0 B11R1.280 CCc1cc(ccc1Cl)OC AS02713 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.280 CCc1cc(ccc1F)C#N AS05847 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.280 CCc1cc(ccc1N)C#N AS05780 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.280 CCc1cc(ccc1O)C=O AS06477 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.280 CCc1ccc(c(c1)OC)Cl AS02712 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.280 CCc1ccc(c(c1)OC)Cl AS04234 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.280 COc1cc(ccc1Br)C#N AS03708 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.280 COc1cc(ccc1Br)C#N AS05806 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.280 COc1cc(ccc1Cl)C#N AS03722 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.280 COc1cc(ccc1Cl)C=O AS02209 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.280 COc1cc(ccc1F)C#N AS02562 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.280 COc1cc(ccc1F)C#N AS03743 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.280 COc1cc(ccc1F)C=O AS03896 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.280 COc1cc(ccc1F)CBr AS05974 [0,0,0,0,0,0|2,0,1]=3 14 B11R1.280 COc1cc(ccc1F)CCl AS00668 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.280 COc1cc(ccc1F)CN AS02610 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.280 COc1cc(ccc1F)CO AS03983 [0,0,0,0,0,0|1,0,2]=3 17 B11R1.280 COc1cc(ccc1I)C#N AS03754 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.280 COc1cc(ccc1N)C#N AS02377 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.280 COc1cc(ccc1O)C#N AS03749 [0,0,0,0,0,0|1,0,1]=2 20 B11R1.280 COc1ccc(c(c1)C=O)O AS02847 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.280 COc1ccc(c(c1)OC)Br AS03217 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.280 COc1ccc(c(c1)OC)Cl AS02696 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.280 COc1ccc(c(c1)OC)F AS05712 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.280 COc1ccc(c(c1)OC)I AS02535 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.280 Cc1ccc(cc1OC)C#N AS03759 [0,0,0,0,0,0|2,0,1]=3 26 B11R1.280 Cc1ccc(cc1OC)C=O AS03926 [0,0,0,0,0,0|1,0,0]=1 27 B11R1.280 Cc1ccc(cc1OC)CN AS00998 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.280 Cc1ccc(cc1OC)CO AS03990 [0,0,0,0,0,0|1,0,2]=3 29 B11R1.280 Cc1ccc(cc1OC)OC AS02539 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.280 c1cc(c(cc1C#N)C=O)O AS06313 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.280 c1cc(c(cc1C=O)C#N)F AS02849 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.30 CCc1cc(ccc1Br)Br AS03545 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.30 CCc1cc(ccc1Cl)Br AS03142 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.30 CCc1cc(ccc1Cl)O AS02715 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.30 CCc1cc(ccc1F)O AS06528 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.30 CCc1cc(ccc1I)Br AS03256 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.30 CCc1cc(ccc1N)Br AS03251 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.30 CCc1cc(ccc1N)Br AS05294 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.30 COc1cc(ccc1Br)Br AS04244 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.30 COc1cc(ccc1Br)Cl AS03119 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.30 COc1cc(ccc1Br)F AS01361 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.30 COc1cc(ccc1Br)I AS02406 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.30 COc1cc(ccc1Br)N AS03268 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.30 COc1cc(ccc1Br)O AS06704 [1,0,0,0,0,0|1,0,1]=3 45 B10R1.30 COc1cc(ccc1Cl)Br AS03122 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.30 COc1cc(ccc1Cl)Cl AS02855 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.30 COc1cc(ccc1Cl)F AS02723 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.30 COc1cc(ccc1Cl)I AS03055 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.30 COc1cc(ccc1Cl)N AS04122 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.30 COc1cc(ccc1Cl)O AS06584 [1,0,0,0,0,0|1,0,1]=3 51 B10R1.30 COc1cc(ccc1F)Br AS01809 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.30 COc1cc(ccc1F)F AS02416 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.30 COc1cc(ccc1F)N AS04086 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.30 COc1cc(ccc1F)O AS05494 [1,0,0,0,0,0|1,0,1]=3 55 B10R1.30 COc1cc(ccc1I)Br AS05451 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.30 COc1cc(ccc1I)Cl AS01817 [1,0,0,0,0,0|2,0,0]=3 57 B10R1.30 COc1cc(ccc1I)I AS06497 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.30 COc1cc(ccc1I)N AS02236 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.30 COc1cc(ccc1N)Br AS03265 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.30 COc1cc(ccc1N)F AS01443 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.30 COc1cc(ccc1N)F AS05422 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.30 COc1cc(ccc1N)I AS05429 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.30 COc1cc(ccc1O)Cl AS02798 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.30 COc1cc(ccc1O)F AS00164 [1,0,0,0,0,0|1,0,0]=2 65 B10R1.30 COc1cc(ccc1O)N AS06520 [1,0,0,0,0,0|1,0,0]=2 66 B10R1.30 Cc1ccc(c(c1)C#N)O AS06290 [1,0,0,0,0,0|2,0,1]=4 67 B10R1.30 Cc1ccc(c(c1)OC)Br AS04221 [1,0,0,0,0,0|1,0,1]=3 68 B10R1.30 Cc1ccc(c(c1)OC)C AS02542 [1,0,0,0,0,0|1,0,1]=3 69 B10R1.30 Cc1ccc(c(c1)OC)Cl AS02806 [1,0,0,0,0,0|1,0,1]=3 70 B10R1.30 Cc1ccc(c(c1)OC)Cl AS04239 [1,0,0,0,0,0|1,0,1]=3 71 B10R1.30 Cc1ccc(c(c1)OC)F AS04269 [1,0,0,0,0,0|1,0,1]=3 72 B10R1.30 Cc1ccc(c(n1)OC)F AS04867 [1,0,0,0,0,0|2,0,1]=4 73 B10R1.30 Cc1ccc(cc1OC)Br AS03406 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.30 Cc1ccc(cc1OC)Cl AS02811 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.30 Cc1ccc(cc1OC)F AS02628 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.30 Cc1ccc(cc1OC)I AS02250 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.30 Cc1ccc(cc1OC)N AS00997 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.30 c1cc(c(cc1Br)C#N)O AS03704 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.30 c1cc(c(cc1Br)C=O)O AS03816 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.30 c1cc(c(cc1Br)CO)O AS00554 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.30 c1cc(c(cc1Cl)C=O)O AS02954 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.30 c1cc(c(cc1Cl)C=O)O AS03840 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.30 c1cc(c(cc1F)C=O)O AS01457 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.30 c1cc(c(cc1I)C#N)O AS03748 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.172 CCc1cccc(c1)C#N AS05846 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.172 COc1cccc(c1)C=O AS02843 [1,0,0,0,0,0|0,0,0]=1 87 B10R1.172 COc1cccc(c1)CCl AS02050 [1,0,0,0,0,0|1,0,1]=3 88 B10R1.172 COc1cccc(c1)CN AS00384 [1,0,0,0,0,0|1,0,1]=3 89 B10R1.172 COc1cccc(c1)CO AS00566 [1,0,0,0,0,0|0,0,2]=3 90 B10R1.172 COc1cccc(c1)OC AS06961 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.172 COc1cccc(c1)SC AS04295 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.172 COc1cccc(n1)OC AS04949 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.172 c1cc(cc(c1)C#N)C=O AS02989 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.172 c1cc(cc(c1)C=O)CBr AS04511 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.176 C=Cc1ccc(c(c1)F)F AS03797 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.176 CCc1ccc(c(c1)N)O AS06527 [1,0,0,0,0,0|2,0,1]=4 97 B10R1.176 CCc1ccc(c(c1)O)Cl AS02714 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.176 CCc1ccc(c(c1)O)O AS06481 [1,0,0,0,0,0|1,0,1]=3 99 B10R1.176 COc1ccc(c(c1)Br)O AS03403 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.176 COc1ccc(c(c1)Cl)O AS00233 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.176 COc1ccc(c(c1)F)O AS02618 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.176 Cc1cc(ccc1Br)C#N AS03711 [1,0,0,0,0,0|2,0,1]=4 103 B10R1.176 Cc1cc(ccc1Br)C=O AS06928 [1,0,0,0,0,0|1,0,0]=2 104 B10R1.176 Cc1cc(ccc1Br)OC AS01021 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.176 Cc1cc(ccc1Cl)C#N AS03724 [1,0,0,0,0,0|2,0,1]=4 106 B10R1.176 Cc1cc(ccc1Cl)C=O AS05565 [1,0,0,0,0,0|1,0,0]=2 107 B10R1.176 Cc1cc(ccc1Cl)OC AS02810 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.176 Cc1cc(ccc1F)C#N AS01685 [1,0,0,0,0,0|2,0,1]=4 109 B10R1.176 Cc1cc(ccc1F)C#N AS04686 [1,0,0,0,0,0|2,0,1]=4 110 B10R1.176 Cc1cc(ccc1F)C=O AS01472 [1,0,0,0,0,0|1,0,0]=2 111 B10R1.176 Cc1cc(ccc1F)CN AS01941 [1,0,0,0,0,0|2,0,1]=4 112 B10R1.176 Cc1cc(ccc1F)CN AS02008 [1,0,0,0,0,0|2,0,1]=4 113 B10R1.176 Cc1cc(ccc1F)OC AS02627 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.176 Cc1cc(ccc1I)C#N AS03758 [1,0,0,0,0,0|2,0,1]=4 115 B10R1.176 Cc1cc(ccc1N)C#N AS02394 [1,0,0,0,0,0|2,0,1]=4 116 B10R1.176 Cc1cc(ccc1N)OC AS00349 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.176 Cc1cc(ccc1O)C=O AS05603 [1,0,0,0,0,0|0,0,0]=1 118 B10R1.176 Cc1ccc(cc1Br)C=O AS02205 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.176 Cc1ccc(cc1C)C=O AS05590 [1,0,0,0,0,0|1,0,0]=2 120 B10R1.176 Cc1ccc(cc1C)CCl AS00712 [1,0,0,0,0,0|2,0,1]=4 121 B10R1.176 Cc1ccc(cc1C)CN AS06971 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.176 Cc1ccc(cc1C)CO AS00594 [1,0,0,0,0,0|1,0,2]=4 123 B10R1.176 Cc1ccc(cc1C)NN AS07068 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.176 Cc1ccc(cc1C)OC AS02544 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.176 Cc1ccc(cc1Cl)C=O AS02998 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.176 c1cc(c(cc1C#N)Br)O AS03702 [1,0,0,0,0,0|2,0,1]=4 127 B10R1.176 c1cc(c(cc1C#N)Cl)O AS03718 [1,0,0,0,0,0|2,0,1]=4 128 B10R1.176 c1cc(c(cc1C#N)F)O AS02587 [1,0,0,0,0,0|2,0,1]=4 129 B10R1.176 c1cc(c(cc1C#N)O)Cl AS06369 [1,0,0,0,0,0|2,0,1]=4 130 B10R1.176 c1cc(c(cc1C#N)O)F AS05849 [1,0,0,0,0,0|2,0,1]=4 131 B10R1.176 c1cc(c(cc1C#N)O)I AS05862 [1,0,0,0,0,0|2,0,1]=4 132 B10R1.176 c1cc(c(cc1C=O)Br)Br AS03024 [1,0,0,0,0,0|2,0,0]=3 133 B10R1.176 c1cc(c(cc1C=O)Br)Cl AS04969 [1,0,0,0,0,0|2,0,0]=3 134 B10R1.176 c1cc(c(cc1C=O)Br)F AS03018 [1,0,0,0,0,0|2,0,0]=3 135 B10R1.176 c1cc(c(cc1C=O)Br)O AS03815 [1,0,0,0,0,0|1,0,0]=2 136 B10R1.176 c1cc(c(cc1C=O)Cl)Cl AS03015 [1,0,0,0,0,0|2,0,0]=3 137 B10R1.176 c1cc(c(cc1C=O)Cl)F AS03021 [1,0,0,0,0,0|2,0,0]=3 138 B10R1.176 c1cc(c(cc1C=O)Cl)O AS06839 [1,0,0,0,0,0|1,0,0]=2 139 B10R1.176 c1cc(c(cc1C=O)F)Br AS01429 [1,0,0,0,0,0|2,0,0]=3 140 B10R1.176 c1cc(c(cc1C=O)F)Br AS03947 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.176 c1cc(c(cc1C=O)F)Cl AS03837 [1,0,0,0,0,0|2,0,0]=3 142 B10R1.176 c1cc(c(cc1C=O)F)F AS01454 [1,0,0,0,0,0|2,0,0]=3 143 B10R1.176 c1cc(c(cc1C=O)F)I AS05595 [1,0,0,0,0,0|2,0,0]=3 144 B10R1.176 c1cc(c(cc1C=O)F)O AS03052 [1,0,0,0,0,0|1,0,0]=2 145 B10R1.176 c1cc(c(cc1C=O)I)Br AS06471 [1,0,0,0,0,0|2,0,0]=3 146 B10R1.176 c1cc(c(cc1C=O)I)Cl AS06472 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.176 c1cc(c(cc1C=O)I)F AS03887 [1,0,0,0,0,0|2,0,0]=3 148 B10R1.176 c1cc(c(cc1C=O)I)F AS05596 [1,0,0,0,0,0|2,0,0]=3 149 B10R1.176 c1cc(c(cc1C=O)I)I AS06470 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.176 c1cc(c(cc1C=O)I)O AS02778 [1,0,0,0,0,0|1,0,0]=2 151 B10R1.176 c1cc(c(cc1C=O)O)Br AS05537 [1,0,0,0,0,0|1,0,0]=2 152 B10R1.176 c1cc(c(cc1CO)O)I AS05984 [1,0,0,0,0,0|1,0,2]=4 153 B12R1.56 CC(=O)c1ccc(c(c1)C#N)N AS05770 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.56 CC(=O)c1ccc(c(c1)OC)F AS01208 [0,1,0,0,0,0|1,0,0]=2 155 B12R1.56 CC(=O)c1ccc(c(c1)OC)O AS03910 [0,1,0,0,0,0|0,0,0]=1 156 B12R1.56 COc1cc(ccc1Br)C(=O)N AS03390 [0,1,0,0,0,0|1,0,0]=2 157 B12R1.56 COc1cc(ccc1Br)C(=O)O AS03393 [0,1,0,0,0,0|1,0,0]=2 158 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] AS01276 [0,1,0,0,0,0|2,0,0]=3 159 B12R1.56 COc1cc(ccc1Cl)C(=O)N AS02792 [0,1,0,0,0,0|1,0,0]=2 160 B12R1.56 COc1cc(ccc1Cl)C(=O)O AS02794 [0,1,0,0,0,0|1,0,0]=2 161 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] AS02826 [0,1,0,0,0,0|2,0,0]=3 162 B12R1.56 COc1cc(ccc1F)C(=O)O AS02599 [0,1,0,0,0,0|1,0,0]=2 163 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] AS04489 [0,1,0,0,0,0|2,0,0]=3 164 B12R1.56 COc1cc(ccc1I)C(=O)N AS02238 [0,1,0,0,0,0|1,0,0]=2 165 B12R1.56 COc1cc(ccc1I)C(=O)O AS02242 [0,1,0,0,0,0|1,0,0]=2 166 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] AS01818 [0,1,0,0,0,0|2,0,0]=3 167 B12R1.56 COc1cc(ccc1N)C(=O)O AS01781 [0,1,0,0,0,0|1,0,0]=2 168 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] AS00999 [0,1,0,0,0,0|2,0,0]=3 169 B12R1.56 CSc1cc(ccc1Br)[N+](=O)[O-] AS04179 [0,1,0,0,0,0|2,1,0]=4 170 B12R1.56 Cc1ccc(cc1C#C)C(=O)O AS07172 [0,1,0,0,0,0|2,0,1]=4 171 B12R1.56 Cc1ccc(cc1OC)C(=O)O AS01295 [0,1,0,0,0,0|1,0,0]=2 172 B12R1.56 Cc1ccc(cc1OC)[N+](=O)[O-] AS01045 [0,1,0,0,0,0|2,0,0]=3 173 B12R1.56 c1cc(c(cc1C(=O)O)C#N)O AS06365 [0,1,0,0,0,0|2,0,0]=3 174 B12R1.56 c1cc(c(cc1[N+](=O)[O-])C#N)O AS06279 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.56 c1cc(c(cc1[N+](=O)[O-])C=O)O AS02978 [0,1,0,0,0,0|3,0,0]=4 176 B12R1.78 CCc1cc(ccc1OC)OC AS02529 [0,1,0,0,0,0|3,0,0]=4 177 B12R1.78 CCc1ccc(c(c1)OC)OC AS02528 [0,1,0,0,0,0|1,0,1]=3 178 B12R1.78 COc1cc(ccc1C=O)C#N AS02784 [0,1,0,0,0,0|1,0,2]=4 179 B12R1.78 COc1ccc(c(c1)OC)C=O AS02817 [0,1,0,0,0,0|2,0,1]=4 180 B12R1.78 COc1ccc(c(c1)OC)CN AS02517 [0,1,0,0,0,0|3,0,0]=4 181 B12R1.78 COc1ccc(c(c1)OC)CO AS00570 [0,1,0,0,0,0|2,0,0]=3 182 B12R1.78 COc1ccc(c(c1)OC)OC AS01075 [0,1,0,0,0,0|2,0,0]=3 183 B12R1.78 COc1ccc(cc1OC)C#C AS06822 [0,1,0,0,0,0|1,0,1]=3 184 B12R1.78 COc1ccc(cc1OC)C#N AS02546 [0,1,0,0,0,0|1,0,1]=3 185 B12R1.78 COc1ccc(cc1OC)C=O AS02987 [0,1,0,0,0,0|0,0,0]=1 186 B12R1.78 COc1ccc(cc1OC)CN AS02518 [0,1,0,0,0,0|1,0,1]=3 187 B12R1.78 COc1ccc(cc1OC)CO AS05969 [0,1,0,0,0,0|0,0,2]=3 188 B12R1.270 CCOc1cc(ccc1Br)C#N AS03701 [0,1,0,0,0,0|2,0,1]=4 189 B12R1.270 CCOc1cc(ccc1Cl)C#N AS03715 [0,1,0,0,0,0|2,0,1]=4 190 B12R1.270 CCOc1cc(ccc1I)C#N AS03733 [0,1,0,0,0,0|2,0,1]=4 191 B12R1.286 COc1cc(ccc1F)CC#N AS01756 [0,1,0,0,0,0|2,0,1]=4 192 B12R1.300 COc1cc(c(c(c1)F)Br)OC AS03219 [0,1,0,0,0,0|3,0,0]=4 193 B12R1.300 COc1cc(c(c(c1)OC)F)N AS05374 [0,1,0,0,0,0|3,0,0]=4 194 B12R1.449 COc1cc(c(cc1Br)Br)OC AS03539 [0,1,0,0,0,0|3,0,0]=4 195 B12R1.449 COc1cc(c(cc1O)F)OC AS00167 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.453 CC(=O)c1cc(ccc1O)C#N AS05152 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.453 c1cc(c(cc1C=O)[N+](=O)[O-])Cl AS03028 [0,1,0,0,0,0|3,0,0]=4 198 B12R1.453 c1cc(c(cc1C=O)[N+](=O)[O-])F AS03031 [0,1,0,0,0,0|3,0,0]=4 199 B12R1.453 c1cc(c(cc1C=O)[N+](=O)[O-])N AS06988 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.654 COc1c(ccc(c1F)C#N)F AS01664 [0,1,0,0,0,0|2,0,1]=4 201 B12R2.44 c1cc(cc2c1cco2)C=O AS06420 [0,0,0,1,0,0|1,0,1]=3 202 B12R2.44 c1cc2c(cco2)cc1C=O AS06442 [0,0,0,1,0,0|1,0,1]=3 203 B9R1.2 C=Cc1cccc(c1)Br AS03805 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.2 C=Cc1cccc(c1)F AS03775 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.2 CCc1cccc(c1)Br AS03253 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.2 CCc1cccc(c1)N AS00465 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.2 CCc1cccc(c1)O AS04468 [2,0,0,0,0,0|1,0,1]=4 208 B9R1.2 CNc1cccc(c1)O AS06505 [2,0,0,0,0,0|1,0,1]=4 209 B9R1.2 COc1cc(ccn1)Br AS04921 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.2 COc1cccc(c1)Br AS04314 [2,0,0,0,0,0|1,0,0]=3 211 B9R1.2 COc1cccc(c1)Cl AS02677 [2,0,0,0,0,0|1,0,0]=3 212 B9R1.2 COc1cccc(c1)F AS02585 [2,0,0,0,0,0|1,0,0]=3 213 B9R1.2 COc1cccc(c1)I AS02207 [2,0,0,0,0,0|1,0,0]=3 214 B9R1.2 COc1cccc(c1)N AS01512 [2,0,0,0,0,0|1,0,0]=3 215 B9R1.2 COc1cccc(c1)O AS00218 [2,0,0,0,0,0|0,0,1]=3 216 B9R1.2 COc1cccc(c1)S AS00080 [2,0,0,0,0,0|0,1,0]=3 217 B9R1.2 COc1cccc(n1)Br AS04908 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.2 CSc1cccc(c1)Br AS04292 [2,0,0,0,0,0|1,1,0]=4 219 B9R1.2 CSc1cccc(c1)Cl AS04288 [2,0,0,0,0,0|1,1,0]=4 220 B9R1.2 CSc1cccc(c1)F AS04285 [2,0,0,0,0,0|1,1,0]=4 221 B9R1.2 CSc1cccc(c1)I AS04300 [2,0,0,0,0,0|1,1,0]=4 222 B9R1.2 CSc1cccc(c1)N AS04282 [2,0,0,0,0,0|1,1,0]=4 223 B9R1.2 Cc1cccc(c1)C#N AS02590 [2,0,0,0,0,0|1,0,1]=4 224 B9R1.2 Cc1cccc(c1)C=O AS02785 [2,0,0,0,0,0|0,0,0]=2 225 B9R1.2 Cc1cccc(c1)CCl AS00628 [2,0,0,0,0,0|1,0,1]=4 226 B9R1.2 Cc1cccc(c1)CF AS05991 [2,0,0,0,0,0|1,0,1]=4 227 B9R1.2 Cc1cccc(c1)CN AS00385 [2,0,0,0,0,0|1,0,1]=4 228 B9R1.2 Cc1cccc(c1)OC AS01016 [2,0,0,0,0,0|0,0,1]=3 229 B9R1.2 Cc1cccc(c1)SC AS04308 [2,0,0,0,0,0|0,1,1]=4 230 B9R1.2 c1cc(cc(c1)Br)C=O AS02864 [2,0,0,0,0,0|1,0,0]=3 231 B9R1.2 c1cc(cc(c1)Cl)C=O AS02776 [2,0,0,0,0,0|1,0,0]=3 232 B9R1.2 c1cc(cc(c1)F)C=O AS03000 [2,0,0,0,0,0|1,0,0]=3 233 B9R1.2 c1cc(cc(c1)I)C=O AS03915 [2,0,0,0,0,0|1,0,0]=3 234 B9R1.2 c1cc(cc(c1)O)C#N AS02649 [2,0,0,0,0,0|1,0,1]=4 235 B9R1.2 c1cc(cc(c1)O)CO AS00159 [2,0,0,0,0,0|0,0,2]=4 236 B9R1.15 CCc1ccccc1Br AS03252 [2,0,0,0,0,0|2,0,0]=4 237 B9R1.15 CCc1ccccc1I AS02158 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.15 CNc1ccccc1N AS04592 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.15 COc1c(cccn1)Br AS04919 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.15 COc1c(cccn1)I AS04954 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.15 COc1ccccc1Br AS02357 [2,0,0,0,0,0|1,0,0]=3 242 B9R1.15 COc1ccccc1Cl AS02676 [2,0,0,0,0,0|1,0,0]=3 243 B9R1.15 COc1ccccc1F AS01803 [2,0,0,0,0,0|1,0,0]=3 244 B9R1.15 COc1ccccc1I AS02206 [2,0,0,0,0,0|1,0,0]=3 245 B9R1.15 COc1ccccc1N AS01503 [2,0,0,0,0,0|1,0,0]=3 246 B9R1.15 COc1ccncc1Br AS04703 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.15 COc1ccncc1Cl AS04708 [2,0,0,0,0,0|2,0,0]=4 248 B9R1.15 CSc1ccccc1Br AS04291 [2,0,0,0,0,0|1,1,0]=4 249 B9R1.15 CSc1ccccc1Cl AS04287 [2,0,0,0,0,0|1,1,0]=4 250 B9R1.15 CSc1ccccc1F AS04284 [2,0,0,0,0,0|1,1,0]=4 251 B9R1.15 CSc1ccccc1I AS04299 [2,0,0,0,0,0|1,1,0]=4 252 B9R1.15 CSc1ccccc1N AS04281 [2,0,0,0,0,0|1,1,0]=4 253 B9R1.15 CSc1ccccc1O AS04298 [2,0,0,0,0,0|0,1,0]=3 254 B9R1.15 Cc1ccccc1OC AS01015 [2,0,0,0,0,0|1,0,0]=3 255 B9R1.15 Cc1ccccc1SC AS04306 [2,0,0,0,0,0|1,1,0]=4 256 B9R1.15 c1ccc(c(c1)C#N)O AS02648 [2,0,0,0,0,0|2,0,0]=4 257 B9R1.15 c1ccc(c(c1)C=O)O AS03003 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.15 c1ccc(c(c1)C=O)O AS07244 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.15 c1ccc(c(c1)CO)O AS00547 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.69 Cc1cc(ccc1Br)Br AS00106 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.69 Cc1cc(ccc1Br)Cl AS03173 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.69 Cc1cc(ccc1Br)F AS01019 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.69 Cc1cc(ccc1Br)I AS03372 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.69 Cc1cc(ccc1Br)N AS03419 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.69 Cc1cc(ccc1Br)N AS04116 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.69 Cc1cc(ccc1Br)N AS06933 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.69 Cc1cc(ccc1Br)O AS06856 [2,0,0,0,0,0|1,0,1]=4 268 B9R1.69 Cc1cc(ccc1Cl)Br AS00100 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.69 Cc1cc(ccc1Cl)Cl AS02895 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.69 Cc1cc(ccc1Cl)F AS02757 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.69 Cc1cc(ccc1Cl)I AS03077 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.69 Cc1cc(ccc1Cl)N AS02804 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.69 Cc1cc(ccc1Cl)N AS02805 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.69 Cc1cc(ccc1F)Br AS03336 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.69 Cc1cc(ccc1F)Cl AS04754 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.69 Cc1cc(ccc1F)F AS02070 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.69 Cc1cc(ccc1F)I AS02074 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.69 Cc1cc(ccc1F)N AS03242 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.69 Cc1cc(ccc1F)O AS01400 [2,0,0,0,0,0|1,0,1]=4 280 B9R1.69 Cc1cc(ccc1I)Br AS03379 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.69 Cc1cc(ccc1I)Cl AS00124 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.69 Cc1cc(ccc1I)F AS02194 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.69 Cc1cc(ccc1I)I AS02148 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.69 Cc1cc(ccc1I)O AS04647 [2,0,0,0,0,0|1,0,1]=4 285 B9R1.69 Cc1cc(ccc1N)Br AS00449 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.69 Cc1cc(ccc1N)Br AS03418 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.69 Cc1cc(ccc1N)Cl AS00413 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.69 Cc1cc(ccc1N)F AS04091 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.69 Cc1cc(ccc1N)I AS02257 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.69 Cc1cc(ccc1O)Br AS00228 [2,0,0,0,0,0|1,0,0]=3 291 B9R1.69 Cc1cc(ccc1O)Br AS06250 [2,0,0,0,0,0|1,0,0]=3 292 B9R1.69 Cc1cc(ccc1O)Cl AS02822 [2,0,0,0,0,0|1,0,0]=3 293 B9R1.69 Cc1cc(ccc1O)F AS01399 [2,0,0,0,0,0|1,0,0]=3 294 B9R1.69 Cc1ccc(c(c1)C)Br AS03232 [2,0,0,0,0,0|1,0,1]=4 295 B9R1.69 Cc1ccc(c(c1)C)C AS00262 [2,0,0,0,0,0|1,0,1]=4 296 B9R1.69 Cc1ccc(c(c1)C)Cl AS02702 [2,0,0,0,0,0|1,0,1]=4 297 B9R1.69 Cc1ccc(c(c1)C)F AS00279 [2,0,0,0,0,0|1,0,1]=4 298 B9R1.69 Cc1ccc(c(c1)C)I AS02153 [2,0,0,0,0,0|1,0,1]=4 299 B9R1.69 Cc1ccc(c(c1)C)N AS01548 [2,0,0,0,0,0|1,0,1]=4 300 B9R1.69 Cc1ccc(c(c1)Cl)O AS02819 [2,0,0,0,0,0|1,0,1]=4 301 B9R1.69 Cc1ccc(c(c1)O)Br AS00227 [2,0,0,0,0,0|1,0,1]=4 302 B9R1.69 Cc1ccc(c(c1)O)C AS00223 [2,0,0,0,0,0|1,0,1]=4 303 B9R1.69 Cc1ccc(c(c1)O)Cl AS02820 [2,0,0,0,0,0|1,0,1]=4 304 B9R1.69 Cc1ccc(c(c1)O)F AS00182 [2,0,0,0,0,0|1,0,1]=4 305 B9R1.69 Cc1ccc(c(c1)O)O AS07054 [2,0,0,0,0,0|0,0,1]=3 306 B9R1.69 Cc1ccc(cc1C)Br AS03659 [2,0,0,0,0,0|2,0,0]=4 307 B9R1.69 Cc1ccc(cc1C)Cl AS02704 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.69 Cc1ccc(cc1C)F AS00280 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.69 Cc1ccc(cc1C)I AS02151 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.69 Cc1ccc(cc1C)N AS07069 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.69 Cc1ccc(cc1O)Br AS04653 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.69 Cc1ccc(cc1O)Cl AS02823 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.69 Cc1ccc(cc1O)F AS00890 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.69 Cc1ccc(cc1O)N AS05434 [2,0,0,0,0,0|2,0,0]=4 315 B9R1.69 Cc1ccc(cc1O)O AS06296 [2,0,0,0,0,0|1,0,1]=4 316 B9R1.69 c1cc(c(cc1Br)Cl)O AS03169 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.69 c1cc(c(cc1Br)F)O AS00212 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.69 c1cc(c(cc1Br)I)O AS05450 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.69 c1cc(c(cc1Br)N)O AS00170 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.69 c1cc(c(cc1Br)O)Br AS04420 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.69 c1cc(c(cc1Br)O)Cl AS00161 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.69 c1cc(c(cc1Br)O)F AS00226 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.69 c1cc(c(cc1Br)O)N AS05408 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.69 c1cc(c(cc1Cl)Br)O AS03166 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.69 c1cc(c(cc1Cl)F)O AS00395 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.69 c1cc(c(cc1Cl)I)O AS05468 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.69 c1cc(c(cc1Cl)N)O AS04639 [2,0,0,0,0,0|2,0,0]=4 328 B9R1.69 c1cc(c(cc1Cl)O)Cl AS02889 [2,0,0,0,0,0|2,0,0]=4 329 B9R1.69 c1cc(c(cc1Cl)O)F AS01380 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.69 c1cc(c(cc1Cl)O)I AS03074 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.69 c1cc(c(cc1F)Br)O AS00231 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.69 c1cc(c(cc1F)Cl)O AS00391 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.69 c1cc(c(cc1F)F)O AS00157 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.69 c1cc(c(cc1F)I)O AS06581 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.69 c1cc(c(cc1F)N)O AS00224 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.69 c1cc(c(cc1F)O)Br AS00222 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.69 c1cc(c(cc1F)O)Cl AS00194 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.69 c1cc(c(cc1F)O)F AS00183 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.69 c1cc(c(cc1F)O)I AS06580 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.69 c1cc(c(cc1F)O)N AS01348 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.69 c1cc(c(cc1F)O)O AS01420 [2,0,0,0,0,0|1,0,0]=3 342 B9R1.69 c1cc(c(cc1I)Br)O AS06568 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.69 c1cc(c(cc1I)F)O AS05492 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.69 c1cc(c(cc1I)O)Cl AS03072 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.69 c1cc(c(cc1I)O)I AS06590 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.69 c1cc(c(cc1N)Cl)O AS06870 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.69 c1cc(c(cc1N)F)O AS01350 [2,0,0,0,0,0|2,0,0]=4 348 B9R1.69 c1cc(c(cc1N)O)Cl AS05416 [2,0,0,0,0,0|2,0,0]=4 349 B9R1.69 c1cc(c(cc1O)Cl)O AS02779 [2,0,0,0,0,0|1,0,1]=4 350 B9R1.69 c1cc(c(cc1O)O)F AS05497 [2,0,0,0,0,0|1,0,1]=4 351 B9R1.69 c1cc(c(cc1O)O)N AS05427 [2,0,0,0,0,0|1,0,1]=4 352 B9R1.69 c1cc(c(cc1O)O)O AS00200 [2,0,0,0,0,0|0,0,1]=3 353 B9R1.1 C=Cc1ccc(cc1)Br AS03806 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.1 C=Cc1ccc(cc1)F AS03795 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.1 COc1ccc(cc1)O AS04576 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.1 Cc1ccc(cc1)C=O AS02824 [2,0,0,0,0,0|1,0,0]=3 357 B9R1.1 c1cc(ccc1C#N)O AS02647 [2,0,0,0,0,0|1,0,1]=4 358 B9R1.1 c1cc(ccc1C=O)Br AS02893 [2,0,0,0,0,0|1,0,0]=3 359 B9R1.1 c1cc(ccc1C=O)Cl AS02986 [2,0,0,0,0,0|1,0,0]=3 360 B9R1.1 c1cc(ccc1C=O)F AS02846 [2,0,0,0,0,0|1,0,0]=3 361 B9R1.1 c1cc(ccc1C=O)F AS03001 [2,0,0,0,0,0|1,0,0]=3 362 B9R1.1 c1cc(ccc1C=O)I AS03916 [2,0,0,0,0,0|1,0,0]=3 363 B9R1.1 c1cc(ccc1C=O)N AS06990 [2,0,0,0,0,0|1,0,0]=3 364 B9R1.1 c1cc(ccc1C=O)O AS02994 [2,0,0,0,0,0|0,0,0]=2 365 B9R1.1 c1cc(ccc1CO)O AS00576 [2,0,0,0,0,0|0,0,2]=4 366 B9R1.1 c1cc(ncc1C=O)Br AS06180 [2,0,0,0,0,0|2,0,0]=4 367 B11R1.8 COc1cc(cc(c1F)F)Br AS04316 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.8 Cc1cc(c(c(c1)OC)C)C AS01077 [1,1,0,0,0,0|1,0,1]=4 369 B11R1.8 Cc1cc(cc(c1N)OC)Br AS05411 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.37 COc1cc(ccc1C#C)O AS07209 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.37 COc1cc(ccc1C#N)Br AS02600 [1,1,0,0,0,0|2,0,0]=4 372 B11R1.37 COc1cc(ccc1C#N)F AS03742 [1,1,0,0,0,0|2,0,0]=4 373 B11R1.37 COc1cc(ccc1C#N)O AS06316 [1,1,0,0,0,0|1,0,1]=4 374 B11R1.37 COc1cc(ccc1C=O)Br AS02782 [1,1,0,0,0,0|1,0,1]=4 375 B11R1.37 COc1cc(ccc1C=O)Cl AS03934 [1,1,0,0,0,0|1,0,1]=4 376 B11R1.37 COc1cc(ccc1C=O)Cl AS05560 [1,1,0,0,0,0|1,0,1]=4 377 B11R1.37 COc1cc(ccc1C=O)F AS03036 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.37 COc1cc(ccc1C=O)O AS06309 [1,1,0,0,0,0|0,0,2]=4 379 B11R1.37 COc1cc(ccc1CCl)F AS00666 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.37 COc1cc(ccc1CN)F AS02609 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.37 COc1cc(ccc1CO)Br AS00555 [1,1,0,0,0,0|1,0,0]=3 382 B11R1.37 COc1cc(ccc1CO)Cl AS04003 [1,1,0,0,0,0|1,0,0]=3 383 B11R1.37 COc1cc(ccc1CO)F AS03982 [1,1,0,0,0,0|1,0,0]=3 384 B11R1.37 COc1ccc(cc1OC)Br AS03218 [1,1,0,0,0,0|1,0,0]=3 385 B11R1.37 COc1ccc(cc1OC)F AS02401 [1,1,0,0,0,0|1,0,0]=3 386 B11R1.37 COc1ccc(cc1OC)I AS02534 [1,1,0,0,0,0|1,0,0]=3 387 B11R1.37 COc1ccc(cc1OC)O AS01392 [1,1,0,0,0,0|0,0,1]=3 388 B11R1.37 Cc1ccc(c(c1)OC)C#N AS05867 [1,1,0,0,0,0|1,0,1]=4 389 B11R1.37 Cc1ccc(c(c1)OC)OC AS02540 [1,1,0,0,0,0|0,0,1]=3 390 B11R1.72 COc1c(ccc(c1Cl)F)F AS04263 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.72 COc1c(ccc(c1F)Cl)F AS04264 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.72 COc1c(ccc(c1F)F)F AS01412 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.72 COc1c(ccc(c1F)F)N AS05420 [1,1,0,0,0,0|2,0,0]=4 394 B11R1.72 Cc1ccc(c(c1Cl)OC)F AS04266 [1,1,0,0,0,0|1,0,1]=4 395 B11R1.72 Cc1ccc(c(c1F)OC)Cl AS04267 [1,1,0,0,0,0|1,0,1]=4 396 B11R1.72 Cc1ccc(c(c1F)OC)F AS04253 [1,1,0,0,0,0|1,0,1]=4 397 B11R1.167 CC(=O)c1cc(ccc1O)Br AS01134 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.167 CC(=O)c1cc(ccc1O)Cl AS03839 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.167 CC(=O)c1cc(ccc1O)F AS01202 [1,1,0,0,0,0|2,0,0]=4 400 B11R1.167 CC(=O)c1cc(ccc1O)N AS05086 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.167 CC(=O)c1cc(ccc1O)O AS05179 [1,1,0,0,0,0|1,0,1]=4 402 B11R1.167 CC(C)c1cc(ccc1O)Cl AS06506 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.167 CC(c1cc(ccc1O)Br)N AS04674 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.182 CCOc1cc(ccc1Br)N AS01553 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.182 CCOc1cc(ccc1Cl)F AS02750 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.182 CCOc1cc(ccc1F)Cl AS02755 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.277 COc1cc(c(cc1Br)F)F AS03198 [1,1,0,0,0,0|2,0,0]=4 408 B11R1.277 COc1cc(c(cc1Cl)Cl)N AS00411 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.277 COc1cc(c(cc1Cl)Cl)N AS02882 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.277 COc1cc(c(cc1Cl)Cl)N AS02883 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.277 COc1cc(c(cc1Cl)F)Br AS01354 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.277 COc1cc(c(cc1F)Br)F AS03199 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.277 COc1cc(c(cc1O)F)Br AS05446 [1,1,0,0,0,0|1,0,0]=3 414 B11R1.9 COc1cc(cc(c1)Br)C#N AS05805 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.9 COc1cc(cc(c1)Cl)OC AS02697 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.9 COc1cc(cc(c1)F)C#N AS05854 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.9 COc1cc(cc(c1)F)C=O AS06490 [1,1,0,0,0,0|0,0,0]=2 418 B11R1.9 COc1cc(cc(c1)F)CBr AS00625 [1,1,0,0,0,0|1,0,1]=4 419 B11R1.9 COc1cc(cc(c1)F)OC AS02530 [1,1,0,0,0,0|2,0,0]=4 420 B11R1.9 COc1cc(cc(c1)I)OC AS01576 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.9 COc1cc(cc(c1)OC)N AS00405 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.9 Cc1cc(cc(c1)OC)C#N AS06491 [1,1,0,0,0,0|1,0,1]=4 423 B11R1.9 Cc1cc(cc(c1)OC)C=O AS05606 [1,1,0,0,0,0|0,0,0]=2 424 B11R1.9 c1c(cc(cc1C#N)F)C=O AS05573 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.189 CCOc1cccc(c1)C=O AS05594 [1,1,0,0,0,0|0,0,0]=2 426 B11R1.189 COc1cccc(c1)CC#N AS01660 [1,1,0,0,0,0|1,0,1]=4 427 B11R1.189 COc1cccc(c1)CCN AS00486 [1,1,0,0,0,0|1,0,1]=4 428 B11R1.189 COc1cccc(c1)CCO AS00578 [1,1,0,0,0,0|0,0,2]=4 429 B11R1.189 CSc1cccc(c1)N=C=O AS04378 [1,1,0,0,0,0|0,1,1]=4 430 B11R1.266 B(c1cccc(c1)OC)(O)O AS06731 [1,1,0,0,0,0|1,0,1]=4 431 B11R1.266 CC(=O)c1cccc(c1)C#N AS01138 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.266 CC(=O)c1cccc(c1)CCl AS06810 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.266 CCc1cccc(c1)C(=O)C AS05184 [1,1,0,0,0,0|1,0,0]=3 434 B11R1.266 COc1cccc(c1)C(=O)O AS00759 [1,1,0,0,0,0|0,0,0]=2 435 B11R1.266 CSc1cccc(c1)[N+](=O)[O-] AS04260 [1,1,0,0,0,0|1,1,0]=4 436 B11R1.266 c1cc(cc(c1)C(=O)Cl)C#N AS07200 [1,1,0,0,0,0|2,0,0]=4 437 B11R1.266 c1cc(cc(c1)C(=O)O)CCl AS00739 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.266 c1cc(cc(c1)[N+](=O)[O-])C=O AS02844 [1,1,0,0,0,0|2,0,0]=4 439 B11R1.267 COc1cccc(c1F)C#N AS05852 [1,1,0,0,0,0|1,0,1]=4 440 B11R1.267 COc1cccc(c1F)C=O AS03037 [1,1,0,0,0,0|0,0,0]=2 441 B11R1.267 COc1cccc(c1N)C#N AS05784 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.267 COc1cccc(c1N)OC AS05365 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.267 COc1cccc(c1O)C#N AS06484 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.267 Cc1c(cccc1OC)OC AS02098 [1,1,0,0,0,0|2,0,0]=4 445 B11R1.267 c1cc(c(c(c1)C#N)Cl)C=O AS04488 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.267 c1cc(c(c(c1)C=O)Br)C=O AS02878 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.14 Cc1cc(cc(c1Br)C)C=O AS05534 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.14 Cc1cc(cc(c1N)C)C=O AS04606 [1,1,0,0,0,0|1,0,0]=3 449 B11R1.14 Cc1cc(cc(c1O)C)C=O AS06252 [1,1,0,0,0,0|0,0,0]=2 450 B11R1.14 c1c(cc(c(c1Cl)F)Cl)C=O AS05579 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.14 c1c(cc(c(c1F)Cl)Cl)C=O AS05578 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.14 c1c(cc(c(c1F)F)F)C=O AS01491 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.14 c1c(cc(c(c1I)O)I)C=O AS05589 [1,1,0,0,0,0|1,0,0]=3 454 B11R1.14 c1c(cc(c(c1O)O)Br)C=O AS06342 [1,1,0,0,0,0|0,0,0]=2 455 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br AS03854 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl AS05101 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.21 CC(=O)c1ccc(c(c1)Br)F AS01132 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.21 CC(=O)c1ccc(c(c1)Br)N AS05067 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl AS03863 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F AS01148 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O AS05145 [1,1,0,0,0,0|1,0,0]=3 462 B11R1.21 CC(=O)c1ccc(c(c1)F)Br AS05111 [1,1,0,0,0,0|2,0,0]=4 463 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl AS01173 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.21 CC(=O)c1ccc(c(c1)F)F AS01192 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.21 CC(=O)c1ccc(c(c1)F)N AS01172 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.21 CC(=O)c1ccc(c(c1)F)O AS01203 [1,1,0,0,0,0|1,0,0]=3 467 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl AS05249 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.21 CC(=O)c1ccc(c(c1)N)F AS04017 [1,1,0,0,0,0|2,0,0]=4 469 B11R1.21 CC(=O)c1ccc(c(c1)O)F AS03881 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.21 Cc1cc(ccc1Br)C(=O)C AS03824 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.21 Cc1cc(ccc1Br)C(=O)C AS05124 [1,1,0,0,0,0|1,0,0]=3 472 B11R1.21 Cc1cc(ccc1Br)C(=O)N AS03423 [1,1,0,0,0,0|1,0,0]=3 473 B11R1.21 Cc1cc(ccc1Br)C(=O)O AS02483 [1,1,0,0,0,0|1,0,0]=3 474 B11R1.21 Cc1cc(ccc1Br)[N+](=O)[O-] AS03682 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.21 Cc1cc(ccc1Cl)C(=O)C AS03848 [1,1,0,0,0,0|1,0,0]=3 476 B11R1.21 Cc1cc(ccc1Cl)C(=O)N AS02813 [1,1,0,0,0,0|1,0,0]=3 477 B11R1.21 Cc1cc(ccc1Cl)C(=O)O AS00788 [1,1,0,0,0,0|1,0,0]=3 478 B11R1.21 Cc1cc(ccc1Cl)[N+](=O)[O-] AS02830 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.21 Cc1cc(ccc1F)C(=O)C AS05267 [1,1,0,0,0,0|1,0,0]=3 480 B11R1.21 Cc1cc(ccc1F)C(=O)Cl AS00026 [1,1,0,0,0,0|1,0,0]=3 481 B11R1.21 Cc1cc(ccc1F)C(=O)O AS01875 [1,1,0,0,0,0|1,0,0]=3 482 B11R1.21 Cc1cc(ccc1F)[N+](=O)[O-] AS01271 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.21 Cc1cc(ccc1I)C(=O)N AS02260 [1,1,0,0,0,0|1,0,0]=3 484 B11R1.21 Cc1cc(ccc1I)C(=O)O AS02265 [1,1,0,0,0,0|1,0,0]=3 485 B11R1.21 Cc1cc(ccc1I)[N+](=O)[O-] AS02329 [1,1,0,0,0,0|2,0,0]=4 486 B11R1.21 Cc1cc(ccc1N)C(=O)O AS01122 [1,1,0,0,0,0|1,0,0]=3 487 B11R1.21 Cc1cc(ccc1N)[N+](=O)[O-] AS02088 [1,1,0,0,0,0|2,0,0]=4 488 B11R1.21 Cc1cc(ccc1O)C(=O)C AS04503 [1,1,0,0,0,0|0,0,0]=2 489 B11R1.21 Cc1cc(ccc1O)C(=O)O AS00899 [1,1,0,0,0,0|0,0,0]=2 490 B11R1.21 Cc1ccc(cc1Br)C(=O)C AS03823 [1,1,0,0,0,0|2,0,0]=4 491 B11R1.21 Cc1ccc(cc1Br)C(=O)N AS03422 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.21 Cc1ccc(cc1Br)C(=O)O AS02482 [1,1,0,0,0,0|2,0,0]=4 493 B11R1.21 Cc1ccc(cc1C)C(=O)C AS03873 [1,1,0,0,0,0|1,0,0]=3 494 B11R1.21 Cc1ccc(cc1C)C(=O)O AS00741 [1,1,0,0,0,0|1,0,0]=3 495 B11R1.21 Cc1ccc(cc1C)[N+](=O)[O-] AS07070 [1,1,0,0,0,0|2,0,0]=4 496 B11R1.21 Cc1ccc(cc1Cl)C(=O)O AS00790 [1,1,0,0,0,0|2,0,0]=4 497 B11R1.21 Cc1ccc(cc1F)C(=O)C AS05187 [1,1,0,0,0,0|2,0,0]=4 498 B11R1.21 Cc1ccc(cc1F)C(=O)O AS02484 [1,1,0,0,0,0|2,0,0]=4 499 B11R1.21 Cc1ccc(cc1I)C(=O)C AS03923 [1,1,0,0,0,0|2,0,0]=4 500 B11R1.21 Cc1ccc(cc1I)C(=O)N AS02259 [1,1,0,0,0,0|2,0,0]=4 501 B11R1.21 Cc1ccc(cc1I)C(=O)O AS02264 [1,1,0,0,0,0|2,0,0]=4 502 B11R1.21 Cc1ccc(cc1O)C(=O)C AS05196 [1,1,0,0,0,0|1,0,0]=3 503 B11R1.21 Cc1ccc(cc1O)C(=O)O AS01294 [1,1,0,0,0,0|1,0,0]=3 504 B11R1.21 c1cc(c(cc1C(=O)Cl)Br)F AS00045 [1,1,0,0,0,0|2,0,0]=4 505 B11R1.21 c1cc(c(cc1C(=O)Cl)Cl)F AS00038 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.21 c1cc(c(cc1C(=O)Cl)F)F AS00035 [1,1,0,0,0,0|2,0,0]=4 507 B11R1.21 c1cc(c(cc1C(=O)N)Cl)Cl AS02860 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.21 c1cc(c(cc1C(=O)N)F)F AS00797 [1,1,0,0,0,0|2,0,0]=4 509 B11R1.21 c1cc(c(cc1C(=O)O)Br)Br AS03516 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl AS00750 [1,1,0,0,0,0|2,0,0]=4 511 B11R1.21 c1cc(c(cc1C(=O)O)Br)F AS00969 [1,1,0,0,0,0|2,0,0]=4 512 B11R1.21 c1cc(c(cc1C(=O)O)Br)I AS03364 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.21 c1cc(c(cc1C(=O)O)Br)I AS04475 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.21 c1cc(c(cc1C(=O)O)Br)N AS00983 [1,1,0,0,0,0|2,0,0]=4 515 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Cl AS00789 [1,1,0,0,0,0|2,0,0]=4 516 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F AS00963 [1,1,0,0,0,0|2,0,0]=4 517 B11R1.21 c1cc(c(cc1C(=O)O)Cl)N AS00982 [1,1,0,0,0,0|2,0,0]=4 518 B11R1.21 c1cc(c(cc1C(=O)O)F)Br AS00972 [1,1,0,0,0,0|2,0,0]=4 519 B11R1.21 c1cc(c(cc1C(=O)O)F)Cl AS02731 [1,1,0,0,0,0|2,0,0]=4 520 B11R1.21 c1cc(c(cc1C(=O)O)F)F AS00851 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.21 c1cc(c(cc1C(=O)O)F)N AS00977 [1,1,0,0,0,0|2,0,0]=4 522 B11R1.21 c1cc(c(cc1C(=O)O)F)O AS01857 [1,1,0,0,0,0|1,0,0]=3 523 B11R1.21 c1cc(c(cc1C(=O)O)I)Br AS06467 [1,1,0,0,0,0|2,0,0]=4 524 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl AS06466 [1,1,0,0,0,0|2,0,0]=4 525 B11R1.21 c1cc(c(cc1C(=O)O)I)F AS02183 [1,1,0,0,0,0|2,0,0]=4 526 B11R1.21 c1cc(c(cc1C(=O)O)I)F AS06468 [1,1,0,0,0,0|2,0,0]=4 527 B11R1.21 c1cc(c(cc1C(=O)O)I)I AS06469 [1,1,0,0,0,0|2,0,0]=4 528 B11R1.21 c1cc(c(cc1C(=O)O)N)Br AS00868 [1,1,0,0,0,0|2,0,0]=4 529 B11R1.21 c1cc(c(cc1C(=O)O)N)Cl AS00844 [1,1,0,0,0,0|2,0,0]=4 530 B11R1.21 c1cc(c(cc1C(=O)O)N)F AS00976 [1,1,0,0,0,0|2,0,0]=4 531 B11R1.21 c1cc(c(cc1C(=O)O)N)N AS04450 [1,1,0,0,0,0|2,0,0]=4 532 B11R1.21 c1cc(c(cc1C(=O)O)N)O AS00843 [1,1,0,0,0,0|1,0,0]=3 533 B11R1.21 c1cc(c(cc1C(=O)O)O)Br AS06643 [1,1,0,0,0,0|1,0,0]=3 534 B11R1.21 c1cc(c(cc1C(=O)O)O)F AS01859 [1,1,0,0,0,0|1,0,0]=3 535 B11R1.21 c1cc(c(cc1C(=O)O)O)N AS00858 [1,1,0,0,0,0|1,0,0]=3 536 B11R1.21 c1cc(c(cc1C(=O)[O-])F)F AS00781 [1,1,0,0,0,0|2,0,0]=4 537 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Br)O AS00229 [1,1,0,0,0,0|2,0,0]=4 538 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Cl)O AS00165 [1,1,0,0,0,0|2,0,0]=4 539 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)O AS00186 [1,1,0,0,0,0|2,0,0]=4 540 B11R1.21 c1cc(c(cc1[N+](=O)[O-])O)F AS01401 [1,1,0,0,0,0|2,0,0]=4 541 B11R1.21 c1cc(c(cc1[N+](=O)[O-])O)F AS05978 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.21 c1cc(c(cc1[N+](=O)[O-])O)N AS07156 [1,1,0,0,0,0|2,0,0]=4 543 B11R1.192 Cc1cc(ccc1Cl)N=C=O AS06142 [1,1,0,0,0,0|1,0,1]=4 544 B11R1.278 c1cc(c(c(c1C=O)F)F)Br AS05532 [1,1,0,0,0,0|2,0,0]=4 545 B11R1.278 c1cc(c(c(c1C=O)F)F)F AS01487 [1,1,0,0,0,0|2,0,0]=4 546 B11R1.278 c1cc(c(c(c1C=O)F)F)I AS05586 [1,1,0,0,0,0|2,0,0]=4 547 B11R1.278 c1cc(c(c(c1C=O)F)F)O AS04607 [1,1,0,0,0,0|1,0,0]=3 548 B11R1.278 c1cc(c(c(c1C=O)F)O)F AS05584 [1,1,0,0,0,0|1,0,0]=3 549 B11R1.279 COc1ccc(c(c1)O)OC AS06540 [1,1,0,0,0,0|2,0,0]=4 550 B11R1.279 COc1ccc(cc1Br)C=O AS03008 [1,1,0,0,0,0|1,0,0]=3 551 B11R1.279 COc1ccc(cc1Cl)C=O AS03845 [1,1,0,0,0,0|1,0,0]=3 552 B11R1.279 COc1ccc(cc1Cl)C=O AS05559 [1,1,0,0,0,0|1,0,0]=3 553 B11R1.279 COc1ccc(cc1F)C=O AS03032 [1,1,0,0,0,0|1,0,0]=3 554 B11R1.279 COc1ccc(cc1I)C=O AS03921 [1,1,0,0,0,0|1,0,0]=3 555 B11R1.279 COc1ccc(cc1O)C#N AS02385 [1,1,0,0,0,0|1,0,1]=4 556 B11R1.279 Cc1cc(ccc1OC)C#N AS03767 [1,1,0,0,0,0|1,0,1]=4 557 B11R1.279 Cc1cc(ccc1OC)C=O AS02783 [1,1,0,0,0,0|0,0,0]=2 558 B11R1.279 Cc1cc(ccc1OC)OC AS02031 [1,1,0,0,0,0|2,0,0]=4 559 B13R1.13 CC(=O)c1cc(ccc1O)[N+](=O)[O-] AS05197 [0,2,0,0,0,0|2,0,0]=4 560 B13R1.13 CC(=O)c1ccc(c(c1)[N+](=O)[O-])O AS05199 [0,2,0,0,0,0|2,0,0]=4 561 B13R1.13 c1cc(c(cc1C(=O)O)[N+](=O)[O-])O AS00841 [0,2,0,0,0,0|2,0,0]=4 562 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O AS05276 [0,2,0,0,0,0|0,0,0]=2 563 B13R1.49 COc1cc(ccc1O)C(=O)OC AS07152 [0,2,0,0,0,0|0,0,0]=2 564 B13R1.49 Cc1ccc(cc1OC)C(=O)OC AS01335 [0,2,0,0,0,0|1,0,0]=3 565 B13R1.354 CCOc1cc(ccc1Br)C(=O)N AS03244 [0,2,0,0,0,0|1,0,0]=3 566 B13R1.354 CCOc1cc(ccc1Br)C(=O)O AS03245 [0,2,0,0,0,0|1,0,0]=3 567 B13R1.354 CCOc1cc(ccc1Br)[N+](=O)[O-] AS02402 [0,2,0,0,0,0|2,0,0]=4 568 B13R1.354 CCOc1cc(ccc1Cl)C(=O)N AS02709 [0,2,0,0,0,0|1,0,0]=3 569 B13R1.354 CCOc1cc(ccc1Cl)C(=O)O AS02710 [0,2,0,0,0,0|1,0,0]=3 570 B13R1.354 CCOc1cc(ccc1I)C(=O)C AS03875 [0,2,0,0,0,0|1,0,0]=3 571 B13R1.354 CCOc1cc(ccc1I)C(=O)N AS02560 [0,2,0,0,0,0|1,0,0]=3 572 B13R1.354 CCOc1cc(ccc1I)C(=O)O AS02561 [0,2,0,0,0,0|1,0,0]=3 573 B13R1.354 CCOc1cc(ccc1N)[N+](=O)[O-] AS02566 [0,2,0,0,0,0|2,0,0]=4 574 B13R1.651 CC(=O)c1cc(c(cc1N)F)OC AS05084 [0,2,0,0,0,0|1,0,0]=3 575 B13R1.651 COc1cc(c(cc1Cl)Cl)[N+](=O)[O-] AS05479 [0,2,0,0,0,0|2,0,0]=4 576 B13R1.651 COc1cc(c(cc1Cl)F)[N+](=O)[O-] AS04268 [0,2,0,0,0,0|2,0,0]=4 577 B13R1.651 COc1cc(c(cc1Cl)N)[N+](=O)[O-] AS07062 [0,2,0,0,0,0|2,0,0]=4 578 B13R1.651 COc1cc(c(cc1F)F)[N+](=O)[O-] AS05485 [0,2,0,0,0,0|2,0,0]=4 579 B13R1.651 COc1cc(c(cc1F)N)[N+](=O)[O-] AS05426 [0,2,0,0,0,0|2,0,0]=4 580 B13R1.3091 COc1cc(ccc1CN)C(=O)O AS07235 [0,2,0,0,0,0|1,0,0]=3 581 B13R1.3230 CC(=O)c1ccc(c(c1F)OC)F AS05170 [0,2,0,0,0,0|1,0,0]=3 582 B13R1.3230 COc1c(ccc(c1F)C(=O)O)F AS01848 [0,2,0,0,0,0|1,0,0]=3 583 B13R1.3230 COc1c(ccc(c1N)C(=O)O)O AS06330 [0,2,0,0,0,0|0,0,0]=2 584 B13R1.355 CCOc1cc(ccc1OC)C#N AS05845 [0,2,0,0,0,0|1,0,1]=4 585 B13R1.355 CCOc1cc(ccc1OC)C=O AS07035 [0,2,0,0,0,0|0,0,0]=2 586 B13R1.386 CCOc1ccc(c(c1)OC)OC AS02526 [0,2,0,0,0,0|1,0,1]=4 587 B13R1.1249 CCOc1ccc(cc1OC)C=O AS03876 [0,2,0,0,0,0|0,0,0]=2 588 B13R1.1249 CCOc1ccc(cc1OC)OC AS02527 [0,2,0,0,0,0|2,0,0]=4 589 B13R1.2200 COc1cc(c(cc1OC)F)C#N AS03730 [0,2,0,0,0,0|1,0,1]=4 590 B13R1.2200 COc1cc(c(cc1OC)F)C=O AS03907 [0,2,0,0,0,0|0,0,0]=2 591 B13R1.2200 COc1cc(c(cc1OC)N)C#N AS01600 [0,2,0,0,0,0|1,0,1]=4 592 B13R1.2422 COc1ccc(c(c1OC)Cl)C=O AS05550 [0,2,0,0,0,0|0,0,0]=2 593 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])C=O AS06922 [0,2,0,0,0,0|2,0,0]=4 594 B13R1.52 COc1cc(ccc1F)CC(=O)O AS02176 [0,2,0,0,0,0|1,0,0]=3 595 B13R1.52 COc1cc(ccc1F)CC(=O)O AS06107 [0,2,0,0,0,0|1,0,0]=3 596 B13R1.52 COc1cc(ccc1O)CC(=O)O AS06111 [0,2,0,0,0,0|0,0,0]=2 597 B13R1.98 CC(C)(C)c1cc(ccc1O)C=O AS06476 [0,2,0,0,0,0|1,0,0]=3 598 B11R2.36 Cc1ccc2c(c1)OCO2 AS01485 [1,0,0,1,0,0|0,0,1]=3 599 B11R2.36 c1cc2c(cc1Br)CCO2 AS06345 [1,0,0,1,0,0|2,0,0]=4 600 B11R2.36 c1cc2c(cc1Br)OCC2 AS06451 [1,0,0,1,0,0|2,0,0]=4 601 B11R2.36 c1cc2c(cc1Br)OCO2 AS00922 [1,0,0,1,0,0|1,0,0]=3 602 B11R2.36 c1cc2c(cc1Cl)OCO2 AS02681 [1,0,0,1,0,0|1,0,0]=3 603 B11R2.36 c1cc2c(cc1I)CCO2 AS06344 [1,0,0,1,0,0|2,0,0]=4 604 B11R2.36 c1cc2c(cc1I)OCO2 AS02215 [1,0,0,1,0,0|1,0,0]=3 605 B11R2.36 c1cc2c(cc1N)CCO2 AS06343 [1,0,0,1,0,0|2,0,0]=4 606 B11R2.36 c1cc2c(cc1N)OCO2 AS06260 [1,0,0,1,0,0|1,0,0]=3 607 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 AS03929 [0,1,0,1,0,0|0,0,0]=2 608 B13R2.430 c1cc(cc2c1cco2)C(=O)O AS06444 [0,1,0,1,0,0|1,0,1]=4 609 B13R2.430 c1cc2c(cc1C(=O)Cl)OCO2 AS00011 [0,1,0,1,0,0|0,0,0]=2 610 B13R2.430 c1cc2c(cc1[N+](=O)[O-])CCO2 AS06347 [0,1,0,1,0,0|2,0,0]=4 611 B13R2.430 c1cc2c(cco2)cc1C(=O)O AS06443 [0,1,0,1,0,0|1,0,1]=4 612 B11R1.265 COc1c(cccc1Cl)C=O AS05558 [0,0,0,0,1,1|1,0,0]=3 613 B11R1.265 COc1c(cccc1Cl)C=O AS06905 [0,0,0,0,1,1|1,0,0]=3 614 B11R1.265 COc1c(cccc1F)C=O AS01462 [0,0,0,0,1,1|1,0,0]=3 615 B11R1.265 COc1c(cccc1F)C=O AS04977 [0,0,0,0,1,1|1,0,0]=3 616 B11R1.265 COc1c(cccc1O)C#N AS06402 [0,0,0,0,1,1|1,0,1]=4 617 B11R1.265 COc1cccc(c1OC)O AS06583 [0,0,0,0,1,1|2,0,0]=4