1,0,0,0,0|0,0,2]=4 617 B10R1.61 CC(=O)c1ccccc1I AS03911 [1,1,0,0,0,0|0,0,2]=4 618 B10R1.61 CC(=O)c1ccccc1O AS01159 [1,1,0,0,0,0|0,0,2]=4 619 B10R1.61 CC(C)c1ccccc1Br AS05661 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.61 CC(c1ccccc1Br)N AS03460 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.61 CC(c1ccccc1Br)O AS03463 [1,1,0,0,0,0|0,0,0]=2 622 B10R1.61 CC(c1ccccc1Cl)N AS02835 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.61 CC(c1ccccc1Cl)O AS02837 [1,1,0,0,0,0|0,0,0]=2 624 B10R1.61 CC(c1ccccc1F)N AS00852 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.61 CC(c1ccccc1F)O AS00893 [1,1,0,0,0,0|0,0,0]=2 626 B10R1.61 CN(C)c1ccccc1F AS05364 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.61 C[C@H](c1ccccc1O)N AS06796 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.61 c1ccc(c(c1)C(=O)O)Br AS00760 [1,1,0,0,0,0|1,0,1]=4 629 B10R1.61 c1ccc(c(c1)C(=O)O)Cl AS00802 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.61 c1ccc(c(c1)C(=O)O)F AS00814 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.61 c1ccc(c(c1)C(=O)O)I AS02216 [1,1,0,0,0,0|1,0,1]=4 632 B10R1.113 CC(=O)c1cccc(c1)Br AS01168 [1,1,0,0,0,0|0,0,2]=4 633 B10R1.113 CC(=O)c1cccc(c1)Cl AS03831 [1,1,0,0,0,0|0,0,2]=4 634 B10R1.113 CC(=O)c1cccc(c1)F AS01151 [1,1,0,0,0,0|0,0,2]=4 635 B10R1.113 CC(=O)c1cccc(c1)I AS04040 [1,1,0,0,0,0|0,0,2]=4 636 B10R1.113 CC(=O)c1cccc(c1)O AS01139 [1,1,0,0,0,0|0,0,2]=4 637 B10R1.113 CC(C)c1cccc(c1)Br AS05658 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.113 CC(C)c1cccc(n1)Br AS06182 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.113 CC(c1cccc(c1)Br)N AS03461 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.113 CC(c1cccc(c1)Br)O AS03464 [1,1,0,0,0,0|0,0,0]=2 641 B10R1.113 CC(c1cccc(c1)Cl)O AS02838 [1,1,0,0,0,0|0,0,0]=2 642 B10R1.113 CC(c1cccc(c1)F)N AS00853 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.113 CC(c1cccc(c1)F)N AS06027 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.113 CC(c1cccc(c1)F)O AS00894 [1,1,0,0,0,0|0,0,0]=2 645 B10R1.113 Cc1cccc(c1)C(=O)C AS04042 [1,1,0,0,0,0|0,0,2]=4 646 B10R1.113 Cc1cccc(c1)C(=O)O AS00863 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.113 c1cc(cc(c1)Br)C(=O)O AS01127 [1,1,0,0,0,0|1,0,1]=4 648 B10R1.113 c1cc(cc(c1)Cl)C(=O)O AS00810 [1,1,0,0,0,0|1,0,1]=4 649 B10R1.113 c1cc(cc(c1)F)C(=O)O AS00742 [1,1,0,0,0,0|1,0,1]=4 650 B10R1.113 c1cc(cc(c1)F)C(=O)O AS01279 [1,1,0,0,0,0|1,0,1]=4 651 B10R1.113 c1cc(cc(c1)F)C(F)F AS05706 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.113 c1cc(cc(c1)I)C(=O)O AS02217 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.113 c1cc(cc(c1)N)C(=O)O AS00862 [1,1,0,0,0,0|1,0,1]=4 654 B12R1.4 CC(=O)Nc1ccc(cc1)OC AS00987 [0,1,0,0,0,1|0,0,2]=4 655 B12R1.4 CC(C)Oc1ccc(cc1)C#N AS03769 [0,1,0,0,0,1|1,0,1]=4 656 B12R1.4 CC(C)Oc1ccc(cc1)C=O AS03945 [0,1,0,0,0,1|1,0,1]=4 657 B12R1.4 CC(C)Oc1ccc(cc1)CO AS04001 [0,1,0,0,0,1|1,0,0]=3 658 B12R1.4 CCc1ccc(cc1)CC(=O)C AS05185 [0,1,0,0,0,1|0,0,2]=4 659 B12R1.4 c1cc(ccc1CBr)OC(F)F AS00698 [0,1,0,0,0,1|2,0,0]=4 660 B12R1.4 c1cc(ccc1CC(=O)O)CBr AS00533 [0,1,0,0,0,1|1,0,1]=4 661 B12R1.4 c1cc(ccc1CN)OC(F)F AS02244 [0,1,0,0,0,1|2,0,0]=4 662 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl AS03171 [0,1,0,0,0,1|2,0,0]=4 663 B12R1.19 CC(C)Oc1ccc(c(c1)F)F AS02514 [0,1,0,0,0,1|2,0,0]=4 664 B12R1.19 Cc1ccc(cc1C)CC(=O)O AS06102 [0,1,0,0,0,1|1,0,1]=4 665 B12R1.19 Cc1ccc(cc1F)NC(=O)C AS06994 [0,1,0,0,0,1|0,0,2]=4 666 B12R1.20 Cc1ccc(cc1)C(C(=O)O)N AS06783 [0,1,0,0,0,1|1,0,1]=4 667 B12R1.106 CC(C)(C)Oc1ccc(cc1)Br AS05671 [0,1,0,0,0,1|2,0,0]=4 668 B12R1.106 Cc1ccc(cc1)OC(C)(C)C AS01012 [0,1,0,0,0,1|1,0,0]=3 669 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl AS03170 [0,1,0,0,0,1|2,0,0]=4 670 B12R1.233 CC(C)Oc1ccc(cc1Br)F AS03332 [0,1,0,0,0,1|2,0,0]=4 671 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br AS03172 [0,1,0,0,0,1|2,0,0]=4 672 B12R1.233 CC(C)Oc1ccc(cc1Cl)F AS02756 [0,1,0,0,0,1|2,0,0]=4 673 B12R1.233 CC(C)Oc1ccc(cc1F)Br AS03333 [0,1,0,0,0,1|2,0,0]=4 674 B12R1.233 CC(C)Oc1ccc(cc1F)F AS02513 [0,1,0,0,0,1|2,0,0]=4 675 B12R1.233 Cc1ccc(c(c1)Br)NC(=O)C AS03408 [0,1,0,0,0,1|0,0,2]=4 676 B12R1.233 Cc1ccc(c(c1)Cl)NC(=O)C AS02800 [0,1,0,0,0,1|0,0,2]=4 677 B12R1.233 Cc1ccc(c(c1)F)CC(=O)O AS01083 [0,1,0,0,0,1|1,0,1]=4 678 B12R1.5 CCc1ccc(cc1)C(=O)CC AS05277 [0,2,0,0,0,0|0,0,2]=4 679 B12R1.5 COC(=O)c1ccc(cc1)CBr AS02422 [0,2,0,0,0,0|0,0,2]=4 680 B12R1.5 COc1ccc(cc1)C(=O)CBr AS04022 [0,2,0,0,0,0|0,0,2]=4 681 B12R1.5 COc1ccc(cc1)C(=O)CBr AS05122 [0,2,0,0,0,0|0,0,2]=4 682 B12R1.5 COc1ccc(cc1)C(=O)CCl AS01440 [0,2,0,0,0,0|0,0,2]=4 683 B12R1.5 COc1ccc(cc1)C(=O)OC AS02499 [0,2,0,0,0,0|0,0,2]=4 684 B12R1.6 CC(C)(C)c1ccc(cc1)C=O AS03004 [0,2,0,0,0,0|1,0,1]=4 685 B12R1.6 CC(C)(C)c1ccc(cc1)OC AS01006 [0,2,0,0,0,0|1,0,0]=3 686 B12R1.6 CNc1ccc(cc1)C(F)(F)F AS01514 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.6 COc1ccc(cc1)C(F)(F)F AS01416 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.6 CS(=O)(=O)c1ccc(cc1)CO AS00561 [0,2,0,0,0,0|1,0,1]=4 689 B12R1.6 CSc1ccc(cc1)C(F)(F)F AS04278 [0,2,0,0,0,0|2,0,0]=4 690 B12R1.6 c1cc(ccc1CBr)C(F)(F)F AS00690 [0,2,0,0,0,0|2,0,0]=4 691 B12R1.6 c1cc(ccc1CCl)C(F)(F)F AS00639 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.6 c1cc(ccc1CN)C(F)(F)F AS00473 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.6 c1cc(ccc1CN)C(F)(F)F AS00887 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.6 c1cc(ccc1CN)C(F)(F)F AS01947 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.6 c1cc(ccc1CO)C(F)(F)F AS00565 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.48 CC(=O)c1ccc(c(c1)F)OC AS01207 [0,2,0,0,0,0|0,0,2]=4 697 B12R1.48 CC(c1ccc(c(c1)F)OC)N AS02620 [0,2,0,0,0,0|1,0,0]=3 698 B12R1.48 COc1ccc(cc1Br)C(=O)O AS03392 [0,2,0,0,0,0|1,0,1]=4 699 B12R1.48 COc1ccc(cc1Cl)C(=O)O AS02793 [0,2,0,0,0,0|1,0,1]=4 700 B12R1.48 COc1ccc(cc1F)C(=O)O AS02486 [0,2,0,0,0,0|1,0,1]=4 701 B12R1.48 COc1ccc(cc1I)C(=O)O AS02240 [0,2,0,0,0,0|1,0,1]=4 702 B12R1.48 Cc1cc(ccc1OC)C(=O)O AS01296 [0,2,0,0,0,0|1,0,1]=4 703 B12R1.113 B(c1ccc(cc1)CCC)(O)O AS04593 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.113 CCOc1ccc(cc1)C(=O)C AS01130 [0,2,0,0,0,0|0,0,2]=4 705 B12R1.113 CCOc1ccc(cc1)C(=O)C AS01166 [0,2,0,0,0,0|0,0,2]=4 706 B12R1.113 CCOc1ccc(cc1)C(=O)O AS02555 [0,2,0,0,0,0|1,0,1]=4 707 B12R1.256 B(c1ccc(cc1)N(C)C)(O)O AS06511 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.452 CC(=O)c1ccc(cc1F)OC AS01205 [0,2,0,0,0,0|0,0,2]=4 709 B12R1.452 CC(=O)c1ccc(cc1N)OC AS05088 [0,2,0,0,0,0|0,0,2]=4 710 B12R1.452 CC(=O)c1ccc(cc1O)OC AS05193 [0,2,0,0,0,0|0,0,2]=4 711 B12R1.452 CC(C)c1ccc(cc1F)OC AS02621 [0,2,0,0,0,0|1,0,0]=3 712 B12R1.452 CC(c1ccc(cc1F)OC)N AS02619 [0,2,0,0,0,0|1,0,0]=3 713 B12R1.452 COc1ccc(c(c1)Br)C(=O)O AS04623 [0,2,0,0,0,0|1,0,1]=4 714 B12R1.452 COc1ccc(c(c1)F)C(=O)O AS02487 [0,2,0,0,0,0|1,0,1]=4 715 B12R1.452 COc1ccc(c(c1)F)C(=O)O AS02597 [0,2,0,0,0,0|1,0,1]=4 716 B12R1.452 COc1ccc(c(c1)N)C(=O)O AS04457 [0,2,0,0,0,0|1,0,1]=4 717 B12R1.452 Cc1cc(ccc1C(=O)O)OC AS07027 [0,2,0,0,0,0|1,0,1]=4 718 B12R1.23 CC(C)(C)c1ccc(c(c1)Br)Br AS05689 [0,2,0,0,0,0|2,0,0]=4 719 B12R1.23 CC(C)(C)c1ccc(c(c1)Br)N AS05284 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.23 CC(C)(C)c1ccc(c(c1)Br)O AS00232 [0,2,0,0,0,0|2,0,0]=4 721 B12R1.23 CC(C)(C)c1ccc(c(c1)Cl)Cl AS06299 [0,2,0,0,0,0|2,0,0]=4 722 B12R1.23 CC(C)(C)c1ccc(c(c1)Cl)O AS00166 [0,2,0,0,0,0|2,0,0]=4 723 B12R1.23 CC(C)(C)c1ccc(c(c1)N)N AS04401 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.23 CC(C)(C)c1ccc(c(c1)O)Br AS06565 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.23 Cc1ccc(cc1Br)C(F)(F)F AS05918 [0,2,0,0,0,0|2,0,0]=4 726 B12R1.23 Cc1ccc(cc1N)C(F)(F)F AS04101 [0,2,0,0,0,0|2,0,0]=4 727 B12R1.23 Cc1ccc(cc1O)C(F)(F)F AS06538 [0,2,0,0,0,0|2,0,0]=4 728 B12R1.126 Cc1ccc(c(c1)Cl)C(F)(F)F AS01746 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.56 Cc1ccc(cc1C#C)C(=O)O AS07172 [0,2,0,0,0,0|1,0,1]=4 730 B12R1.56 Cc1ccc(cc1OC)C(=O)O AS01295 [0,2,0,0,0,0|1,0,1]=4 731 B12R1.232 Cc1cc(c(cc1C(=O)O)Br)C AS06300 [0,2,0,0,0,0|1,0,1]=4 732 B12R1.232 Cc1cc(c(cc1C)O)C(=O)C AS05182 [0,2,0,0,0,0|0,0,2]=4 733 B12R1.232 Cc1cc(c(cc1F)C(=O)O)F AS01850 [0,2,0,0,0,0|1,0,1]=4 734 B12R1.232 Cc1cc(c(cc1F)C(=O)O)F AS05005 [0,2,0,0,0,0|1,0,1]=4 735 B12R1.367 Cc1ccc(cc1Br)C(=O)OC AS03641 [0,2,0,0,0,0|0,0,2]=4 736 B12R1.367 Cc1ccc(cc1Cl)C(=O)OC AS00791 [0,2,0,0,0,0|0,0,2]=4 737 B12R1.367 Cc1ccc(cc1F)C(=O)CCl AS05140 [0,2,0,0,0,0|0,0,2]=4 738 B12R1.367 Cc1ccc(cc1I)C(=O)OC AS01247 [0,2,0,0,0,0|0,0,2]=4 739 B12R1.893 Cc1ccc(c(c1C)N)C(=O)O AS01774 [0,2,0,0,0,0|1,0,1]=4 740 B12R1.893 Cc1ccc(c(c1F)F)C(=O)C AS05174 [0,2,0,0,0,0|0,0,2]=4 741 B12R1.1005 CC(C)c1cc(c(c(c1)Br)N)Br AS05341 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.1005 Cc1c(cc(cc1Br)C(=O)O)Br AS03572 [0,2,0,0,0,0|1,0,1]=4 743 B12R1.1005 Cc1c(cc(cc1Cl)C(=O)O)Cl AS00744 [0,2,0,0,0,0|1,0,1]=4 744 B12R1.1005 Cc1c(cc(cc1I)C(=O)O)Br AS03368 [0,2,0,0,0,0|1,0,1]=4 745 B12R1.1005 Cc1c(cc(cc1I)C(=O)O)F AS04996 [0,2,0,0,0,0|1,0,1]=4 746 B12R1.1005 Cc1c(cc(cc1I)C(=O)O)I AS02140 [0,2,0,0,0,0|1,0,1]=4 747 B12R1.1005 Cc1c(cc(cc1O)C(=O)O)O AS01213 [0,2,0,0,0,0|1,0,1]=4 748 B12R1.12 COC(c1ccc(cc1)Br)OC AS03782 [0,2,0,0,0,0|1,0,0]=3 749 B12R1.12 COC(c1ccc(cc1)I)OC AS03919 [0,2,0,0,0,0|1,0,0]=3 750 B12R1.16 CCOC(=O)c1ccc(cc1)C AS01277 [0,2,0,0,0,0|0,0,2]=4 751 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CBr AS05109 [0,2,0,0,0,0|0,0,2]=4 752 B12R1.57 CC(C)c1ccc(cc1OC)F AS02622 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C AS00884 [0,2,0,0,0,0|2,0,0]=4 754 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C AS06278 [0,2,0,0,0,0|1,0,1]=4 755 B10R1.18 CC(Cc1ccccc1)O AS07220 [1,0,0,0,0,1|0,0,0]=2