0 B11R1.166 B(c1ccc(cc1C)C)(O)O AS04994 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.166 CC(=O)c1ccc(cc1Br)Br AS03852 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01149 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01174 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 CC(=O)c1ccc(cc1Br)N AS05248 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 CC(=O)c1ccc(cc1Br)O AS05117 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl AS03861 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.166 CC(=O)c1ccc(cc1Cl)F AS04025 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.166 CC(=O)c1ccc(cc1Cl)N AS05072 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05144 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05258 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.166 CC(=O)c1ccc(cc1F)Br AS01131 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.166 CC(=O)c1ccc(cc1F)Cl AS04005 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.166 CC(=O)c1ccc(cc1F)F AS01190 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.166 CC(=O)c1ccc(cc1F)O AS01200 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.166 CC(=O)c1ccc(cc1N)F AS06564 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.166 CC(=O)c1ccc(cc1O)Cl AS05146 [0,0,0,0,0,0|2,0,1]=3 17 B11R1.166 CC(=O)c1ccc(cc1O)F AS01201 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.166 CC(=O)c1ccc(cc1O)N AS05250 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.166 CC(=O)c1ccc(cc1O)O AS01140 [0,0,0,0,0,0|2,0,1]=3 20 B11R1.166 CC(C)c1ccc(cc1O)O AS07039 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.166 CC(c1ccc(cc1Cl)Cl)N AS02890 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.166 CC(c1ccc(cc1F)F)N AS00800 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.166 C[C@H](c1ccc(cc1F)Br)N AS06792 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.166 Cc1cc(ccc1C(=O)C)Cl AS05148 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.166 Cc1cc(ccc1C(=O)C)F AS01144 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.166 Cc1cc(ccc1C(=O)C)F AS03900 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.166 Cc1cc(ccc1C(=O)C)O AS04594 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O AS00875 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.166 Cc1ccc(c(c1)C)C(=O)Cl AS00021 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.166 Cc1ccc(c(c1)C)C(=O)O AS03894 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.166 Cc1ccc(c(c1)C)C(F)F AS05714 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O AS00152 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.166 Cc1ccc(c(c1)Cl)[N+](=O)[O-] AS02916 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.166 Cc1ccc(c(c1)F)C(=O)O AS00764 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] AS02078 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.166 Cc1ccc(c(c1)I)[N+](=O)[O-] AS02093 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.166 Cc1ccc(c(c1)N)C(=O)O AS00771 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.166 Cc1ccc(c(c1)N)[N+](=O)[O-] AS02089 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.166 Cc1ccc(c(c1)O)C(=O)C AS05195 [0,0,0,0,0,0|1,0,1]=2 40 B11R1.166 Cc1ccc(c(n1)O)[N+](=O)[O-] AS04943 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.166 c1cc(c(cc1Br)O)C(=O)N AS03343 [0,0,0,0,0,0|3,0,1]=4 42 B11R1.166 c1cc(c(cc1Br)O)C(=O)O AS00769 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] AS05458 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O AS02762 [0,0,0,0,0,0|3,0,1]=4 45 B11R1.166 c1cc(c(cc1F)O)C(=O)O AS01858 [0,0,0,0,0,0|3,0,1]=4 46 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] AS01405 [0,0,0,0,0,0|4,0,0]=4 47 B11R1.166 c1cc(c(cc1I)O)C(=O)O AS02196 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.166 c1cc(c(cc1O)O)C(=O)O AS00962 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.166 c1cc(c(cc1O)O)[N+](=O)[O-] AS06332 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.13 B(c1ccc(cc1)C)(O)O AS07183 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.13 CC(=C)c1ccc(cc1)O AS06541 [1,0,0,0,0,0|1,0,2]=4 52 B10R1.13 CC(=O)c1ccc(cc1)Br AS01178 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.13 CC(=O)c1ccc(cc1)Cl AS05257 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.13 CC(=O)c1ccc(cc1)F AS01160 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.13 CC(=O)c1ccc(cc1)I AS04012 [1,0,0,0,0,0|2,0,1]=4 56 B10R1.13 CC(=O)c1ccc(cc1)N AS01150 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.13 CC(=O)c1ccc(cc1)O AS01158 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.13 CC(C)c1ccc(cc1)I AS02289 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.13 CC(C)c1ccc(cc1)S AS00078 [1,0,0,0,0,0|1,0,0]=2 60 B10R1.13 CC(c1ccc(cc1)Br)N AS03462 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.13 CC(c1ccc(cc1)Br)O AS03465 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 CC(c1ccc(cc1)Cl)Br AS06898 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.13 CC(c1ccc(cc1)Cl)N AS02836 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.13 CC(c1ccc(cc1)Cl)O AS02839 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.13 CC(c1ccc(cc1)F)O AS00895 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.13 CN(C)c1ccc(cc1)Cl AS05322 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.13 CN(C)c1ccc(cc1)O AS06531 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.13 Cc1ccc(cc1)C(=O)C AS01165 [1,0,0,0,0,0|1,0,1]=3 69 B10R1.13 Cc1ccc(cc1)C(=O)Cl AS00020 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.13 Cc1ccc(cc1)C(=O)N AS05901 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.13 Cc1ccc(cc1)C(=O)O AS00864 [1,0,0,0,0,0|2,0,1]=4 72 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] AS01013 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.13 c1cc(ccc1C(F)F)Br AS05635 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.25 COc1c(cc(cn1)F)O AS04881 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.25 COc1ccc(cc1Br)Br AS03501 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.25 COc1ccc(cc1Br)Cl AS03118 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.25 COc1ccc(cc1Br)F AS01624 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.25 COc1ccc(cc1Br)I AS03354 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.25 COc1ccc(cc1Br)N AS03267 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.25 COc1ccc(cc1Br)N AS03385 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.25 COc1ccc(cc1Cl)Br AS03121 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.25 COc1ccc(cc1Cl)Cl AS02854 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.25 COc1ccc(cc1Cl)F AS02722 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.25 COc1ccc(cc1Cl)I AS03054 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.25 COc1ccc(cc1Cl)N AS02789 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.25 COc1ccc(cc1F)Br AS03274 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.25 COc1ccc(cc1F)Cl AS02726 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.25 COc1ccc(cc1F)F AS02507 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.25 COc1ccc(cc1F)N AS03264 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.25 COc1ccc(cc1F)N AS04085 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.25 COc1ccc(cc1F)O AS04432 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.25 COc1ccc(cc1I)Br AS03356 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.25 COc1ccc(cc1I)Cl AS03057 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.25 COc1ccc(cc1I)I AS02516 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.25 COc1ccc(cc1I)N AS02234 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.25 COc1ccc(cc1I)N AS02235 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.25 COc1ccc(cc1N)F AS04087 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.25 COc1ccc(cc1N)I AS05428 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.25 COc1ccc(cc1N)N AS04137 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.25 COc1ccc(cc1N)N AS04209 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.25 COc1ccc(cc1O)F AS00192 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.25 CSc1ccc(cc1Br)Cl AS04512 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.25 CSc1ccc(cc1F)F AS04305 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.25 Cc1cc(ccc1CN)Br AS06015 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.25 Cc1cc(ccc1CN)F AS00849 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.25 Cc1cc(ccc1CN)O AS06507 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.25 Cc1cc(ccc1CO)Br AS05952 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.25 Cc1cc(ccc1CO)F AS00602 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.25 Cc1cc(ccc1OC)Br AS03407 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.25 Cc1cc(ccc1OC)Cl AS02809 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.25 Cc1cc(ccc1OC)F AS04149 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.25 Cc1cc(ccc1OC)I AS02251 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.25 Cc1cc(ccc1OC)N AS00453 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.25 Cc1ccc(c(c1)Br)C=O AS06927 [1,0,0,0,0,0|2,0,1]=4 115 B10R1.25 Cc1ccc(c(c1)Br)OC AS03405 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.25 Cc1ccc(c(c1)C)CCl AS00710 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.25 Cc1ccc(c(c1)C)NN AS03280 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.25 Cc1ccc(c(c1)C)OC AS02541 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.25 Cc1ccc(c(c1)Cl)C#N AS01650 [1,0,0,0,0,0|2,0,1]=4 120 B10R1.25 Cc1ccc(c(c1)Cl)C=O AS06929 [1,0,0,0,0,0|2,0,1]=4 121 B10R1.25 Cc1ccc(c(c1)Cl)NN AS01996 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.25 Cc1ccc(c(c1)Cl)OC AS02799 [1,0,0,0,0,0|2,0,0]=3 123 B10R1.25 Cc1ccc(c(c1)F)C#N AS01680 [1,0,0,0,0,0|2,0,1]=4 124 B10R1.25 Cc1ccc(c(c1)F)C=O AS01466 [1,0,0,0,0,0|2,0,1]=4 125 B10R1.25 Cc1ccc(c(c1)I)OC AS02092 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.25 Cc1ccc(c(c1)N)C#N AS01609 [1,0,0,0,0,0|2,0,1]=4 127 B10R1.25 c1cc(c(cc1Br)Br)CO AS03971 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.25 c1cc(c(cc1Br)F)CBr AS00654 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.25 c1cc(c(cc1Br)F)CN AS01929 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.25 c1cc(c(cc1Br)F)CN AS03304 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.25 c1cc(c(cc1Br)F)CO AS03958 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.25 c1cc(c(cc1Br)N)CO AS01411 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.25 c1cc(c(cc1Br)O)C#N AS03703 [1,0,0,0,0,0|2,0,1]=4 134 B10R1.25 c1cc(c(cc1Br)O)C=O AS04630 [1,0,0,0,0,0|2,0,1]=4 135 B10R1.25 c1cc(c(cc1Br)O)CO AS05949 [1,0,0,0,0,0|2,0,0]=3 136 B10R1.25 c1cc(c(cc1Cl)Br)CBr AS06264 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.25 c1cc(c(cc1Cl)Cl)CBr AS00003 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.25 c1cc(c(cc1Cl)Cl)CCl AS02062 [1,0,0,0,0,0|3,0,0]=4 139 B10R1.25 c1cc(c(cc1Cl)Cl)CO AS00605 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.25 c1cc(c(cc1Cl)F)CCl AS00670 [1,0,0,0,0,0|3,0,0]=4 141 B10R1.25 c1cc(c(cc1Cl)F)CN AS02308 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.25 c1cc(c(cc1Cl)F)CN AS02739 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.25 c1cc(c(cc1Cl)F)CO AS00595 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.25 c1cc(c(cc1Cl)O)C#N AS05818 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.25 c1cc(c(cc1Cl)O)C=O AS05554 [1,0,0,0,0,0|2,0,1]=4 146 B10R1.25 c1cc(c(cc1F)Br)CBr AS00655 [1,0,0,0,0,0|3,0,0]=4 147 B10R1.25 c1cc(c(cc1F)Br)CN AS03302 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.25 c1cc(c(cc1F)Br)CO AS03955 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.25 c1cc(c(cc1F)Cl)CBr AS00679 [1,0,0,0,0,0|3,0,0]=4 150 B10R1.25 c1cc(c(cc1F)Cl)CCl AS00671 [1,0,0,0,0,0|3,0,0]=4 151 B10R1.25 c1cc(c(cc1F)Cl)CN AS02307 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.25 c1cc(c(cc1F)Cl)CN AS02737 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.25 c1cc(c(cc1F)Cl)CO AS03966 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.25 c1cc(c(cc1F)F)CBr AS00700 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.25 c1cc(c(cc1F)F)CCl AS00685 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.25 c1cc(c(cc1F)F)CN AS01933 [1,0,0,0,0,0|3,0,0]=4 157 B10R1.25 c1cc(c(cc1F)F)CO AS00610 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.25 c1cc(c(cc1F)O)C=O AS03068 [1,0,0,0,0,0|2,0,1]=4 159 B10R1.25 c1cc(c(cc1N)O)C#N AS06282 [1,0,0,0,0,0|2,0,1]=4 160 B10R1.25 c1cc(c(cc1O)O)C#N AS07229 [1,0,0,0,0,0|2,0,1]=4 161 B10R1.25 c1cc(c(cc1O)O)C=O AS02995 [1,0,0,0,0,0|2,0,1]=4 162 B10R1.61 CC(=O)c1ccccc1Br AS01164 [1,0,0,0,0,0|2,0,1]=4 163 B10R1.61 CC(=O)c1ccccc1Cl AS01142 [1,0,0,0,0,0|2,0,1]=4 164 B10R1.61 CC(=O)c1ccccc1F AS01129 [1,0,0,0,0,0|2,0,1]=4 165 B10R1.61 CC(=O)c1ccccc1I AS03911 [1,0,0,0,0,0|2,0,1]=4 166 B10R1.61 CC(=O)c1ccccc1O AS01159 [1,0,0,0,0,0|1,0,1]=3 167 B10R1.61 CC(C)c1ccccc1Br AS05661 [1,0,0,0,0,0|1,0,0]=2 168 B10R1.61 CC(c1ccccc1Br)N AS03460 [1,0,0,0,0,0|2,0,0]=3 169 B10R1.61 CC(c1ccccc1Br)O AS03463 [1,0,0,0,0,0|2,0,0]=3 170 B10R1.61 CC(c1ccccc1Cl)N AS02835 [1,0,0,0,0,0|2,0,0]=3 171 B10R1.61 CC(c1ccccc1Cl)O AS02837 [1,0,0,0,0,0|2,0,0]=3 172 B10R1.61 CC(c1ccccc1F)N AS00852 [1,0,0,0,0,0|2,0,0]=3 173 B10R1.61 CC(c1ccccc1F)O AS00893 [1,0,0,0,0,0|2,0,0]=3 174 B10R1.61 CN(C)c1ccccc1F AS05364 [1,0,0,0,0,0|2,0,0]=3 175 B10R1.61 C[C@H](c1ccccc1O)N AS06796 [1,0,0,0,0,0|1,0,0]=2 176 B12R1.57 CC(=O)c1ccc(cc1OC)F AS01206 [0,1,0,0,0,0|2,0,1]=4 177 B12R1.57 CC(C)c1ccc(cc1OC)F AS02622 [0,1,0,0,0,0|1,0,0]=2 178 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] AS05504 [0,1,0,0,0,0|3,0,0]=4 179 B12R1.126 Cc1ccc(c(c1)Cl)C(F)(F)F AS01746 [0,1,0,0,0,0|3,0,0]=4 180 B12R1.126 c1cc(c(cc1F)O)C(F)(F)F AS01407 [0,1,0,0,0,0|3,0,0]=4 181 B12R1.232 CC(=O)c1cc(c(cc1O)F)F AS05169 [0,1,0,0,0,0|2,0,1]=4 182 B12R1.232 Cc1cc(c(cc1C)O)C(=O)C AS05182 [0,1,0,0,0,0|1,0,1]=3 183 B12R1.232 Cc1cc(c(cc1Cl)[N+](=O)[O-])O AS06982 [0,1,0,0,0,0|3,0,0]=4 184 B12R1.232 Cc1cc(c(cc1F)[N+](=O)[O-])O AS07238 [0,1,0,0,0,0|3,0,0]=4 185 B12R1.452 CC(=O)c1ccc(cc1F)OC AS01205 [0,1,0,0,0,0|2,0,1]=4 186 B12R1.452 CC(=O)c1ccc(cc1N)OC AS05088 [0,1,0,0,0,0|2,0,1]=4 187 B12R1.452 CC(=O)c1ccc(cc1O)OC AS05193 [0,1,0,0,0,0|1,0,1]=3 188 B12R1.452 CC(C)c1ccc(cc1F)OC AS02621 [0,1,0,0,0,0|1,0,0]=2 189 B12R1.452 CC(c1ccc(cc1F)OC)N AS02619 [0,1,0,0,0,0|2,0,0]=3 190 B12R1.452 CN(C)c1ccc(cc1F)C#N AS06487 [0,1,0,0,0,0|2,0,1]=4 191 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] AS05502 [0,1,0,0,0,0|3,0,0]=4 192 B12R1.893 Cc1ccc(c(c1F)F)C(=O)C AS05174 [0,1,0,0,0,0|2,0,1]=4 193 B12R1.1000 CC(=O)c1c(cc(cc1O)O)O AS01157 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C AS00884 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C AS06278 [0,1,0,0,0,0|2,0,1]=4 196 B12R1.1703 CCC(=O)c1ccc(cc1O)O AS07000 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.1703 COC(=O)c1ccc(cc1O)Br AS03632 [0,1,0,0,0,0|2,0,1]=4 198 B12R1.1703 COC(=O)c1ccc(cc1O)F AS01320 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.1703 COC(=O)c1ccc(cc1O)I AS02314 [0,1,0,0,0,0|2,0,1]=4 200 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CBr AS05109 [0,1,0,0,0,0|2,0,1]=4 201 B12R2.612 c1cc2c(cc1Br)OCC2=O AS06368 [0,0,0,1,0,0|2,0,1]=4 202 B12R2.612 c1cc2c(cc1Cl)OCC2=O AS06461 [0,0,0,1,0,0|2,0,1]=4 203 B12R2.612 c1cc2c(cc1F)OCC2=O AS06460 [0,0,0,1,0,0|2,0,1]=4 204 B12R2.612 c1cc2c(cc1O)OCC2=O AS06432 [0,0,0,1,0,0|2,0,1]=4 205 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl AS03170 [0,0,0,0,0,1|2,0,0]=3 206 B12R1.233 CC(C)Oc1ccc(cc1Br)F AS03332 [0,0,0,0,0,1|2,0,0]=3 207 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br AS03172 [0,0,0,0,0,1|2,0,0]=3 208 B12R1.233 CC(C)Oc1ccc(cc1Cl)F AS02756 [0,0,0,0,0,1|2,0,0]=3 209 B12R1.233 CC(C)Oc1ccc(cc1F)Br AS03333 [0,0,0,0,0,1|2,0,0]=3 210 B12R1.233 CC(C)Oc1ccc(cc1F)F AS02513 [0,0,0,0,0,1|2,0,0]=3 211 B12R1.233 Cc1ccc(c(c1)Br)NC(=O)C AS03408 [0,0,0,0,0,1|2,0,1]=4 212 B12R1.233 Cc1ccc(c(c1)Cl)NC(=O)C AS02800 [0,0,0,0,0,1|2,0,1]=4 213 B9R1.1 CCc1ccc(cc1)Br AS03254 [2,0,0,0,0,0|1,0,0]=3 214 B9R1.1 CCc1ccc(cc1)F AS04424 [2,0,0,0,0,0|1,0,0]=3 215 B9R1.1 CCc1ccc(cc1)I AS02159 [2,0,0,0,0,0|1,0,0]=3 216 B9R1.1 CNc1ccc(cc1)I AS05390 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.1 COc1ccc(cc1)Br AS02358 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.1 COc1ccc(cc1)Cl AS01802 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.1 COc1ccc(cc1)F AS02586 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.1 COc1ccc(cc1)I AS02208 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.1 COc1ccc(cc1)O AS04576 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.1 CSc1ccc(cc1)Br AS04293 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.1 CSc1ccc(cc1)Cl AS04289 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.1 CSc1ccc(cc1)F AS04286 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.1 CSc1ccc(cc1)N AS04283 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.1 Cc1ccc(cc1)C#N AS03761 [2,0,0,0,0,0|1,0,1]=4 227 B9R1.1 Cc1ccc(cc1)C=O AS02824 [2,0,0,0,0,0|1,0,1]=4 228 B9R1.1 Cc1ccc(cc1)CCl AS00637 [2,0,0,0,0,0|1,0,0]=3 229 B9R1.1 Cc1ccc(cc1)SC AS04302 [2,0,0,0,0,0|1,0,0]=3 230 B9R1.1 c1cc(ccc1CBr)Br AS02044 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.1 c1cc(ccc1CBr)Cl AS02046 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.1 c1cc(ccc1CBr)F AS00664 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.1 c1cc(ccc1CBr)I AS00645 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.1 c1cc(ccc1CCl)Br AS00646 [2,0,0,0,0,0|2,0,0]=4 235 B9R1.1 c1cc(ccc1CCl)F AS00660 [2,0,0,0,0,0|2,0,0]=4 236 B9R1.1 c1cc(ccc1CCl)F AS02054 [2,0,0,0,0,0|2,0,0]=4 237 B9R1.1 c1cc(ccc1CN)Br AS02268 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.1 c1cc(ccc1CN)Br AS03103 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.1 c1cc(ccc1CN)Br AS06970 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.1 c1cc(ccc1CN)Cl AS00379 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.1 c1cc(ccc1CN)Cl AS02689 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.1 c1cc(ccc1CN)F AS00834 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.1 c1cc(ccc1CN)F AS01938 [2,0,0,0,0,0|2,0,0]=4 244 B9R1.1 c1cc(ccc1CN)I AS02223 [2,0,0,0,0,0|2,0,0]=4 245 B9R1.1 c1cc(ccc1CN)I AS02301 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.1 c1cc(ccc1CO)Br AS03954 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.1 c1cc(ccc1CO)Cl AS03965 [2,0,0,0,0,0|2,0,0]=4 248 B9R1.1 c1cc(ccc1CO)F AS03978 [2,0,0,0,0,0|2,0,0]=4 249 B9R1.1 c1cc(ccc1CO)I AS00604 [2,0,0,0,0,0|2,0,0]=4 250 B9R1.1 c1cc(ccc1CO)I AS03987 [2,0,0,0,0,0|2,0,0]=4 251 B9R1.1 c1cc(ccc1CO)N AS00548 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.1 c1cc(ccc1CO)O AS00576 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.15 CCc1ccccc1Br AS03252 [2,0,0,0,0,0|1,0,0]=3 254 B9R1.15 CCc1ccccc1I AS02158 [2,0,0,0,0,0|1,0,0]=3 255 B9R1.15 CNc1ccccc1N AS04592 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.15 COc1ccccc1Br AS02357 [2,0,0,0,0,0|2,0,0]=4 257 B9R1.15 COc1ccccc1Cl AS02676 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.15 COc1ccccc1F AS01803 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.15 COc1ccccc1I AS02206 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.15 COc1ccccc1N AS01503 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.15 CSc1ccccc1Br AS04291 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.15 CSc1ccccc1Cl AS04287 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.15 CSc1ccccc1F AS04284 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.15 CSc1ccccc1I AS04299 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.15 CSc1ccccc1N AS04281 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.15 CSc1ccccc1O AS04298 [2,0,0,0,0,0|1,0,0]=3 267 B9R1.15 Cc1ccccc1CBr AS02052 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.15 Cc1ccccc1CCl AS03843 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.15 Cc1ccccc1CN AS00380 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.15 Cc1ccccc1OC AS01015 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.15 Cc1ccccc1SC AS04306 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.15 c1ccc(c(c1)C#N)O AS02648 [2,0,0,0,0,0|1,0,1]=4 273 B9R1.15 c1ccc(c(c1)C=O)O AS03003 [2,0,0,0,0,0|1,0,1]=4 274 B9R1.15 c1ccc(c(c1)C=O)O AS07244 [2,0,0,0,0,0|1,0,1]=4 275 B9R1.15 c1ccc(c(c1)CBr)Br AS02057 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.15 c1ccc(c(c1)CBr)Cl AS02065 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.15 c1ccc(c(c1)CBr)F AS00662 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.15 c1ccc(c(c1)CBr)I AS00633 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.15 c1ccc(c(c1)CCl)F AS00659 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.15 c1ccc(c(c1)CN)Br AS02252 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.15 c1ccc(c(c1)CN)Br AS03101 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.15 c1ccc(c(c1)CN)Cl AS00369 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.15 c1ccc(c(c1)CN)Cl AS02687 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.15 c1ccc(c(c1)CN)F AS00832 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.15 c1ccc(c(c1)CN)F AS01936 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.15 c1ccc(c(c1)CN)I AS02221 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.15 c1ccc(c(c1)CN)I AS02299 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.15 c1ccc(c(c1)CN)N AS06598 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.15 c1ccc(c(c1)CO)Br AS03952 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.15 c1ccc(c(c1)CO)Cl AS03963 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.15 c1ccc(c(c1)CO)F AS03976 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.15 c1ccc(c(c1)CO)I AS03985 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.15 c1ccc(c(c1)CO)N AS00575 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.15 c1ccc(c(c1)CO)O AS00547 [2,0,0,0,0,0|1,0,0]=3 295 B9R1.69 Cc1ccc(c(c1)Br)Br AS00240 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.69 Cc1ccc(c(c1)Br)Br AS02027 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.69 Cc1ccc(c(c1)Br)C AS00264 [2,0,0,0,0,0|1,0,0]=3 298 B9R1.69 Cc1ccc(c(c1)Br)Cl AS00084 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.69 Cc1ccc(c(c1)Br)F AS03335 [2,0,0,0,0,0|2,0,0]=4 300 B9R1.69 Cc1ccc(c(c1)Br)I AS03375 [2,0,0,0,0,0|2,0,0]=4 301 B9R1.69 Cc1ccc(c(c1)Br)N AS03412 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.69 Cc1ccc(c(c1)Br)N AS03417 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.69 Cc1ccc(c(c1)C)Br AS03232 [2,0,0,0,0,0|2,0,0]=4 304 B9R1.69 Cc1ccc(c(c1)C)C AS00262 [2,0,0,0,0,0|1,0,0]=3 305 B9R1.69 Cc1ccc(c(c1)C)Cl AS02702 [2,0,0,0,0,0|2,0,0]=4 306 B9R1.69 Cc1ccc(c(c1)C)F AS00279 [2,0,0,0,0,0|2,0,0]=4 307 B9R1.69 Cc1ccc(c(c1)C)I AS02153 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.69 Cc1ccc(c(c1)C)N AS01548 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.69 Cc1ccc(c(c1)Cl)Br AS03175 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.69 Cc1ccc(c(c1)Cl)C AS02703 [2,0,0,0,0,0|1,0,0]=3 311 B9R1.69 Cc1ccc(c(c1)Cl)F AS02758 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.69 Cc1ccc(c(c1)Cl)I AS00145 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.69 Cc1ccc(c(c1)Cl)N AS05330 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.69 Cc1ccc(c(c1)Cl)O AS02819 [2,0,0,0,0,0|2,0,0]=4 315 B9R1.69 Cc1ccc(c(c1)F)Br AS00304 [2,0,0,0,0,0|2,0,0]=4 316 B9R1.69 Cc1ccc(c(c1)F)Cl AS02760 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.69 Cc1ccc(c(c1)F)F AS02071 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.69 Cc1ccc(c(c1)F)I AS02191 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.69 Cc1ccc(c(c1)F)N AS00425 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.69 Cc1ccc(c(c1)I)Br AS03378 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.69 Cc1ccc(c(c1)I)C AS02155 [2,0,0,0,0,0|1,0,0]=3 322 B9R1.69 Cc1ccc(c(c1)I)F AS02193 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.69 Cc1ccc(c(c1)I)I AS02149 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.69 Cc1ccc(c(c1)I)N AS02255 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.69 Cc1ccc(c(c1)N)Br AS06846 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.69 Cc1ccc(c(c1)N)Br AS06967 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.69 Cc1ccc(c(c1)N)Cl AS04682 [2,0,0,0,0,0|2,0,0]=4 328 B9R1.69 Cc1ccc(c(c1)N)Cl AS06932 [2,0,0,0,0,0|2,0,0]=4 329 B9R1.69 Cc1ccc(c(c1)N)F AS03240 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.69 Cc1ccc(c(c1)N)I AS04099 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.69 Cc1ccc(c(c1)O)Br AS00227 [2,0,0,0,0,0|1,0,0]=3 332 B9R1.69 Cc1ccc(c(c1)O)C AS00223 [2,0,0,0,0,0|0,0,0]=2 333 B9R1.69 Cc1ccc(c(c1)O)Cl AS02820 [2,0,0,0,0,0|1,0,0]=3 334 B9R1.69 Cc1ccc(c(c1)O)F AS00182 [2,0,0,0,0,0|1,0,0]=3 335 B9R1.69 Cc1ccc(c(c1)O)O AS07054 [2,0,0,0,0,0|1,0,0]=3 336 B9R1.69 Cc1ccc(c(c1)S)C AS00079 [2,0,0,0,0,0|0,1,0]=3 337 B9R1.69 Cc1ccc(cc1Br)Br AS00135 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.69 Cc1ccc(cc1Br)Cl AS00104 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.69 Cc1ccc(cc1Br)F AS01018 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.69 Cc1ccc(cc1Br)I AS03371 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.69 Cc1ccc(cc1Br)N AS04061 [2,0,0,0,0,0|2,0,0]=4 342 B9R1.69 Cc1ccc(cc1Br)O AS06517 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.69 Cc1ccc(cc1C)Br AS03659 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.69 Cc1ccc(cc1C)Cl AS02704 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.69 Cc1ccc(cc1C)F AS00280 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.69 Cc1ccc(cc1C)I AS02151 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.69 Cc1ccc(cc1C)N AS07069 [2,0,0,0,0,0|2,0,0]=4 348 B9R1.69 Cc1ccc(cc1Cl)Br AS00171 [2,0,0,0,0,0|2,0,0]=4 349 B9R1.69 Cc1ccc(cc1Cl)F AS01022 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.69 Cc1ccc(cc1Cl)I AS03076 [2,0,0,0,0,0|2,0,0]=4 351 B9R1.69 Cc1ccc(cc1Cl)N AS03227 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.69 Cc1ccc(cc1Cl)O AS00234 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.69 Cc1ccc(cc1F)Br AS00241 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.69 Cc1ccc(cc1F)Cl AS02759 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.69 Cc1ccc(cc1F)F AS02069 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.69 Cc1ccc(cc1F)I AS02189 [2,0,0,0,0,0|2,0,0]=4 357 B9R1.69 Cc1ccc(cc1F)N AS00436 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.69 Cc1ccc(cc1F)O AS01398 [2,0,0,0,0,0|2,0,0]=4 359 B9R1.69 Cc1ccc(cc1I)Br AS03377 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.69 Cc1ccc(cc1I)Cl AS03079 [2,0,0,0,0,0|2,0,0]=4 361 B9R1.69 Cc1ccc(cc1I)F AS02192 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.69 Cc1ccc(cc1I)I AS02147 [2,0,0,0,0,0|2,0,0]=4 363 B9R1.69 Cc1ccc(cc1I)N AS02256 [2,0,0,0,0,0|2,0,0]=4 364 B9R1.69 Cc1ccc(cc1N)Br AS00457 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.69 Cc1ccc(cc1N)Cl AS04751 [2,0,0,0,0,0|2,0,0]=4 366 B9R1.69 Cc1ccc(cc1N)F AS00350 [2,0,0,0,0,0|2,0,0]=4 367 B9R1.69 Cc1ccc(cc1N)I AS02328 [2,0,0,0,0,0|2,0,0]=4 368 B9R1.69 Cc1ccc(cc1N)O AS01352 [2,0,0,0,0,0|2,0,0]=4 369 B9R1.69 Cc1ccc(cc1N)O AS02087 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.69 Cc1ccc(cc1O)Br AS04653 [2,0,0,0,0,0|1,0,0]=3 371 B9R1.69 Cc1ccc(cc1O)Cl AS02823 [2,0,0,0,0,0|1,0,0]=3 372 B9R1.69 Cc1ccc(cc1O)F AS00890 [2,0,0,0,0,0|1,0,0]=3 373 B9R1.69 Cc1ccc(cc1O)N AS05434 [2,0,0,0,0,0|1,0,0]=3 374 B9R1.69 Cc1ccc(cc1O)O AS06296 [2,0,0,0,0,0|1,0,0]=3 375 B9R1.69 c1cc(c(cc1Br)O)Br AS04420 [2,0,0,0,0,0|2,0,0]=4 376 B9R1.69 c1cc(c(cc1Br)O)Cl AS00161 [2,0,0,0,0,0|2,0,0]=4 377 B9R1.69 c1cc(c(cc1Br)O)F AS00226 [2,0,0,0,0,0|2,0,0]=4 378 B9R1.69 c1cc(c(cc1Br)O)N AS05408 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.69 c1cc(c(cc1Cl)O)Cl AS02889 [2,0,0,0,0,0|2,0,0]=4 380 B9R1.69 c1cc(c(cc1Cl)O)F AS01380 [2,0,0,0,0,0|2,0,0]=4 381 B9R1.69 c1cc(c(cc1Cl)O)I AS03074 [2,0,0,0,0,0|2,0,0]=4 382 B9R1.69 c1cc(c(cc1F)O)Br AS00222 [2,0,0,0,0,0|2,0,0]=4 383 B9R1.69 c1cc(c(cc1F)O)Cl AS00194 [2,0,0,0,0,0|2,0,0]=4 384 B9R1.69 c1cc(c(cc1F)O)F AS00183 [2,0,0,0,0,0|2,0,0]=4 385 B9R1.69 c1cc(c(cc1F)O)I AS06580 [2,0,0,0,0,0|2,0,0]=4 386 B9R1.69 c1cc(c(cc1F)O)N AS01348 [2,0,0,0,0,0|2,0,0]=4 387 B9R1.69 c1cc(c(cc1F)O)O AS01420 [2,0,0,0,0,0|2,0,0]=4 388 B9R1.69 c1cc(c(cc1I)O)Cl AS03072 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.69 c1cc(c(cc1I)O)I AS06590 [2,0,0,0,0,0|2,0,0]=4 390 B9R1.69 c1cc(c(cc1N)O)Cl AS05416 [2,0,0,0,0,0|2,0,0]=4 391 B9R1.69 c1cc(c(cc1O)O)F AS05497 [2,0,0,0,0,0|2,0,0]=4 392 B9R1.69 c1cc(c(cc1O)O)N AS05427 [2,0,0,0,0,0|2,0,0]=4 393 B9R1.69 c1cc(c(cc1O)O)O AS00200 [2,0,0,0,0,0|2,0,0]=4 394 B11R1.3 CC(C)c1ccc(cc1)C#C AS06788 [1,1,0,0,0,0|0,0,1]=3 395 B11R1.3 CC(C)c1ccc(cc1)NN AS02450 [1,1,0,0,0,0|1,0,0]=3 396 B11R1.3 CC(C)c1ccc(cc1)OC AS01008 [1,1,0,0,0,0|0,0,0]=2 397 B11R1.3 CC(c1ccc(cc1)OC)N AS04622 [1,1,0,0,0,0|1,0,0]=3 398 B11R1.3 CCc1ccc(cc1)C(=O)C AS03877 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.3 CCc1ccc(cc1)C(C)N AS00822 [1,1,0,0,0,0|1,0,0]=3 400 B11R1.3 CN(C)c1ccc(cc1)C#N AS02379 [1,1,0,0,0,0|1,0,1]=4 401 B11R1.3 CN(C)c1ccc(cc1)C=O AS02845 [1,1,0,0,0,0|1,0,1]=4 402 B11R1.3 CN(C)c1ccc(cc1)OC AS04610 [1,1,0,0,0,0|1,0,0]=3 403 B11R1.3 C[C@H](c1ccc(cc1)OC)N AS04502 [1,1,0,0,0,0|1,0,0]=3 404 B11R1.19 CC(C)(C)c1ccc(cc1)Br AS03466 [1,1,0,0,0,0|1,0,0]=3 405 B11R1.19 CC(C)(C)c1ccc(cc1)I AS05654 [1,1,0,0,0,0|1,0,0]=3 406 B11R1.19 CC(C)(C)c1ccc(cc1)O AS00221 [1,1,0,0,0,0|1,0,0]=3 407 B11R1.19 C[Si](C)(C)c1ccc(cc1)F AS05757 [1,1,0,0,0,0|1,1,0]=4 408 B11R1.19 Cc1ccc(cc1)C(F)(F)F AS01764 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.21 CC(C)c1ccc(c(c1)Br)N AS00906 [1,1,0,0,0,0|1,0,0]=3 410 B11R1.21 CC(c1ccc(c(c1)Cl)Cl)N AS02891 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.21 CC(c1ccc(c(c1)F)F)N AS00801 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.21 Cc1ccc(cc1Br)C(=O)C AS03823 [1,1,0,0,0,0|1,0,1]=4 413 B11R1.21 Cc1ccc(cc1C)C(=O)C AS03873 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.21 Cc1ccc(cc1C)C(C)N AS00809 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.21 Cc1ccc(cc1F)C(=O)C AS05187 [1,1,0,0,0,0|1,0,1]=4 416 B11R1.21 Cc1ccc(cc1I)C(=O)C AS03923 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.21 Cc1ccc(cc1N)C(C)C AS05395 [1,1,0,0,0,0|0,0,0]=2 418 B11R1.21 Cc1ccc(cc1O)C(=O)C AS05196 [1,1,0,0,0,0|1,0,1]=4 419 B11R1.21 Cc1ccc(cc1O)C(C)C AS07190 [1,1,0,0,0,0|0,0,0]=2 420 B11R1.22 Cc1ccc(cc1)C(=O)CN AS05091 [1,1,0,0,0,0|1,0,1]=4 421 B11R1.22 Cc1ccc(cc1)C(=O)OC AS01339 [1,1,0,0,0,0|1,0,1]=4 422 B11R1.22 c1cc(ccc1C(CO)O)Br AS06515 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.37 CCc1ccc(cc1CC)O AS07216 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.37 COc1cc(ccc1CCl)F AS00666 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.37 COc1cc(ccc1CN)F AS02609 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.37 COc1cc(ccc1CO)Br AS00555 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.37 COc1cc(ccc1CO)Cl AS04003 [1,1,0,0,0,0|2,0,0]=4 428 B11R1.37 COc1cc(ccc1CO)F AS03982 [1,1,0,0,0,0|2,0,0]=4 429 B11R1.37 COc1ccc(cc1CO)Br AS00560 [1,1,0,0,0,0|2,0,0]=4 430 B11R1.37 COc1ccc(cc1CO)F AS00599 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.37 COc1ccc(cc1OC)Br AS03218 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.37 COc1ccc(cc1OC)F AS02401 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.37 COc1ccc(cc1OC)I AS02534 [1,1,0,0,0,0|2,0,0]=4 434 B11R1.37 COc1ccc(cc1OC)O AS01392 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.37 Cc1ccc(c(c1)OC)C#N AS05867 [1,1,0,0,0,0|1,0,1]=4 436 B11R1.37 Cc1ccc(c(c1)OC)OC AS02540 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.81 CCCc1ccc(cc1O)O AS06999 [1,1,0,0,0,0|1,0,0]=3 438 B11R1.81 CCOc1ccc(cc1Cl)F AS02749 [1,1,0,0,0,0|2,0,0]=4 439 B11R1.81 CCOc1ccc(cc1F)Cl AS02753 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.81 c1cc(c(cc1Cl)Cl)CCO AS00584 [1,1,0,0,0,0|2,0,0]=4 441 B11R1.277 COc1cc(c(cc1O)F)Br AS05446 [1,1,0,0,0,0|2,0,0]=4 442 B11R1.277 Cc1cc(c(cc1Cl)C=O)O AS06664 [1,1,0,0,0,0|1,0,1]=4 443 B11R1.277 Cc1cc(c(cc1F)C=O)O AS07166 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.278 Cc1ccc(c(c1F)F)OC AS04252 [1,1,0,0,0,0|2,0,0]=4 445 B11R1.279 COc1ccc(c(c1)Br)OC AS06963 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.279 COc1ccc(c(c1)F)CBr AS07192 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.279 COc1ccc(c(c1)F)CCl AS00667 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.279 COc1ccc(c(c1)F)CN AS02606 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.279 COc1ccc(c(c1)F)CO AS03980 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.279 COc1ccc(c(c1)F)OC AS02400 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.279 COc1ccc(c(c1)O)C#N AS06261 [1,1,0,0,0,0|1,0,1]=4 452 B11R1.279 COc1ccc(c(c1)O)OC AS06540 [1,1,0,0,0,0|1,0,0]=3 453 B11R1.279 COc1ccc(cc1Br)CN AS03398 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.279 COc1ccc(cc1Br)CO AS03961 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.279 COc1ccc(cc1Cl)CN AS02796 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.279 COc1ccc(cc1Cl)CO AS03969 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.279 COc1ccc(cc1F)CBr AS00641 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.279 COc1ccc(cc1F)CCl AS00669 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.279 COc1ccc(cc1F)CN AS02608 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.279 COc1ccc(cc1I)CN AS02248 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.279 COc1ccc(cc1I)CO AS03988 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.279 COc1ccc(cc1O)C#N AS02385 [1,1,0,0,0,0|1,0,1]=4 463 B11R1.279 Cc1cc(ccc1OC)OC AS02031 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.279 c1cc(c(cc1CBr)Br)CBr AS03658 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.464 Cc1cc(c(c(c1)Br)OC)Br AS03569 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.464 Cc1cc(c(c(c1)C)CBr)C AS04444 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.464 Cc1cc(c(c(c1)C)OC)C AS05514 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.464 Cc1cc(c(c(c1)O)C=O)C AS05593 [1,1,0,0,0,0|1,0,1]=4 469 B11R1.53 CC(=O)c1ccccc1OC AS05203 [1,1,0,0,0,0|1,0,1]=4 470 B11R1.53 CC(C)c1ccccc1C=O AS06366 [1,1,0,0,0,0|0,0,1]=3 471 B11R1.53 CC(C)c1ccccc1OC AS01007 [1,1,0,0,0,0|0,0,0]=2 472 B11R1.53 CC(c1ccccc1OC)O AS04413 [1,1,0,0,0,0|1,0,0]=3 473 B11R1.87 CC(C)(C)c1ccccc1N AS05312 [1,1,0,0,0,0|1,0,0]=3 474 B11R1.87 Cc1ccccc1C(C)(C)C AS05627 [1,1,0,0,0,0|1,0,0]=3 475 B11R1.87 c1ccc(c(c1)C(F)(F)F)O AS04749 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.156 CC(=O)c1c(cccc1F)O AS01204 [1,1,0,0,0,0|1,0,1]=4 477 B11R1.156 CC(C)c1c(cccc1O)N AS06513 [1,1,0,0,0,0|0,0,0]=2 478 B11R1.156 CC(c1c(cccc1Cl)Cl)Cl AS07051 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.156 CC(c1c(cccc1Cl)Cl)O AS07052 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.159 CC(=O)c1cccc(c1O)Br AS05118 [1,1,0,0,0,0|1,0,1]=4 481 B11R1.159 CC(=O)c1cccc(c1O)N AS05085 [1,1,0,0,0,0|1,0,1]=4 482 B11R1.159 CC(C)c1cccc(c1F)O AS06530 [1,1,0,0,0,0|1,0,0]=3 483 B11R1.159 CC(C)c1cccc(c1O)Cl AS06587 [1,1,0,0,0,0|0,0,0]=2 484 B11R1.167 CC(=O)c1cc(ccc1O)Br AS01134 [1,1,0,0,0,0|1,0,1]=4 485 B11R1.167 CC(=O)c1cc(ccc1O)Cl AS03839 [1,1,0,0,0,0|1,0,1]=4 486 B11R1.167 CC(=O)c1cc(ccc1O)F AS01202 [1,1,0,0,0,0|1,0,1]=4 487 B11R1.167 CC(=O)c1cc(ccc1O)N AS05086 [1,1,0,0,0,0|1,0,1]=4 488 B11R1.167 CC(=O)c1cc(ccc1O)O AS05179 [1,1,0,0,0,0|1,0,1]=4 489 B11R1.167 CC(C)c1cc(ccc1O)Cl AS06506 [1,1,0,0,0,0|0,0,0]=2 490 B11R1.167 CC(c1cc(ccc1O)Br)N AS04674 [1,1,0,0,0,0|1,0,0]=3 491 B11R1.222 CCC(C)c1ccccc1N AS05311 [1,1,0,0,0,0|1,0,0]=3 492 B13R1.2065 Cc1ccc(c(c1)OC)C(=O)OC AS04422 [0,2,0,0,0,0|1,0,1]=4 493 B13R1.120 CC(C)c1ccc(cc1Br)[N+](=O)[O-] AS05666 [0,2,0,0,0,0|2,0,0]=4 494 B13R1.961 COC(c1ccc(cc1Br)Br)OC AS03857 [0,2,0,0,0,0|2,0,0]=4 495 B13R1.961 COC(c1ccc(cc1Br)Cl)OC AS03933 [0,2,0,0,0,0|2,0,0]=4 496 B13R1.961 COC(c1ccc(cc1Cl)Br)OC AS03790 [0,2,0,0,0,0|2,0,0]=4 497 B13R1.961 COC(c1ccc(cc1F)Br)OC AS03810 [0,2,0,0,0,0|2,0,0]=4 498 B13R1.961 COC(c1ccc(cc1F)I)OC AS03888 [0,2,0,0,0,0|2,0,0]=4 499 B11R2.36 Cc1ccc2c(c1)OCO2 AS01485 [1,0,0,1,0,0|1,0,0]=3 500 B11R2.36 c1cc2c(cc1Br)OCC2 AS06451 [1,0,0,1,0,0|1,0,0]=3 501 B11R2.36 c1cc2c(cc1Br)OCO2 AS00922 [1,0,0,1,0,0|2,0,0]=4 502 B11R2.36 c1cc2c(cc1Cl)OCO2 AS02681 [1,0,0,1,0,0|2,0,0]=4 503 B11R2.36 c1cc2c(cc1I)OCO2 AS02215 [1,0,0,1,0,0|2,0,0]=4 504 B11R2.36 c1cc2c(cc1N)OCO2 AS06260 [1,0,0,1,0,0|2,0,0]=4 505 B11R1.20 CC(C)Cc1ccc(cc1)Br AS05659 [1,0,0,0,0,1|1,0,0]=3 506 B11R1.20 CC(C)Oc1ccc(cc1)N AS05394 [1,0,0,0,0,1|1,0,0]=3 507 B11R1.20 CC(Oc1ccc(cc1)Br)Cl AS03451 [1,0,0,0,0,1|2,0,0]=4 508 B11R1.20 Cc1ccc(cc1)NC(=O)C AS00879 [1,0,0,0,0,1|1,0,1]=4 509 B11R1.86 CC(=O)Nc1ccccc1O AS00888 [1,0,0,0,0,1|1,0,1]=4 510 B11R1.86 CC(C)Oc1ccccc1Br AS03456 [1,0,0,0,0,1|1,0,0]=3