0 B10R1.3 CCc1ccc(cc1)OC AS02574 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.3 COc1ccc(cc1)C#N AS02378 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.3 COc1ccc(cc1)C=O AS02988 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.3 COc1ccc(cc1)CCl AS02049 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.3 COc1ccc(cc1)CN AS00371 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.3 COc1ccc(cc1)OC AS06962 [0,0,0,0,0,0|0,0,0]=0 6 B10R1.3 COc1ccc(cc1)SC AS04296 [0,0,0,0,0,0|0,1,0]=1 7 B10R1.3 CSc1ccc(cc1)CN AS06024 [0,0,0,0,0,0|2,1,0]=3 8 B10R1.3 c1cc(ccc1C=O)C#N AS02996 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.3 c1cc(ccc1CBr)C#N AS00649 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.3 c1cc(ccc1CBr)CBr AS00653 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.3 c1cc(ccc1CN)C#N AS05785 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.3 c1cc(ccc1CO)CBr AS05951 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.3 c1cc(ccc1CO)CO AS00556 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.1 C#Cc1ccc(cc1)F AS00454 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.1 C#Cc1ccc(cc1)N AS04615 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.1 C=Cc1ccc(cc1)Br AS03806 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.1 C=Cc1ccc(cc1)F AS03795 [1,0,0,0,0,0|2,0,1]=4 18 B9R1.1 CCc1ccc(cc1)Br AS03254 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.1 CCc1ccc(cc1)F AS04424 [1,0,0,0,0,0|2,0,0]=3 20 B9R1.1 CCc1ccc(cc1)I AS02159 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.1 CNc1ccc(cc1)I AS05390 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.1 COc1ccc(cc1)Br AS02358 [1,0,0,0,0,0|1,0,0]=2 23 B9R1.1 COc1ccc(cc1)Cl AS01802 [1,0,0,0,0,0|1,0,0]=2 24 B9R1.1 COc1ccc(cc1)F AS02586 [1,0,0,0,0,0|1,0,0]=2 25 B9R1.1 COc1ccc(cc1)I AS02208 [1,0,0,0,0,0|1,0,0]=2 26 B9R1.1 COc1ccc(cc1)O AS04576 [1,0,0,0,0,0|0,0,0]=1 27 B9R1.1 COc1ccc(cn1)Br AS03404 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.1 COc1ccc(cn1)F AS04877 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.1 COc1ccc(nc1)Br AS04912 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.1 CSc1ccc(cc1)Br AS04293 [1,0,0,0,0,0|1,1,0]=3 31 B9R1.1 CSc1ccc(cc1)Cl AS04289 [1,0,0,0,0,0|1,1,0]=3 32 B9R1.1 CSc1ccc(cc1)F AS04286 [1,0,0,0,0,0|1,1,0]=3 33 B9R1.1 CSc1ccc(cc1)N AS04283 [1,0,0,0,0,0|1,1,0]=3 34 B9R1.1 Cc1ccc(cc1)C#N AS03761 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.1 Cc1ccc(cc1)C=O AS02824 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.1 Cc1ccc(cc1)CCl AS00637 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.1 Cc1ccc(cc1)SC AS04302 [1,0,0,0,0,0|0,1,0]=2 38 B9R1.1 Cc1ccc(nc1)C#N AS04709 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.1 c1cc(ccc1C#N)Br AS03698 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.1 c1cc(ccc1C#N)Cl AS02369 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.1 c1cc(ccc1C#N)F AS03736 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.1 c1cc(ccc1C#N)I AS03752 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.1 c1cc(ccc1C#N)N AS02646 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.1 c1cc(ccc1C#N)O AS02647 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.1 c1cc(ccc1C=O)Br AS02893 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.1 c1cc(ccc1C=O)Cl AS02986 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.1 c1cc(ccc1C=O)F AS02846 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 c1cc(ccc1C=O)F AS03001 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.1 c1cc(ccc1C=O)I AS03916 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.1 c1cc(ccc1C=O)N AS06990 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.1 c1cc(ccc1C=O)O AS02994 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.1 c1cc(ccc1CBr)Br AS02044 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.1 c1cc(ccc1CBr)Cl AS02046 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 c1cc(ccc1CBr)F AS00664 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 c1cc(ccc1CBr)I AS00645 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.1 c1cc(ccc1CCl)Br AS00646 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 c1cc(ccc1CCl)F AS00660 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 c1cc(ccc1CCl)F AS02054 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 c1cc(ccc1CN)Br AS02268 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 c1cc(ccc1CN)Br AS03103 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 c1cc(ccc1CN)Br AS06970 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.1 c1cc(ccc1CN)Cl AS00379 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.1 c1cc(ccc1CN)Cl AS02689 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.1 c1cc(ccc1CN)F AS00834 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.1 c1cc(ccc1CN)F AS01938 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.1 c1cc(ccc1CN)I AS02223 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 c1cc(ccc1CN)I AS02301 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.1 c1cc(ccc1CO)Br AS03954 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.1 c1cc(ccc1CO)Cl AS03965 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.1 c1cc(ccc1CO)F AS03978 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.1 c1cc(ccc1CO)I AS00604 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.1 c1cc(ccc1CO)I AS03987 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.1 c1cc(ccc1CO)N AS00548 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.1 c1cc(ccc1CO)O AS00576 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.1 c1cc(ccc1NN)Br AS02015 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.1 c1cc(ccc1NN)Cl AS04469 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.1 c1cc(ccc1NN)F AS02961 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.1 c1cc(ccc1OS)I AS02948 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.3 CC(=O)c1ccc(cc1)C#N AS05151 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.3 CC(C)c1ccc(cc1)C#C AS06788 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.3 CC(C)c1ccc(cc1)NN AS02450 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.3 CC(C)c1ccc(cc1)OC AS01008 [0,1,0,0,0,0|1,0,0]=2 83 B11R1.3 CC(c1ccc(cc1)OC)N AS04622 [0,1,0,0,0,0|1,0,0]=2 84 B11R1.3 CCc1ccc(cc1)C(=O)C AS03877 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.3 CCc1ccc(cc1)C(C)N AS00822 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.3 CN(C)c1ccc(cc1)C#N AS02379 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.3 CN(C)c1ccc(cc1)C=O AS02845 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.3 CN(C)c1ccc(cc1)OC AS04610 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] AS04616 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.3 COc1ccc(cc1)C(=O)Cl AS00015 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.3 COc1ccc(cc1)C(=O)O AS00727 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.3 COc1ccc(cc1)C(=O)O AS03913 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] AS01804 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.3 COc1ccc(cn1)C(=O)O AS01298 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.3 CSc1ccc(cc1)[N+](=O)[O-] AS04280 [0,1,0,0,0,0|2,1,0]=4 96 B11R1.3 C[C@H](c1ccc(cc1)OC)N AS04502 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.83 CCOc1ccc(cc1)CO AS05972 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.83 COc1ccc(cc1)CC#N AS01654 [0,1,0,0,0,0|1,0,1]=3 99 B11R1.83 COc1ccc(cc1)CC=O AS04419 [0,1,0,0,0,0|1,0,1]=3 100 B11R1.83 c1cc(ccc1CCO)C=O AS04409 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.279 COc1ccc(c(c1)Br)C=O AS05539 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.279 COc1ccc(c(c1)Br)OC AS06963 [0,1,0,0,0,0|0,0,0]=1 103 B11R1.279 COc1ccc(c(c1)Cl)C#N AS01648 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.279 COc1ccc(c(c1)Cl)C=O AS05556 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.279 COc1ccc(c(c1)F)C#N AS02602 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.279 COc1ccc(c(c1)F)C#N AS04965 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.279 COc1ccc(c(c1)F)C=O AS03035 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.279 COc1ccc(c(c1)F)CBr AS07192 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.279 COc1ccc(c(c1)F)CCl AS00667 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.279 COc1ccc(c(c1)F)CN AS02606 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.279 COc1ccc(c(c1)F)CO AS03980 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.279 COc1ccc(c(c1)F)NN AS06155 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.279 COc1ccc(c(c1)F)OC AS02400 [0,1,0,0,0,0|0,0,0]=1 114 B11R1.279 COc1ccc(c(c1)I)C#N AS06294 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.279 COc1ccc(c(c1)O)C#N AS06261 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.279 COc1ccc(c(c1)O)OC AS06540 [0,1,0,0,0,0|0,0,0]=1 117 B11R1.279 COc1ccc(cc1Br)C#N AS03707 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.279 COc1ccc(cc1Br)C=O AS03008 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.279 COc1ccc(cc1Br)CN AS03398 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.279 COc1ccc(cc1Br)CO AS03961 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.279 COc1ccc(cc1Cl)C#N AS03721 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.279 COc1ccc(cc1Cl)C=O AS03845 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.279 COc1ccc(cc1Cl)C=O AS05559 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.279 COc1ccc(cc1Cl)CN AS02796 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.279 COc1ccc(cc1Cl)CO AS03969 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.279 COc1ccc(cc1F)C#N AS03741 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.279 COc1ccc(cc1F)C=O AS03032 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.279 COc1ccc(cc1F)CBr AS00641 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.279 COc1ccc(cc1F)CCl AS00669 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.279 COc1ccc(cc1F)CN AS02608 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.279 COc1ccc(cc1I)C#N AS03753 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.279 COc1ccc(cc1I)C=O AS03921 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.279 COc1ccc(cc1I)CN AS02248 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.279 COc1ccc(cc1I)CO AS03988 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.279 COc1ccc(cc1O)C#N AS02385 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.279 Cc1cc(ccc1C#N)OC AS07023 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.279 Cc1cc(ccc1C=O)OC AS02210 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.279 Cc1cc(ccc1C=O)OC AS07028 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.279 Cc1cc(ccc1OC)C#N AS03767 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.279 Cc1cc(ccc1OC)C=O AS02783 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.279 Cc1cc(ccc1OC)OC AS02031 [0,1,0,0,0,0|0,0,0]=1 142 B9R0.24 COC(=O)C=CC(=O)OC AS01220 [0,0,1,0,0,0|2,0,0]=3 143 B8R1.2 COc1ccccc1 AS04310 [2,0,0,0,0,0|0,0,0]=2 144 B8R1.2 COc1ccccc1 AS06877 [2,0,0,0,0,0|0,0,0]=2 145 B8R1.2 COc1ccccn1 AS01009 [2,0,0,0,0,0|1,0,0]=3 146 B8R1.2 COc1cccnc1 AS01010 [2,0,0,0,0,0|1,0,0]=3 147 B8R1.2 COc1ccncc1 AS04953 [2,0,0,0,0,0|1,0,0]=3 148 B8R1.2 CSc1ccccc1 AS04279 [2,0,0,0,0,0|0,1,0]=3 149 B8R1.2 c1ccc(cc1)C#N AS02370 [2,0,0,0,0,0|2,0,0]=4 150 B8R1.2 c1ccc(cc1)CBr AS02048 [2,0,0,0,0,0|2,0,0]=4 151 B8R1.2 c1ccc(cc1)CO AS04466 [2,0,0,0,0,0|2,0,0]=4 152 B8R1.2 c1ccc(cc1)N=O AS01444 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.3 Cc1ccc(cc1)C AS00254 [2,0,0,0,0,0|0,0,0]=2 154 B8R1.3 Cc1ccc(cc1)F AS00305 [2,0,0,0,0,0|1,0,0]=3 155 B8R1.3 Cc1ccc(cc1)I AS02294 [2,0,0,0,0,0|1,0,0]=3 156 B8R1.3 Cc1ccc(cc1)N AS06931 [2,0,0,0,0,0|1,0,0]=3 157 B8R1.3 Cc1ccc(cn1)F AS04876 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.3 Cc1ccc(nc1)Br AS04906 [2,0,0,0,0,0|2,0,0]=4 159 B8R1.3 Cc1ccc(nc1)F AS04850 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.3 c1cc(ccc1Br)Br AS05688 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.3 c1cc(ccc1Br)I AS03362 [2,0,0,0,0,0|2,0,0]=4 162 B8R1.3 c1cc(ccc1Cl)Br AS06959 [2,0,0,0,0,0|2,0,0]=4 163 B8R1.3 c1cc(ccc1Cl)Cl AS06944 [2,0,0,0,0,0|2,0,0]=4 164 B8R1.3 c1cc(ccc1Cl)I AS03063 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.3 c1cc(ccc1F)Br AS00255 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.3 c1cc(ccc1F)Cl AS02729 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.3 c1cc(ccc1F)F AS00245 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.3 c1cc(ccc1F)I AS02180 [2,0,0,0,0,0|2,0,0]=4 169 B8R1.3 c1cc(ccc1F)S AS04129 [2,0,0,0,0,0|1,1,0]=4 170 B8R1.3 c1cc(ccc1I)I AS00081 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.3 c1cc(ccc1N)Br AS00914 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.3 c1cc(ccc1N)Cl AS02971 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.3 c1cc(ccc1N)Cl AS06958 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.3 c1cc(ccc1N)F AS00828 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.3 c1cc(ccc1N)F AS01509 [2,0,0,0,0,0|2,0,0]=4 176 B8R1.3 c1cc(ccc1N)I AS00432 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.3 c1cc(ccc1N)N AS00466 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.3 c1cc(ccc1N)O AS04549 [2,0,0,0,0,0|1,0,0]=3 179 B8R1.3 c1cc(ccc1N)S AS04134 [2,0,0,0,0,0|1,1,0]=4 180 B8R1.3 c1cc(ccc1O)Cl AS00215 [2,0,0,0,0,0|1,0,0]=3 181 B8R1.3 c1cc(ccc1O)F AS00216 [2,0,0,0,0,0|1,0,0]=3 182 B8R1.3 c1cc(ccc1O)O AS00174 [2,0,0,0,0,0|0,0,0]=2 183 B8R1.3 c1cc(ccc1S)Cl AS04130 [2,0,0,0,0,0|1,1,0]=4 184 B8R1.3 c1cc(ncc1Cl)O AS04939 [2,0,0,0,0,0|2,0,0]=4 185 B8R1.3 c1cc(ncc1F)O AS04872 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.3 c1cc(ncc1O)F AS04834 [2,0,0,0,0,0|2,0,0]=4 187 B10R1.1 CCOc1ccc(cc1)Br AS03448 [1,1,0,0,0,0|1,0,0]=3 188 B10R1.1 CCOc1ccc(cc1)F AS02638 [1,1,0,0,0,0|1,0,0]=3 189 B10R1.1 CCOc1ccc(cc1)I AS02282 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.1 Cc1ccc(cc1)CC#N AS01373 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.1 Cc1ccc(cc1)CC#N AS06119 [1,1,0,0,0,0|1,0,1]=4 192 B10R1.1 Cc1ccc(cc1)CCBr AS06761 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.1 Cc1ccc(cc1)CCN AS00487 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.1 Cc1ccc(cc1)CCO AS00590 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.1 c1cc(ccc1CCBr)Cl AS06011 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.1 c1cc(ccc1CCBr)F AS00126 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.1 c1cc(ccc1CCBr)F AS01797 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.1 c1cc(ccc1CCCl)Cl AS06010 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.1 c1cc(ccc1CCN)Br AS06806 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.1 c1cc(ccc1CCN)Cl AS00485 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.1 c1cc(ccc1CCN)F AS00493 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.1 c1cc(ccc1CCO)Br AS00568 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.1 c1cc(ccc1CCO)Cl AS06008 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.1 c1cc(ccc1CCO)F AS00589 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.1 c1cc(ccc1CCO)N AS00567 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.1 c1cc(ccc1CCO)O AS00553 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.13 B(c1ccc(cc1)C)(O)O AS07183 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.13 B(c1ccc(cc1)O)(O)O AS06272 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.13 CC(=C)c1ccc(cc1)O AS06541 [1,1,0,0,0,0|1,0,0]=3 210 B10R1.13 CC(=O)c1ccc(cc1)Br AS01178 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.13 CC(=O)c1ccc(cc1)Cl AS05257 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.13 CC(=O)c1ccc(cc1)F AS01160 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.13 CC(=O)c1ccc(cc1)I AS04012 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.13 CC(=O)c1ccc(cc1)N AS01150 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.13 CC(=O)c1ccc(cc1)O AS01158 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.13 CC(=O)c1ccc(nc1)O AS04944 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.13 CC(C)c1ccc(cc1)I AS02289 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.13 CC(C)c1ccc(cc1)S AS00078 [1,1,0,0,0,0|1,1,0]=4 219 B10R1.13 CC(c1ccc(cc1)Br)N AS03462 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.13 CC(c1ccc(cc1)Br)O AS03465 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.13 CC(c1ccc(cc1)Cl)Br AS06898 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.13 CC(c1ccc(cc1)Cl)N AS02836 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.13 CC(c1ccc(cc1)Cl)O AS02839 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.13 CC(c1ccc(cc1)F)O AS00895 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.13 CN(C)c1ccc(cc1)Cl AS05322 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.13 CN(C)c1ccc(cc1)O AS06531 [1,1,0,0,0,0|1,0,0]=3 227 B10R1.13 Cc1ccc(cc1)C(=O)C AS01165 [1,1,0,0,0,0|1,0,0]=3 228 B10R1.13 Cc1ccc(cc1)C(=O)Cl AS00020 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.13 Cc1ccc(cc1)C(=O)N AS05901 [1,1,0,0,0,0|2,0,0]=4 230 B10R1.13 Cc1ccc(cc1)C(=O)O AS00864 [1,1,0,0,0,0|2,0,0]=4 231 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] AS01013 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.13 c1cc(ccc1[N+](=O)[O-])O AS00220 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.25 COc1c(cc(cn1)F)Br AS04795 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.25 COc1c(cc(cn1)F)O AS04881 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.25 COc1c(cc(cn1)N)Br AS04900 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.25 COc1ccc(cc1Br)Br AS03501 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.25 COc1ccc(cc1Br)Cl AS03118 [1,1,0,0,0,0|1,0,0]=3 238 B10R1.25 COc1ccc(cc1Br)F AS01624 [1,1,0,0,0,0|1,0,0]=3 239 B10R1.25 COc1ccc(cc1Br)I AS03354 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.25 COc1ccc(cc1Br)N AS03267 [1,1,0,0,0,0|1,0,0]=3 241 B10R1.25 COc1ccc(cc1Br)N AS03385 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.25 COc1ccc(cc1Cl)Br AS03121 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.25 COc1ccc(cc1Cl)Cl AS02854 [1,1,0,0,0,0|1,0,0]=3 244 B10R1.25 COc1ccc(cc1Cl)F AS02722 [1,1,0,0,0,0|1,0,0]=3 245 B10R1.25 COc1ccc(cc1Cl)I AS03054 [1,1,0,0,0,0|1,0,0]=3 246 B10R1.25 COc1ccc(cc1Cl)N AS02789 [1,1,0,0,0,0|1,0,0]=3 247 B10R1.25 COc1ccc(cc1F)Br AS03274 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.25 COc1ccc(cc1F)Cl AS02726 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.25 COc1ccc(cc1F)F AS02507 [1,1,0,0,0,0|1,0,0]=3 250 B10R1.25 COc1ccc(cc1F)N AS03264 [1,1,0,0,0,0|1,0,0]=3 251 B10R1.25 COc1ccc(cc1F)N AS04085 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.25 COc1ccc(cc1F)O AS04432 [1,1,0,0,0,0|0,0,0]=2 253 B10R1.25 COc1ccc(cc1I)Br AS03356 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.25 COc1ccc(cc1I)Cl AS03057 [1,1,0,0,0,0|1,0,0]=3 255 B10R1.25 COc1ccc(cc1I)I AS02516 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.25 COc1ccc(cc1I)N AS02234 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.25 COc1ccc(cc1I)N AS02235 [1,1,0,0,0,0|1,0,0]=3 258 B10R1.25 COc1ccc(cc1N)F AS04087 [1,1,0,0,0,0|1,0,0]=3 259 B10R1.25 COc1ccc(cc1N)I AS05428 [1,1,0,0,0,0|1,0,0]=3 260 B10R1.25 COc1ccc(cc1N)N AS04137 [1,1,0,0,0,0|1,0,0]=3 261 B10R1.25 COc1ccc(cc1N)N AS04209 [1,1,0,0,0,0|1,0,0]=3 262 B10R1.25 COc1ccc(cc1O)F AS00192 [1,1,0,0,0,0|1,0,0]=3 263 B10R1.25 CSc1ccc(cc1Br)Cl AS04512 [1,1,0,0,0,0|1,1,0]=4 264 B10R1.25 CSc1ccc(cc1F)F AS04305 [1,1,0,0,0,0|1,1,0]=4 265 B10R1.25 Cc1cc(ccc1C#N)O AS06275 [1,1,0,0,0,0|2,0,0]=4 266 B10R1.25 Cc1cc(ccc1C=O)O AS05602 [1,1,0,0,0,0|2,0,0]=4 267 B10R1.25 Cc1cc(ccc1CN)O AS06507 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.25 Cc1cc(ccc1OC)Br AS03407 [1,1,0,0,0,0|1,0,0]=3 269 B10R1.25 Cc1cc(ccc1OC)Cl AS02809 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.25 Cc1cc(ccc1OC)F AS04149 [1,1,0,0,0,0|1,0,0]=3 271 B10R1.25 Cc1cc(ccc1OC)I AS02251 [1,1,0,0,0,0|1,0,0]=3 272 B10R1.25 Cc1cc(ccc1OC)N AS00453 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.25 Cc1ccc(c(c1)Br)C=O AS06927 [1,1,0,0,0,0|2,0,0]=4 274 B10R1.25 Cc1ccc(c(c1)Br)OC AS03405 [1,1,0,0,0,0|0,0,0]=2 275 B10R1.25 Cc1ccc(c(c1)C)CCl AS00710 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.25 Cc1ccc(c(c1)C)NN AS03280 [1,1,0,0,0,0|2,0,0]=4 277 B10R1.25 Cc1ccc(c(c1)C)OC AS02541 [1,1,0,0,0,0|0,0,0]=2 278 B10R1.25 Cc1ccc(c(c1)Cl)C#N AS01650 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.25 Cc1ccc(c(c1)Cl)C=O AS06929 [1,1,0,0,0,0|2,0,0]=4 280 B10R1.25 Cc1ccc(c(c1)Cl)NN AS01996 [1,1,0,0,0,0|2,0,0]=4 281 B10R1.25 Cc1ccc(c(c1)Cl)OC AS02799 [1,1,0,0,0,0|0,0,0]=2 282 B10R1.25 Cc1ccc(c(c1)F)C#N AS01680 [1,1,0,0,0,0|2,0,0]=4 283 B10R1.25 Cc1ccc(c(c1)F)C=O AS01466 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.25 Cc1ccc(c(c1)I)OC AS02092 [1,1,0,0,0,0|0,0,0]=2 285 B10R1.25 Cc1ccc(c(c1)N)C#N AS01609 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.25 c1cc(c(cc1O)Br)C=O AS06475 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.25 c1cc(c(cc1O)Cl)C#N AS05814 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.25 c1cc(c(cc1O)Cl)C=O AS02997 [1,1,0,0,0,0|2,0,0]=4 289 B10R1.25 c1cc(c(cc1O)F)C#N AS03737 [1,1,0,0,0,0|2,0,0]=4 290 B10R1.25 c1cc(c(cc1O)F)C=O AS03069 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.25 c1cc(c(cc1O)I)C=O AS06474 [1,1,0,0,0,0|2,0,0]=4 292 B10R1.25 c1cc(c(cc1O)O)C#N AS07229 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.25 c1cc(c(cc1O)O)C=O AS02995 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.176 CCc1ccc(c(c1)Br)Br AS03544 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.176 CCc1ccc(c(c1)Br)Cl AS03141 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.176 CCc1ccc(c(c1)Br)I AS03255 [1,1,0,0,0,0|2,0,0]=4 297 B10R1.176 CCc1ccc(c(c1)Br)N AS03249 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.176 CCc1ccc(c(c1)Br)N AS03250 [1,1,0,0,0,0|2,0,0]=4 299 B10R1.176 CCc1ccc(c(c1)N)O AS06527 [1,1,0,0,0,0|1,0,0]=3 300 B10R1.176 CCc1ccc(c(c1)O)Cl AS02714 [1,1,0,0,0,0|2,0,0]=4 301 B10R1.176 CCc1ccc(c(c1)O)O AS06481 [1,1,0,0,0,0|1,0,0]=3 302 B10R1.176 CNc1ccc(c(c1)Cl)Cl AS05344 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.176 COc1cc(c(cn1)F)Br AS04799 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.176 COc1cc(c(cn1)F)I AS04873 [1,1,0,0,0,0|2,0,0]=4 305 B10R1.176 COc1ccc(c(c1)Br)Br AS03504 [1,1,0,0,0,0|1,0,0]=3 306 B10R1.176 COc1ccc(c(c1)Br)Cl AS01807 [1,1,0,0,0,0|1,0,0]=3 307 B10R1.176 COc1ccc(c(c1)Br)F AS05445 [1,1,0,0,0,0|1,0,0]=3 308 B10R1.176 COc1ccc(c(c1)Br)N AS04059 [1,1,0,0,0,0|1,0,0]=3 309 B10R1.176 COc1ccc(c(c1)Br)O AS03403 [1,1,0,0,0,0|0,0,0]=2 310 B10R1.176 COc1ccc(c(c1)Cl)Br AS02951 [1,1,0,0,0,0|1,0,0]=3 311 B10R1.176 COc1ccc(c(c1)Cl)Cl AS02857 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.176 COc1ccc(c(c1)Cl)F AS02724 [1,1,0,0,0,0|1,0,0]=3 313 B10R1.176 COc1ccc(c(c1)Cl)I AS06281 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.176 COc1ccc(c(c1)Cl)N AS05414 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.176 COc1ccc(c(c1)Cl)O AS00233 [1,1,0,0,0,0|0,0,0]=2 316 B10R1.176 COc1ccc(c(c1)F)Br AS01368 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.176 COc1ccc(c(c1)F)Br AS04321 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.176 COc1ccc(c(c1)F)Cl AS02727 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.176 COc1ccc(c(c1)F)F AS02508 [1,1,0,0,0,0|1,0,0]=3 320 B10R1.176 COc1ccc(c(c1)F)O AS02618 [1,1,0,0,0,0|0,0,0]=2 321 B10R1.176 COc1ccc(c(c1)I)Br AS03357 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.176 COc1ccc(c(c1)I)Cl AS03058 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.176 COc1ccc(c(c1)I)N AS05431 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.176 COc1ccc(c(c1)N)Br AS03386 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.176 COc1ccc(c(c1)N)Br AS03666 [1,1,0,0,0,0|1,0,0]=3 326 B10R1.176 COc1ccc(c(c1)N)Br AS04115 [1,1,0,0,0,0|1,0,0]=3 327 B10R1.176 COc1ccc(c(c1)N)Cl AS02788 [1,1,0,0,0,0|1,0,0]=3 328 B10R1.176 COc1ccc(c(c1)N)Cl AS04068 [1,1,0,0,0,0|1,0,0]=3 329 B10R1.176 COc1ccc(c(c1)N)F AS05424 [1,1,0,0,0,0|1,0,0]=3 330 B10R1.176 COc1ccc(c(c1)N)N AS05476 [1,1,0,0,0,0|1,0,0]=3 331 B10R1.176 COc1ccc(c(c1)N)N AS05477 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.176 Cc1c(ccc(n1)OC)Br AS04927 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.176 Cc1c(ccc(n1)OC)F AS04875 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.176 Cc1cc(ccc1Br)OC AS01021 [1,1,0,0,0,0|1,0,0]=3 335 B10R1.176 Cc1cc(ccc1Cl)OC AS02810 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.176 Cc1cc(ccc1F)OC AS02627 [1,1,0,0,0,0|1,0,0]=3 337 B10R1.176 Cc1cc(ccc1N)OC AS00349 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.176 Cc1cc(ccc1O)C=O AS05603 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.176 Cc1ccc(cc1Br)C#N AS02383 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.176 Cc1ccc(cc1Br)C#N AS04683 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.176 Cc1ccc(cc1Br)C=O AS02205 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.176 Cc1ccc(cc1Br)OC AS05453 [1,1,0,0,0,0|0,0,0]=2 343 B10R1.176 Cc1ccc(cc1C)C=O AS05590 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.176 Cc1ccc(cc1C)CCl AS00712 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.176 Cc1ccc(cc1C)CN AS06971 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.176 Cc1ccc(cc1C)CO AS00594 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.176 Cc1ccc(cc1C)NN AS07068 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.176 Cc1ccc(cc1C)OC AS02544 [1,1,0,0,0,0|0,0,0]=2 349 B10R1.176 Cc1ccc(cc1Cl)C=O AS02998 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.176 Cc1ccc(cc1Cl)CN AS00381 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.176 Cc1ccc(cc1Cl)OC AS02808 [1,1,0,0,0,0|0,0,0]=2 352 B10R1.176 Cc1ccc(cc1F)C#N AS01683 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.176 Cc1ccc(cc1F)C#N AS02711 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.176 Cc1ccc(cc1F)CN AS06972 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.176 Cc1ccc(cc1F)NN AS02007 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.176 Cc1ccc(cc1F)OC AS02625 [1,1,0,0,0,0|0,0,0]=2 357 B10R1.176 Cc1ccc(cc1I)C#N AS03757 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.176 Cc1ccc(cc1N)C#N AS01610 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.176 Cc1ccc(cc1N)OC AS05433 [1,1,0,0,0,0|0,0,0]=2 360 B10R1.176 c1cc(c(cc1C#N)Br)O AS03702 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.176 c1cc(c(cc1C#N)Cl)O AS03718 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.176 c1cc(c(cc1C#N)F)O AS02587 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.176 c1cc(c(cc1C=O)Br)O AS03815 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.176 c1cc(c(cc1C=O)Cl)O AS06839 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.176 c1cc(c(cc1C=O)F)O AS03052 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.176 c1cc(c(cc1C=O)I)O AS02778 [1,1,0,0,0,0|2,0,0]=4 367 B12R1.5 CCc1ccc(cc1)C(=O)CC AS05277 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.5 COC(=O)c1ccc(cc1)C=O AS06270 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.5 COC(=O)c1ccc(cc1)CBr AS02422 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.5 COc1ccc(cc1)C(=O)CBr AS04022 [0,2,0,0,0,0|1,0,0]=3 371 B12R1.5 COc1ccc(cc1)C(=O)CBr AS05122 [0,2,0,0,0,0|1,0,0]=3 372 B12R1.5 COc1ccc(cc1)C(=O)CCl AS01440 [0,2,0,0,0,0|1,0,0]=3 373 B12R1.5 COc1ccc(cc1)C(=O)NN AS01118 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.5 COc1ccc(cc1)C(=O)OC AS02499 [0,2,0,0,0,0|0,0,0]=2 375 B12R1.6 CC(C)(C)c1ccc(cc1)OC AS01006 [0,2,0,0,0,0|1,0,0]=3 376 B12R1.6 COc1ccc(cc1)C(F)(F)F AS01416 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.48 CC(=O)c1ccc(c(c1)F)OC AS01207 [0,2,0,0,0,0|1,0,0]=3 378 B12R1.48 CC(c1ccc(c(c1)F)OC)N AS02620 [0,2,0,0,0,0|1,0,0]=3 379 B12R1.48 COc1ccc(cc1Br)C(=O)O AS03392 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.48 COc1ccc(cc1Br)[N+](=O)[O-] AS01812 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.48 COc1ccc(cc1Cl)C(=O)O AS02793 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.48 COc1ccc(cc1Cl)[N+](=O)[O-] AS02407 [0,2,0,0,0,0|2,0,0]=4 383 B12R1.48 COc1ccc(cc1F)C(=O)Cl AS01128 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.48 COc1ccc(cc1F)C(=O)O AS02486 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.48 COc1ccc(cc1F)[N+](=O)[O-] AS02629 [0,2,0,0,0,0|2,0,0]=4 386 B12R1.48 COc1ccc(cc1I)C(=O)O AS02240 [0,2,0,0,0,0|2,0,0]=4 387 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] AS01810 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] AS02272 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] AS04248 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] AS05500 [0,2,0,0,0,0|2,0,0]=4 391 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] AS06844 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.48 COc1ccc(cc1N)[N+](=O)[O-] AS04309 [0,2,0,0,0,0|2,0,0]=4 393 B12R1.48 COc1ccc(cc1O)[N+](=O)[O-] AS00160 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.48 Cc1cc(ccc1OC)C(=O)O AS01296 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.48 Cc1cc(ccc1OC)[N+](=O)[O-] AS05503 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.113 CCOc1ccc(cc1)C(=O)C AS01130 [0,2,0,0,0,0|1,0,0]=3 397 B12R1.113 CCOc1ccc(cc1)C(=O)C AS01166 [0,2,0,0,0,0|1,0,0]=3 398 B12R1.113 CCOc1ccc(cc1)C(=O)O AS02555 [0,2,0,0,0,0|2,0,0]=4 399 B12R1.452 CC(=O)c1ccc(cc1F)OC AS01205 [0,2,0,0,0,0|1,0,0]=3 400 B12R1.452 CC(=O)c1ccc(cc1N)OC AS05088 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.452 CC(=O)c1ccc(cc1O)OC AS05193 [0,2,0,0,0,0|1,0,0]=3 402 B12R1.452 CC(C)c1ccc(cc1F)OC AS02621 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.452 CC(c1ccc(cc1F)OC)N AS02619 [0,2,0,0,0,0|1,0,0]=3 404 B12R1.452 COc1ccc(c(c1)Br)C(=O)O AS04623 [0,2,0,0,0,0|2,0,0]=4 405 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl AS00075 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.452 COc1ccc(c(c1)F)C(=O)O AS02487 [0,2,0,0,0,0|2,0,0]=4 407 B12R1.452 COc1ccc(c(c1)F)C(=O)O AS02597 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] AS01402 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] AS05501 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.452 COc1ccc(c(c1)N)C(=O)N AS04407 [0,2,0,0,0,0|2,0,0]=4 411 B12R1.452 COc1ccc(c(c1)N)C(=O)O AS04457 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] AS01000 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] AS05502 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.452 Cc1cc(ccc1C(=O)O)OC AS07027 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])OC AS01409 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.4 CC(=O)Nc1ccc(cc1)OC AS00987 [0,2,0,0,0,0|1,0,0]=3 417 B12R1.4 CC(=O)Oc1ccc(cc1)C=O AS03005 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.4 CC(C)Oc1ccc(cc1)C#N AS03769 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.4 CC(C)Oc1ccc(cc1)C=O AS03945 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.4 CC(C)Oc1ccc(cc1)CO AS04001 [0,2,0,0,0,0|2,0,0]=4 421 B12R1.4 CCc1ccc(cc1)CC(=O)C AS05185 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.4 c1cc(ccc1C#N)OC(F)F AS02735 [0,2,0,0,0,0|2,0,0]=4 423 B12R1.4 c1cc(ccc1C=O)OC(F)F AS03097 [0,2,0,0,0,0|2,0,0]=4 424 B12R1.4 c1cc(ccc1CBr)OC(F)F AS00698 [0,2,0,0,0,0|2,0,0]=4 425 B12R1.4 c1cc(ccc1CN)OC(F)F AS02244 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.71 CCCOc1ccc(cc1)C#C AS06594 [0,2,0,0,0,0|1,0,1]=4 427 B12R1.71 CCCOc1ccc(cc1)C#N AS03768 [0,2,0,0,0,0|2,0,0]=4 428 B12R1.71 CCCOc1ccc(cc1)C=O AS03944 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.71 CCCOc1ccc(cc1)CO AS04000 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.114 CCOc1ccc(cc1Br)C=O AS03793 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.114 COc1ccc(c(c1)Cl)CC#N AS06876 [0,2,0,0,0,0|1,0,1]=4 432 B12R1.114 COc1ccc(c(c1)F)CC#N AS02348 [0,2,0,0,0,0|1,0,1]=4 433 B12R1.116 CCOc1ccc(cc1)CC#N AS06104 [0,2,0,0,0,0|1,0,1]=4 434 B12R1.288 CCOc1ccc(c(c1)O)C=O AS06248 [0,2,0,0,0,0|2,0,0]=4 435 B12R1.288 COc1ccc(cc1F)CC#N AS01729 [0,2,0,0,0,0|1,0,1]=4 436 B12R1.78 CCc1cc(ccc1OC)OC AS02529 [0,2,0,0,0,0|0,0,0]=2 437 B12R1.78 CCc1ccc(c(c1)OC)OC AS02528 [0,2,0,0,0,0|1,0,0]=3 438 B12R1.78 COc1ccc(c(c1)C#N)C=O AS06463 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.78 COc1ccc(c(c1)C#N)OC AS02594 [0,2,0,0,0,0|0,0,0]=2 440 B12R1.78 COc1ccc(c(c1)C=O)OC AS02990 [0,2,0,0,0,0|0,0,0]=2 441 B12R1.78 COc1ccc(c(c1)C=O)OC AS04611 [0,2,0,0,0,0|0,0,0]=2 442 B12R1.78 COc1ccc(c(c1)OC)C=O AS02817 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.78 COc1ccc(c(c1)OC)CN AS02517 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.78 COc1ccc(c(c1)OC)CO AS00570 [0,2,0,0,0,0|2,0,0]=4 445 B12R1.78 COc1ccc(c(c1)OC)OC AS01075 [0,2,0,0,0,0|0,0,0]=2 446 B12R1.78 COc1ccc(cc1OC)C#C AS06822 [0,2,0,0,0,0|1,0,1]=4 447 B12R1.78 COc1ccc(cc1OC)C#N AS02546 [0,2,0,0,0,0|2,0,0]=4 448 B12R1.78 COc1ccc(cc1OC)C=O AS02987 [0,2,0,0,0,0|2,0,0]=4 449 B12R1.78 COc1ccc(cc1OC)CN AS02518 [0,2,0,0,0,0|2,0,0]=4 450 B12R1.78 COc1ccc(cc1OC)CO AS05969 [0,2,0,0,0,0|2,0,0]=4 451 B12R1.301 COc1c(cc(cc1F)C#N)F AS02372 [0,2,0,0,0,0|2,0,0]=4 452 B12R1.301 COc1cc(c(c(c1)Cl)C#N)Cl AS05831 [0,2,0,0,0,0|2,0,0]=4 453 B12R1.301 COc1cc(c(c(c1)Cl)C=O)Cl AS05582 [0,2,0,0,0,0|2,0,0]=4 454 B12R1.301 COc1cc(c(c(c1)F)C#N)F AS01663 [0,2,0,0,0,0|2,0,0]=4 455 B12R1.301 COc1cc(c(c(c1)F)C=O)F AS05588 [0,2,0,0,0,0|2,0,0]=4 456 B12R1.301 Cc1cc(cc(c1CBr)C)OC AS00635 [0,2,0,0,0,0|2,0,0]=4 457 B12R1.301 Cc1cc(cc(c1CCl)C)OC AS00634 [0,2,0,0,0,0|2,0,0]=4 458 B12R1.301 Cc1cc(cc(c1OC)C)C#N AS03731 [0,2,0,0,0,0|2,0,0]=4 459 B12R1.301 Cc1cc(cc(c1OC)C)C=O AS03874 [0,2,0,0,0,0|2,0,0]=4 460 B12R1.301 Cc1cc(cc(c1OC)C)OC AS02524 [0,2,0,0,0,0|0,0,0]=2 461 B12R1.450 COc1cc(c(cc1F)C#N)F AS02643 [0,2,0,0,0,0|2,0,0]=4 462 B12R1.450 COc1cc(c(cc1F)OC)F AS02510 [0,2,0,0,0,0|0,0,0]=2 463 B12R1.450 COc1cc(c(cc1F)OC)O AS00175 [0,2,0,0,0,0|0,0,0]=2 464 B12R1.653 COc1ccc(c(c1Br)Br)OC AS05694 [0,2,0,0,0,0|0,0,0]=2 465 B12R1.653 COc1ccc(c(c1O)Cl)C=O AS05555 [0,2,0,0,0,0|2,0,0]=4 466 B10R1.2 Cc1cccc(c1C)OC AS01272 [0,0,1,1,0,0|1,0,1]=4 467 B10R1.172 COc1cccc(c1)C=O AS02843 [0,0,0,0,1,1|2,0,0]=4 468 B10R1.172 COc1cccc(c1)CCl AS02050 [0,0,0,0,1,1|2,0,0]=4 469 B10R1.172 COc1cccc(c1)CN AS00384 [0,0,0,0,1,1|2,0,0]=4 470 B10R1.172 COc1cccc(c1)CO AS00566 [0,0,0,0,1,1|2,0,0]=4 471 B10R1.172 COc1cccc(c1)OC AS06961 [0,0,0,0,1,1|0,0,0]=2 472 B10R1.172 COc1cccc(c1)SC AS04295 [0,0,0,0,1,1|0,1,0]=3 473 B10R1.172 COc1cccc(n1)OC AS04949 [0,0,0,0,1,1|1,0,0]=3