0 B10R1.15 C=CC(=O)c1ccccc1 AS07048 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.15 CCC(=O)c1ccccc1 AS01141 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.15 CCC(C)c1ccccc1 AS05667 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.15 c1ccc(cc1)C(=NO)N AS06646 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.15 c1ccc(cc1)C(=O)C#N AS04664 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.15 c1ccc(cc1)C(=O)CBr AS01145 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.15 c1ccc(cc1)C(=O)CCl AS01163 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.15 c1ccc(cc1)C(=O)NN AS01560 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 c1cc(cnc1)C(=N)N AS06178 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.6 c1ccc(cc1)C(=O)Cl AS00010 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.6 c1ccc(cc1)C(=O)O AS04617 [1,0,0,0,0,0|1,0,0]=2 11 B9R1.6 c1ccc(cc1)C(=O)[O-] AS01250 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.6 c1ccc(cc1)[N+](=O)[O-] AS01461 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.8 c1ccc(cc1)CON AS04494 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.16 CCOC(=O)c1ccccn1 AS01278 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.16 c1ccc(cc1)C(=O)CCN AS05234 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.16 c1ccc(cc1)C(=O)N=C=O AS04369 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.16 c1ccc(cc1)C(=O)N=C=S AS00355 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.22 CCC(=O)c1ccc(cc1)Br AS03828 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.22 CCC(=O)c1ccc(cc1)Cl AS03849 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.22 CCC(=O)c1ccc(cc1)F AS03904 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.22 COC(=O)c1ccc(cc1)Br AS03617 [0,1,0,0,0,0|1,0,0]=2 22 B11R1.22 COC(=O)c1ccc(cc1)Cl AS02923 [0,1,0,0,0,0|1,0,0]=2 23 B11R1.22 COC(=O)c1ccc(cc1)F AS01318 [0,1,0,0,0,0|1,0,0]=2 24 B11R1.22 COC(=O)c1ccc(cc1)I AS02318 [0,1,0,0,0,0|1,0,0]=2 25 B11R1.22 COC(=O)c1ccc(cc1)O AS01626 [0,1,0,0,0,0|1,0,0]=2 26 B11R1.22 Cc1ccc(cc1)C(=O)CN AS05091 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.22 Cc1ccc(cc1)C(=O)OC AS01339 [0,1,0,0,0,0|1,0,0]=2 28 B11R1.22 c1cc(ccc1C(=O)CBr)Br AS05097 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.22 c1cc(ccc1C(=O)CBr)Cl AS01180 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.22 c1cc(ccc1C(=O)CBr)I AS05120 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.22 c1cc(ccc1C(=O)CBr)N AS05064 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS04020 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS05102 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.22 c1cc(ccc1C(=O)CCl)Cl AS05154 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.22 c1cc(ccc1C(=O)CCl)O AS05143 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.22 c1cc(ccc1C(=O)CN)Br AS05065 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.22 c1cc(ccc1C(=O)CN)Cl AS05073 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.22 c1cc(ccc1C(=O)CN)F AS05082 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.22 c1cc(ccc1C(=O)NN)Br AS00928 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.22 c1cc(ccc1C(=O)NN)Cl AS02684 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.22 c1cc(ccc1C(=O)NN)F AS00306 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.22 c1cc(ccc1C(=O)NN)I AS02957 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.22 c1cc(ccc1C(=O)NN)O AS00896 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.23 CCC(=O)c1cccc(c1)Br AS03827 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.23 CCC(=O)c1cccc(c1)C AS07217 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.23 CCC(=O)c1cccc(c1)N AS05233 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.23 CCC(=O)c1cccc(c1)O AS05242 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.23 CNC(=O)c1cccc(c1)N AS06601 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.23 COC(=O)c1cc(ccn1)Br AS04714 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.23 COC(=O)c1cccc(c1)Br AS03616 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.23 COC(=O)c1cccc(c1)I AS02317 [0,1,0,0,0,0|1,0,0]=2 52 B11R1.23 COC(=O)c1ccnc(c1)Br AS04445 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.23 Cc1cccc(c1)C(=O)OC AS02466 [0,1,0,0,0,0|1,0,0]=2 54 B11R1.23 c1cc(cc(c1)Br)C(=O)CBr AS05096 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.23 c1cc(cc(c1)Br)C(=O)NN AS00927 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.23 c1cc(cc(c1)Cl)C(=O)CBr AS05100 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.23 c1cc(cc(c1)Cl)C(=O)CCl AS05153 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.23 c1cc(cc(c1)Cl)C(=O)NN AS02683 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.23 c1cc(cc(c1)Cl)C(=O)OO AS04620 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.23 c1cc(cc(c1)F)C(=O)CCl AS04006 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.23 c1cc(cc(c1)F)C(=O)NN AS02956 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.23 c1cc(cc(c1)O)C(=O)CBr AS05116 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.23 c1cc(cc(c1)O)C(=O)CCl AS05142 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.23 c1cc(cc(c1)O)C(=O)NN AS00901 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.36 c1ccc(cc1)C(=O)C(F)F AS05165 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.222 CCC(=O)c1ccccc1Cl AS06723 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.222 COC(=O)c1ccccc1Br AS03615 [0,1,0,0,0,0|1,0,0]=2 68 B11R1.222 COC(=O)c1ccccc1Cl AS00094 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.222 COC(=O)c1ccccc1F AS01317 [0,1,0,0,0,0|1,0,0]=2 70 B11R1.222 COC(=O)c1ccccc1I AS02316 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.222 COC(=O)c1ccccc1N AS01236 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl AS05099 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.222 c1ccc(c(c1)C(=O)CBr)F AS05110 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.222 c1ccc(c(c1)C(=O)CN)Br AS05062 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.222 c1ccc(c(c1)C(=O)CN)Cl AS05070 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.222 c1ccc(c(c1)C(=O)CN)F AS05081 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.222 c1ccc(c(c1)C(=O)NN)Br AS00926 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.222 c1ccc(c(c1)C(=O)NN)Cl AS02682 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.222 c1ccc(c(c1)C(=O)NN)F AS02953 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.222 c1ccc(c(c1)C(=O)NN)O AS00900 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.11 COC(=O)c1c[nH]nc1 AS07234 [0,0,0,0,1,0|1,0,0]=2 82 B11R1.40 c1ccc(cc1)NC(=O)CBr AS00910 [0,0,0,0,0,1|3,0,0]=4 83 B11R1.40 c1ccc(cc1)NC(=O)CCl AS02673 [0,0,0,0,0,1|3,0,0]=4 84 B11R1.40 c1ccc(cc1)NC(=O)CF AS00823 [0,0,0,0,0,1|3,0,0]=4 85 B8R1.2 COc1ccccc1 AS04310 [2,0,0,0,0,0|1,0,0]=3 86 B8R1.2 COc1ccccc1 AS06877 [2,0,0,0,0,0|1,0,0]=3 87 B8R1.2 COc1ccccn1 AS01009 [2,0,0,0,0,0|2,0,0]=4 88 B8R1.2 COc1cccnc1 AS01010 [2,0,0,0,0,0|0,0,0]=2 89 B8R1.2 COc1ccncc1 AS04953 [2,0,0,0,0,0|2,0,0]=4 90 B8R1.2 CSc1ccccc1 AS04279 [2,0,0,0,0,0|1,1,0]=4 91 B8R1.2 c1ccc(cc1)CO AS04466 [2,0,0,0,0,0|1,0,1]=4 92 B8R1.2 c1ccc(cc1)N=O AS01444 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.13 CC(=C)c1ccc(cc1)O AS06541 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.13 CC(=O)c1ccc(cc1)Br AS01178 [1,1,0,0,0,0|1,0,0]=3 95 B10R1.13 CC(=O)c1ccc(cc1)Cl AS05257 [1,1,0,0,0,0|1,0,0]=3 96 B10R1.13 CC(=O)c1ccc(cc1)F AS01160 [1,1,0,0,0,0|1,0,0]=3 97 B10R1.13 CC(=O)c1ccc(cc1)I AS04012 [1,1,0,0,0,0|1,0,0]=3 98 B10R1.13 CC(=O)c1ccc(cc1)N AS01150 [1,1,0,0,0,0|1,0,0]=3 99 B10R1.13 CC(=O)c1ccc(cc1)O AS01158 [1,1,0,0,0,0|1,0,0]=3 100 B10R1.13 CC(=O)c1ccc(nc1)Cl AS05261 [1,1,0,0,0,0|0,0,0]=2 101 B10R1.13 CC(=O)c1ccc(nc1)O AS04944 [1,1,0,0,0,0|0,0,0]=2 102 B10R1.13 Cc1ccc(cc1)C(=O)C AS01165 [1,1,0,0,0,0|1,0,0]=3 103 B10R1.13 Cc1ccc(cc1)C(=O)Cl AS00020 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.13 Cc1ccc(cc1)C(=O)N AS05901 [1,1,0,0,0,0|2,0,0]=4 105 B10R1.13 Cc1ccc(cc1)C(=O)O AS00864 [1,1,0,0,0,0|1,0,0]=3 106 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] AS04952 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.13 c1cc(ccc1C(=O)Cl)I AS00009 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.13 c1cc(ccc1C(=O)N)Br AS00920 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.13 c1cc(ccc1C(=O)N)Cl AS02680 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.13 c1cc(ccc1C(=O)N)F AS00831 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.13 c1cc(ccc1C(=O)O)Br AS00815 [1,1,0,0,0,0|1,0,0]=3 112 B10R1.13 c1cc(ccc1C(=O)O)Cl AS00806 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.13 c1cc(ccc1C(=O)O)F AS00747 [1,1,0,0,0,0|1,0,0]=3 114 B10R1.13 c1cc(ccc1C(=O)O)I AS02218 [1,1,0,0,0,0|1,0,0]=3 115 B10R1.13 c1cc(ccc1C(=O)O)N AS00762 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.13 c1cc(ccc1C(=O)[O-])F AS00778 [1,1,0,0,0,0|1,0,1]=4 117 B10R1.13 c1cc(ncc1C(=O)O)F AS04828 [1,1,0,0,0,0|0,0,0]=2 118 B10R1.13 c1cc(ncc1Cl)C(=O)O AS04938 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.13 c1cc(ncc1F)C(=O)O AS04870 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.13 c1cc(ncc1[N+](=O)[O-])Br AS04909 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.13 c1cc(ncc1[N+](=O)[O-])Cl AS06187 [1,1,0,0,0,0|1,0,1]=4 122 B10R1.13 c1cc(ncc1[N+](=O)[O-])F AS04845 [1,1,0,0,0,0|1,0,1]=4 123 B10R1.61 CC(=O)c1c(cccn1)F AS04769 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.61 CC(=O)c1ccccc1Br AS01164 [1,1,0,0,0,0|1,0,0]=3 125 B10R1.61 CC(=O)c1ccccc1Cl AS01142 [1,1,0,0,0,0|1,0,0]=3 126 B10R1.61 CC(=O)c1ccccc1F AS01129 [1,1,0,0,0,0|1,0,0]=3 127 B10R1.61 CC(=O)c1ccccc1I AS03911 [1,1,0,0,0,0|1,0,0]=3 128 B10R1.61 CC(=O)c1ccccc1O AS01159 [1,1,0,0,0,0|1,0,0]=3 129 B10R1.61 c1cc(c(nc1)F)C(=O)O AS04848 [1,1,0,0,0,0|0,0,0]=2 130 B10R1.61 c1cc(c(nc1)F)[N+](=O)[O-] AS04843 [1,1,0,0,0,0|1,0,1]=4 131 B10R1.61 c1ccc(c(c1)C(=O)Cl)I AS00019 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.61 c1ccc(c(c1)C(=O)N)Br AS00918 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.61 c1ccc(c(c1)C(=O)N)Cl AS02678 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.61 c1ccc(c(c1)C(=O)N)F AS00829 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.61 c1ccc(c(c1)C(=O)N)I AS02212 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.61 c1ccc(c(c1)C(=O)O)Br AS00760 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.61 c1ccc(c(c1)C(=O)O)Cl AS00802 [1,1,0,0,0,0|1,0,0]=3 138 B10R1.61 c1ccc(c(c1)C(=O)O)F AS00814 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.61 c1ccc(c(c1)C(=O)O)I AS02216 [1,1,0,0,0,0|1,0,0]=3 140 B10R1.61 c1ccc(c(c1)C(=O)[O-])F AS00773 [1,1,0,0,0,0|1,0,1]=4 141 B10R1.61 c1cncc(c1N)[N+](=O)[O-] AS04897 [1,1,0,0,0,0|1,0,1]=4 142 B10R1.113 CC(=O)c1cccc(c1)Br AS01168 [1,1,0,0,0,0|1,0,0]=3 143 B10R1.113 CC(=O)c1cccc(c1)Cl AS03831 [1,1,0,0,0,0|1,0,0]=3 144 B10R1.113 CC(=O)c1cccc(c1)F AS01151 [1,1,0,0,0,0|1,0,0]=3 145 B10R1.113 CC(=O)c1cccc(c1)I AS04040 [1,1,0,0,0,0|1,0,0]=3 146 B10R1.113 CC(=O)c1cccc(c1)O AS01139 [1,1,0,0,0,0|1,0,0]=3 147 B10R1.113 Cc1cccc(c1)C(=O)C AS04042 [1,1,0,0,0,0|1,0,0]=3 148 B10R1.113 Cc1cccc(c1)C(=O)Cl AS01364 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.113 Cc1cccc(c1)C(=O)O AS00863 [1,1,0,0,0,0|1,0,0]=3 150 B10R1.113 c1c(cncc1F)C(=O)O AS04871 [1,1,0,0,0,0|0,0,0]=2 151 B10R1.113 c1cc(cc(c1)Br)C(=O)Cl AS00012 [1,1,0,0,0,0|2,0,0]=4 152 B10R1.113 c1cc(cc(c1)Br)C(=O)N AS00919 [1,1,0,0,0,0|2,0,0]=4 153 B10R1.113 c1cc(cc(c1)Br)C(=O)O AS01127 [1,1,0,0,0,0|1,0,0]=3 154 B10R1.113 c1cc(cc(c1)Cl)C(=O)Cl AS00014 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.113 c1cc(cc(c1)Cl)C(=O)N AS02679 [1,1,0,0,0,0|2,0,0]=4 156 B10R1.113 c1cc(cc(c1)Cl)C(=O)O AS00810 [1,1,0,0,0,0|1,0,0]=3 157 B10R1.113 c1cc(cc(c1)F)C(=O)N AS00830 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.113 c1cc(cc(c1)F)C(=O)O AS00742 [1,1,0,0,0,0|1,0,0]=3 159 B10R1.113 c1cc(cc(c1)F)C(=O)O AS01279 [1,1,0,0,0,0|1,0,0]=3 160 B10R1.113 c1cc(cc(c1)F)C(=O)[O-] AS00777 [1,1,0,0,0,0|1,0,1]=4 161 B10R1.113 c1cc(cc(c1)I)C(=O)Cl AS00024 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.113 c1cc(cc(c1)I)C(=O)N AS02213 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.113 c1cc(cc(c1)I)C(=O)O AS02217 [1,1,0,0,0,0|1,0,0]=3 164 B10R1.113 c1cc(cc(c1)N)C(=O)N AS05882 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.113 c1cc(cc(c1)N)C(=O)O AS00862 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.113 c1cc(nc(c1)Cl)C(=O)O AS04933 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.113 c1cc(nc(c1)F)C(=O)O AS04829 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.113 c1cnc(cc1C(=O)O)F AS04827 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.4 COCc1ccccc1Br AS03400 [1,1,0,0,0,0|1,0,1]=4 170 B10R1.4 COCc1ccccc1Br AS03402 [1,1,0,0,0,0|1,0,1]=4 171 B10R1.10 COCc1cccc(c1)Br AS03401 [1,1,0,0,0,0|1,0,1]=4 172 B10R1.14 COC(=O)c1cc(sc1)Br AS06561 [0,1,0,0,1,0|1,0,0]=3 173 B12R1.49 COC(=O)Cc1ccc(cc1)O AS06110 [0,1,0,0,0,1|1,0,0]=3 174 B12R1.50 COC(=O)Cc1cccc(c1)F AS06105 [0,1,0,0,0,1|1,0,0]=3 175 B12R1.50 COC(=O)Cc1cccc(c1)N AS04587 [0,1,0,0,0,1|1,0,0]=3 176 B12R1.50 COC(=O)Cc1cccc(c1)N AS06071 [0,1,0,0,0,1|1,0,0]=3 177 B12R1.478 COC(c1ccccc1)C(=O)O AS04652 [0,2,0,0,0,0|1,0,1]=4 178 B12R1.16 CCOC(=O)c1ccc(cc1)Br AS03590 [0,2,0,0,0,0|1,0,0]=3 179 B12R1.16 CCOC(=O)c1ccc(cc1)C AS01277 [0,2,0,0,0,0|1,0,0]=3 180 B12R1.16 CCOC(=O)c1ccc(cc1)Cl AS02902 [0,2,0,0,0,0|1,0,0]=3 181 B12R1.16 CCOC(=O)c1ccc(cc1)F AS01264 [0,2,0,0,0,0|1,0,0]=3 182 B12R1.16 CCOC(=O)c1ccc(cc1)I AS02162 [0,2,0,0,0,0|1,0,0]=3 183 B12R1.16 CCOC(=O)c1ccc(cc1)N AS04671 [0,2,0,0,0,0|1,0,0]=3 184 B12R1.16 c1cc(ccc1C(=O)CCCl)Cl AS03867 [0,2,0,0,0,0|2,0,0]=4 185 B12R1.17 CCOC(=O)c1cccc(c1)Br AS03589 [0,2,0,0,0,0|1,0,0]=3 186 B12R1.17 CCOC(=O)c1cccc(c1)Cl AS02901 [0,2,0,0,0,0|1,0,0]=3 187 B12R1.17 CCOC(=O)c1cccc(c1)F AS01263 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.17 CCOC(=O)c1cccc(c1)I AS02161 [0,2,0,0,0,0|1,0,0]=3 189 B12R1.17 CCOC(=O)c1cccc(c1)N AS02925 [0,2,0,0,0,0|1,0,0]=3 190 B12R1.308 CCOC(=O)c1ccccc1Br AS03588 [0,2,0,0,0,0|1,0,0]=3 191 B12R1.308 CCOC(=O)c1ccccc1Cl AS02900 [0,2,0,0,0,0|1,0,0]=3 192 B12R1.308 CCOC(=O)c1ccccc1F AS01262 [0,2,0,0,0,0|1,0,0]=3 193 B12R1.308 CCOC(=O)c1ccccc1I AS02160 [0,2,0,0,0,0|1,0,0]=3 194 B12R1.5 CCc1ccc(cc1)C(=O)CC AS05277 [0,2,0,0,0,0|2,0,0]=4 195 B12R1.5 COC(=O)c1ccc(cc1)C=O AS06270 [0,2,0,0,0,0|1,0,0]=3 196 B12R1.5 COC(=O)c1ccc(cc1)CBr AS02422 [0,2,0,0,0,0|1,0,0]=3 197 B12R1.5 COc1ccc(cc1)C(=O)OC AS02499 [0,2,0,0,0,0|1,0,0]=3 198 B12R1.20 CN(C)C(=O)c1ccc(cc1)I AS01595 [0,2,0,0,0,0|2,0,0]=4 199 B12R1.367 CCC(=O)c1ccc(c(c1)Br)F AS03812 [0,2,0,0,0,0|2,0,0]=4 200 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)F AS03838 [0,2,0,0,0,0|2,0,0]=4 201 B12R1.367 COC(=O)c1ccc(c(c1)Br)F AS03630 [0,2,0,0,0,0|1,0,0]=3 202 B12R1.367 COC(=O)c1ccc(c(c1)Br)I AS03634 [0,2,0,0,0,0|1,0,0]=3 203 B12R1.367 COC(=O)c1ccc(c(c1)Br)N AS03611 [0,2,0,0,0,0|1,0,0]=3 204 B12R1.367 COC(=O)c1ccc(c(c1)Br)O AS03657 [0,2,0,0,0,0|1,0,0]=3 205 B12R1.367 COC(=O)c1ccc(c(c1)F)Br AS02424 [0,2,0,0,0,0|1,0,0]=3 206 B12R1.367 COC(=O)c1ccc(c(c1)F)F AS01307 [0,2,0,0,0,0|1,0,0]=3 207 B12R1.367 COC(=O)c1ccc(c(c1)F)F AS02426 [0,2,0,0,0,0|1,0,0]=3 208 B12R1.367 COC(=O)c1ccc(c(c1)I)F AS00128 [0,2,0,0,0,0|1,0,0]=3 209 B12R1.367 COC(=O)c1ccc(c(c1)I)F AS01246 [0,2,0,0,0,0|1,0,0]=3 210 B12R1.367 COC(=O)c1ccc(c(c1)I)O AS06352 [0,2,0,0,0,0|1,0,0]=3 211 B12R1.367 COC(=O)c1ccc(c(c1)N)N AS01842 [0,2,0,0,0,0|1,0,0]=3 212 B12R1.367 COC(=O)c1ccc(c(c1)N)O AS01300 [0,2,0,0,0,0|1,0,0]=3 213 B12R1.367 COC(=O)c1ccc(c(c1)O)F AS01321 [0,2,0,0,0,0|1,0,0]=3 214 B12R1.367 Cc1cc(ccc1Br)C(=O)OC AS02423 [0,2,0,0,0,0|1,0,0]=3 215 B12R1.367 Cc1cc(ccc1Cl)C(=O)OC AS00095 [0,2,0,0,0,0|1,0,0]=3 216 B12R1.367 Cc1cc(ccc1I)C(=O)OC AS02325 [0,2,0,0,0,0|1,0,0]=3 217 B12R1.367 Cc1ccc(cc1Br)C(=O)OC AS03641 [0,2,0,0,0,0|1,0,0]=3 218 B12R1.367 Cc1ccc(cc1Cl)C(=O)OC AS00791 [0,2,0,0,0,0|1,0,0]=3 219 B12R1.367 Cc1ccc(cc1I)C(=O)OC AS01247 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl AS03866 [0,2,0,0,0,0|2,0,0]=4 221 B12R1.1703 CCC(=O)c1ccc(cc1F)Br AS06510 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.1703 CCC(=O)c1ccc(cc1F)F AS03870 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.1703 CCC(=O)c1ccc(cc1O)O AS07000 [0,2,0,0,0,0|2,0,0]=4 224 B12R1.1703 CNC(=O)c1ccc(cc1Br)F AS02440 [0,2,0,0,0,0|2,0,0]=4 225 B12R1.1703 CNC(=O)c1ccc(cc1F)Br AS05903 [0,2,0,0,0,0|2,0,0]=4 226 B12R1.1703 CNC(=O)c1ccc(cc1F)I AS04599 [0,2,0,0,0,0|2,0,0]=4 227 B12R1.1703 COC(=O)c1ccc(cc1Cl)Cl AS02939 [0,2,0,0,0,0|1,0,0]=3 228 B12R1.1703 COC(=O)c1ccc(cc1Cl)N AS01770 [0,2,0,0,0,0|1,0,0]=3 229 B12R1.1703 COC(=O)c1ccc(cc1F)F AS01306 [0,2,0,0,0,0|1,0,0]=3 230 B12R1.1703 COC(=O)c1ccc(cc1F)O AS01245 [0,2,0,0,0,0|1,0,0]=3 231 B12R1.1703 COC(=O)c1ccc(cc1I)Cl AS02930 [0,2,0,0,0,0|1,0,0]=3 232 B12R1.1703 COC(=O)c1ccc(cc1N)Br AS01768 [0,2,0,0,0,0|1,0,0]=3 233 B12R1.1703 COC(=O)c1ccc(cc1O)Br AS03632 [0,2,0,0,0,0|1,0,0]=3 234 B12R1.1703 COC(=O)c1ccc(cc1O)F AS01320 [0,2,0,0,0,0|1,0,0]=3 235 B12R1.1703 COC(=O)c1ccc(cc1O)I AS02314 [0,2,0,0,0,0|1,0,0]=3 236 B12R1.1703 Cc1cc(ccc1C(=O)OC)F AS00096 [0,2,0,0,0,0|1,0,0]=3 237 B12R1.1703 Cc1cc(ccc1C(=O)OC)N AS04604 [0,2,0,0,0,0|1,0,0]=3 238 B12R1.24 COC(=O)c1cccc(c1F)Br AS00091 [0,2,0,0,0,0|1,0,0]=3 239 B12R1.24 COC(=O)c1cccc(c1F)N AS07006 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.24 COC(=O)c1cccc(c1N)F AS01243 [0,2,0,0,0,0|1,0,0]=3 241 B12R1.24 COC(=O)c1cccc(c1N)N AS01841 [0,2,0,0,0,0|1,0,0]=3 242 B12R1.24 COC(=O)c1cccc(c1O)O AS01308 [0,2,0,0,0,0|1,0,0]=3 243 B12R1.24 COC(=O)c1ccnc(c1F)Cl AS04809 [0,2,0,0,0,0|2,0,0]=4 244 B12R1.24 Cc1c(cccc1Br)C(=O)OC AS00093 [0,2,0,0,0,0|1,0,0]=3 245 B12R1.24 Cc1c(cccc1Cl)C(=O)OC AS02936 [0,2,0,0,0,0|1,0,0]=3 246 B12R1.24 Cc1c(cccc1I)C(=O)OC AS02324 [0,2,0,0,0,0|1,0,0]=3 247 B12R1.24 Cc1c(cccc1N)C(=O)OC AS00248 [0,2,0,0,0,0|1,0,0]=3 248 B12R1.24 Cc1cccc(c1Br)C(=O)OC AS03639 [0,2,0,0,0,0|1,0,0]=3 249 B12R1.24 Cc1cccc(c1C)C(=O)OC AS01241 [0,2,0,0,0,0|1,0,0]=3 250 B12R1.24 Cc1cccc(c1Cl)C(=O)OC AS02934 [0,2,0,0,0,0|1,0,0]=3 251 B12R1.24 Cc1cccc(c1I)C(=O)OC AS02322 [0,2,0,0,0,0|1,0,0]=3 252 B12R1.24 Cc1cccc(c1N)C(=O)OC AS04608 [0,2,0,0,0,0|1,0,0]=3 253 B12R1.354 COC(=O)c1cc(ccc1Br)Br AS03645 [0,2,0,0,0,0|1,0,0]=3 254 B12R1.354 COC(=O)c1cc(ccc1Br)Cl AS03618 [0,2,0,0,0,0|1,0,0]=3 255 B12R1.354 COC(=O)c1cc(ccc1Br)F AS03629 [0,2,0,0,0,0|1,0,0]=3 256 B12R1.354 COC(=O)c1cc(ccc1Br)I AS03633 [0,2,0,0,0,0|1,0,0]=3 257 B12R1.354 COC(=O)c1cc(ccc1Br)N AS03683 [0,2,0,0,0,0|1,0,0]=3 258 B12R1.354 COC(=O)c1cc(ccc1Cl)Br AS03621 [0,2,0,0,0,0|1,0,0]=3 259 B12R1.354 COC(=O)c1cc(ccc1Cl)Cl AS02940 [0,2,0,0,0,0|1,0,0]=3 260 B12R1.354 COC(=O)c1cc(ccc1Cl)I AS02928 [0,2,0,0,0,0|1,0,0]=3 261 B12R1.354 COC(=O)c1cc(ccc1I)Br AS01244 [0,2,0,0,0,0|1,0,0]=3 262 B12R1.354 COC(=O)c1cc(ccc1I)Cl AS02931 [0,2,0,0,0,0|1,0,0]=3 263 B12R1.354 COC(=O)c1cc(ccc1N)Br AS03610 [0,2,0,0,0,0|1,0,0]=3 264 B12R1.354 COC(=O)c1cc(ccc1N)Cl AS02913 [0,2,0,0,0,0|1,0,0]=3 265 B12R1.354 COC(=O)c1cc(ccc1N)F AS01625 [0,2,0,0,0,0|1,0,0]=3 266 B12R1.354 COC(=O)c1cc(ccc1N)I AS02298 [0,2,0,0,0,0|1,0,0]=3 267 B12R1.354 COC(=O)c1cc(ccc1O)Br AS03674 [0,2,0,0,0,0|1,0,0]=3 268 B12R1.354 COC(=O)c1cc(ccc1O)Cl AS02955 [0,2,0,0,0,0|1,0,0]=3 269 B12R1.354 COC(=O)c1cc(ccc1O)F AS00902 [0,2,0,0,0,0|1,0,0]=3 270 B12R1.354 COC(=O)c1cc(ccc1O)I AS02315 [0,2,0,0,0,0|1,0,0]=3 271 B12R1.354 COC(=O)c1cc(ccc1O)O AS01309 [0,2,0,0,0,0|1,0,0]=3 272 B12R1.354 Cc1ccc(c(c1)C(=O)OC)Br AS03640 [0,2,0,0,0,0|1,0,0]=3 273 B12R1.354 Cc1ccc(c(c1)C(=O)OC)Cl AS02935 [0,2,0,0,0,0|1,0,0]=3 274 B12R1.354 Cc1ccc(c(c1)C(=O)OC)I AS02323 [0,2,0,0,0,0|1,0,0]=3 275 B12R1.354 Cc1ccc(cc1C(=O)OC)Br AS04501 [0,2,0,0,0,0|1,0,0]=3 276 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)Cl AS05238 [0,2,0,0,0,0|2,0,0]=4 277 B12R1.358 CCC(=O)c1cc(cc(c1)F)F AS05239 [0,2,0,0,0,0|2,0,0]=4 278 B12R1.358 COC(=O)c1cc(cc(c1)Br)Br AS03646 [0,2,0,0,0,0|1,0,0]=3 279 B12R1.358 COC(=O)c1cc(cc(c1)Br)Cl AS03620 [0,2,0,0,0,0|1,0,0]=3 280 B12R1.358 COC(=O)c1cc(cc(c1)Br)F AS03631 [0,2,0,0,0,0|1,0,0]=3 281 B12R1.358 COC(=O)c1cc(cc(c1)Cl)Cl AS02941 [0,2,0,0,0,0|1,0,0]=3 282 B12R1.358 COC(=O)c1cc(cc(c1)I)Br AS03635 [0,2,0,0,0,0|1,0,0]=3 283 B12R1.358 COC(=O)c1cc(cc(c1)I)Cl AS02929 [0,2,0,0,0,0|1,0,0]=3 284 B12R1.358 COC(=O)c1cc(cc(c1)I)I AS02312 [0,2,0,0,0,0|1,0,0]=3 285 B12R1.435 COC(=O)c1cccc(c1)C#N AS02421 [0,2,0,0,0,0|1,0,0]=3 286 B12R1.435 COC(=O)c1cccc(c1)CBr AS01238 [0,2,0,0,0,0|1,0,0]=3 287 B12R1.435 COC(=O)c1cccc(c1)SCl AS06136 [0,2,0,0,0,0|1,0,0]=3 288 B12R1.435 COC(=O)c1cccc(n1)CO AS06191 [0,2,0,0,0,0|2,0,0]=4 289 B12R1.77 COC(=O)c1ccccc1CBr AS00092 [0,2,0,0,0,0|1,0,0]=3 290 B12R1.3441 COC(=O)c1c(cccc1Br)Cl AS03619 [0,2,0,0,0,0|1,0,0]=3 291 B12R1.3441 COC(=O)c1c(cccc1Cl)N AS04677 [0,2,0,0,0,0|1,0,0]=3 292 B12R1.3441 COC(=O)c1c(ccnc1F)I AS04858 [0,2,0,0,0,0|0,0,0]=2 293 B10R2.7 c1cc2cc[nH]c2nc1 AS07114 [1,0,0,1,0,0|2,0,0]=4 294 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 AS06210 [0,1,0,1,0,0|2,0,0]=4 295 B12R2.2028 c1ccc2c(c1)C(=O)OI2O AS06644 [0,1,0,1,0,0|2,0,0]=4 296 B12R2.612 c1cc2c(cc1Br)COC2=O AS07099 [0,1,0,1,0,0|1,0,0]=3 297 B12R2.612 c1cc2c(cc1Cl)CCC2=O AS04658 [0,1,0,1,0,0|2,0,0]=4 298 B8R1.7 c1nc([nH]n1)C(=O)O AS00569 [1,0,0,0,1,0|2,0,0]=4 299 B12R1.27 COC(=O)CCc1ccccc1 AS06125 [0,0,0,0,0,2|1,0,0]=3