0 B11R1.40 c1ccc(cc1)NC(=O)CBr AS00910 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.40 c1ccc(cc1)NC(=O)CCl AS02673 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.40 c1ccc(cc1)NC(=O)CF AS00823 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.17 CCCOc1ccccc1 AS01111 [1,0,0,0,0,0|2,0,1]=4 4 B10R1.17 c1ccc(cc1)CCCBr AS03468 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.17 c1ccc(cc1)CN=C=S AS04379 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.18 CC(Cc1ccccc1)O AS07220 [1,0,0,0,0,0|0,0,2]=3 7 B10R1.18 c1ccc(cc1)OC(=O)Cl AS01233 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.49 COC(=O)Cc1ccc(cc1)O AS06110 [0,1,0,0,0,0|0,0,0]=1 9 B12R1.50 COC(=O)Cc1cccc(c1)F AS06105 [0,1,0,0,0,0|0,0,0]=1 10 B12R1.50 COC(=O)Cc1cccc(c1)N AS04587 [0,1,0,0,0,0|0,0,0]=1 11 B12R1.50 COC(=O)Cc1cccc(c1)N AS06071 [0,1,0,0,0,0|0,0,0]=1 12 B10R1.15 C=CC(=O)c1ccccc1 AS07048 [0,0,0,0,1,0|1,0,1]=3 13 B10R1.15 CCC(=O)c1ccccc1 AS01141 [0,0,0,0,1,0|1,0,0]=2 14 B10R1.15 CCC(C)c1ccccc1 AS05667 [0,0,0,0,1,0|2,0,1]=4 15 B10R1.15 c1ccc(cc1)C(=NO)N AS06646 [0,0,0,0,1,0|3,0,0]=4 16 B10R1.15 c1ccc(cc1)C(=O)C#N AS04664 [0,0,0,0,1,0|2,0,0]=3 17 B10R1.15 c1ccc(cc1)C(=O)CBr AS01145 [0,0,0,0,1,0|2,0,0]=3 18 B10R1.15 c1ccc(cc1)C(=O)CCl AS01163 [0,0,0,0,1,0|2,0,0]=3 19 B10R1.15 c1ccc(cc1)C(=O)NN AS01560 [0,0,0,0,1,0|2,0,0]=3 20 B12R1.27 COC(=O)CCc1ccccc1 AS06125 [0,0,0,0,0,1|0,0,0]=1 21 B9R1.8 c1ccc(cc1)CC#N AS01366 [2,0,0,0,0,0|1,0,1]=4 22 B9R1.8 c1ccc(cc1)CCCl AS00650 [2,0,0,0,0,0|1,0,1]=4 23 B9R1.8 c1ccc(cc1)CCN AS00484 [2,0,0,0,0,0|1,0,1]=4 24 B9R1.8 c1ccc(cc1)CCO AS00558 [2,0,0,0,0,0|0,0,1]=3 25 B9R1.8 c1ccc(cc1)CON AS04494 [2,0,0,0,0,0|1,0,0]=3 26 B9R1.8 c1ccc(cc1)N=C=O AS04076 [2,0,0,0,0,0|1,0,1]=4 27 B11R1.1 CCCCc1ccc(cc1)Cl AS02834 [1,1,0,0,0,0|1,0,1]=4 28 B11R1.1 CCCCc1ccc(cc1)I AS02288 [1,1,0,0,0,0|1,0,1]=4 29 B11R1.1 CCCCc1ccc(cc1)I AS02333 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.1 COCCc1ccc(cc1)O AS00207 [1,1,0,0,0,0|0,0,1]=3 31 B11R1.28 CCCCOc1ccccc1 AS01104 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.91 CC(=O)OCc1ccccc1 AS01460 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.20 CC(=O)Cc1ccc(cc1)F AS05241 [1,1,0,0,0,0|0,0,0]=2 34 B11R1.20 CC(=O)Nc1ccc(cc1)Br AS00912 [1,1,0,0,0,0|1,0,0]=3 35 B11R1.20 CC(=O)Nc1ccc(cc1)Cl AS02675 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.20 CC(=O)Nc1ccc(cc1)F AS00825 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.20 CC(=O)Nc1ccc(cc1)I AS02201 [1,1,0,0,0,0|1,0,0]=3 38 B11R1.20 CC(=O)Oc1ccc(cc1)Cl AS07036 [1,1,0,0,0,0|1,0,0]=3 39 B11R1.20 CC(=O)Oc1ccc(cc1)F AS02347 [1,1,0,0,0,0|1,0,0]=3 40 B11R1.20 CC(C)Cc1ccc(cc1)Br AS05659 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.20 Cc1ccc(cc1)NC(=O)C AS00879 [1,1,0,0,0,0|1,0,0]=3 42 B11R1.20 c1cc(ccc1CC(=O)O)Br AS00507 [1,1,0,0,0,0|0,0,0]=2 43 B11R1.20 c1cc(ccc1CC(=O)O)Cl AS05024 [1,1,0,0,0,0|0,0,0]=2 44 B11R1.20 c1cc(ccc1CC(=O)O)F AS00530 [1,1,0,0,0,0|0,0,0]=2 45 B11R1.20 c1cc(ccc1CC(=O)O)I AS00544 [1,1,0,0,0,0|0,0,0]=2 46 B11R1.20 c1cc(ccc1F)[ClH]C(=O)[O-] AS06245 [1,1,0,0,0,0|1,0,1]=4 47 B11R1.20 c1cc(ccc1[ClH]C(=O)[O-])Br AS06247 [1,1,0,0,0,0|1,0,1]=4 48 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)O AS01425 [1,1,0,0,0,0|0,0,0]=2 49 B11R1.86 CC(=O)Cc1ccccc1Br AS05236 [1,1,0,0,0,0|0,0,0]=2 50 B11R1.86 CC(=O)Nc1ccccc1I AS02199 [1,1,0,0,0,0|1,0,0]=3 51 B11R1.86 CC(=O)Nc1ccccc1O AS00888 [1,1,0,0,0,0|1,0,0]=3 52 B11R1.86 CC(=O)Oc1ccccc1Br AS02339 [1,1,0,0,0,0|1,0,0]=3 53 B11R1.86 CC(=O)Oc1ccccc1F AS02345 [1,1,0,0,0,0|1,0,0]=3 54 B11R1.86 CC(=O)Oc1ccccc1I AS02979 [1,1,0,0,0,0|1,0,0]=3 55 B11R1.86 Cc1ccccc1NC(=O)C AS00877 [1,1,0,0,0,0|1,0,0]=3 56 B11R1.86 c1ccc(c(c1)CC(=O)O)Br AS00524 [1,1,0,0,0,0|0,0,0]=2 57 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl AS05022 [1,1,0,0,0,0|0,0,0]=2 58 B11R1.86 c1ccc(c(c1)CC(=O)O)F AS00497 [1,1,0,0,0,0|0,0,0]=2 59 B11R1.86 c1ccc(c(c1)CC(=O)O)I AS00532 [1,1,0,0,0,0|0,0,0]=2 60 B11R1.157 CC(=O)Cc1cccc(c1)Cl AS05237 [1,1,0,0,0,0|0,0,0]=2 61 B11R1.157 CC(=O)Nc1cccc(c1)Br AS00911 [1,1,0,0,0,0|1,0,0]=3 62 B11R1.157 CC(=O)Nc1cccc(c1)Cl AS02674 [1,1,0,0,0,0|1,0,0]=3 63 B11R1.157 CC(=O)Nc1cccc(c1)F AS00824 [1,1,0,0,0,0|1,0,0]=3 64 B11R1.157 CC(=O)Nc1cccc(c1)I AS02200 [1,1,0,0,0,0|1,0,0]=3 65 B11R1.157 CC(=O)Nc1cccc(c1)O AS00889 [1,1,0,0,0,0|1,0,0]=3 66 B11R1.157 CC(=O)Oc1cccc(c1)Br AS02340 [1,1,0,0,0,0|1,0,0]=3 67 B11R1.157 CC(=O)Oc1cccc(c1)Cl AS02343 [1,1,0,0,0,0|1,0,0]=3 68 B11R1.157 CC(=O)Oc1cccc(c1)F AS02346 [1,1,0,0,0,0|1,0,0]=3 69 B11R1.157 Cc1cccc(c1)CC(=O)O AS00531 [1,1,0,0,0,0|0,0,0]=2 70 B11R1.157 Cc1cccc(c1)NC(=O)C AS00878 [1,1,0,0,0,0|1,0,0]=3 71 B11R1.157 Cc1cccc(c1)OC(=O)C AS01252 [1,1,0,0,0,0|1,0,0]=3 72 B11R1.157 c1cc(cc(c1)Br)CC(=O)O AS00508 [1,1,0,0,0,0|0,0,0]=2 73 B11R1.157 c1cc(cc(c1)Cl)CC(=O)N AS06809 [1,1,0,0,0,0|1,0,0]=3 74 B11R1.157 c1cc(cc(c1)Cl)CC(=O)O AS05023 [1,1,0,0,0,0|0,0,0]=2 75 B11R1.157 c1cc(cc(c1)F)CC(=O)O AS00520 [1,1,0,0,0,0|0,0,0]=2 76 B11R1.157 c1cc(cc(c1)I)CC(=O)O AS00542 [1,1,0,0,0,0|0,0,0]=2 77 B11R1.509 CC(C)(Cc1ccccc1)N AS01627 [1,1,0,0,0,0|1,0,1]=4 78 B11R1.509 c1ccc(cc1)CS(=O)(=O)F AS03388 [1,1,0,0,0,0|1,0,1]=4 79 B11R1.22 CCC(=O)c1ccc(cc1)Br AS03828 [0,1,0,0,1,0|1,0,0]=3 80 B11R1.22 CCC(=O)c1ccc(cc1)Cl AS03849 [0,1,0,0,1,0|1,0,0]=3 81 B11R1.22 CCC(=O)c1ccc(cc1)F AS03904 [0,1,0,0,1,0|1,0,0]=3 82 B11R1.22 COC(=O)c1ccc(cc1)Br AS03617 [0,1,0,0,1,0|0,0,0]=2 83 B11R1.22 COC(=O)c1ccc(cc1)Cl AS02923 [0,1,0,0,1,0|0,0,0]=2 84 B11R1.22 COC(=O)c1ccc(cc1)F AS01318 [0,1,0,0,1,0|0,0,0]=2 85 B11R1.22 COC(=O)c1ccc(cc1)I AS02318 [0,1,0,0,1,0|0,0,0]=2 86 B11R1.22 COC(=O)c1ccc(cc1)O AS01626 [0,1,0,0,1,0|0,0,0]=2 87 B11R1.22 Cc1ccc(cc1)C(=O)CN AS05091 [0,1,0,0,1,0|2,0,0]=4 88 B11R1.22 Cc1ccc(cc1)C(=O)OC AS01339 [0,1,0,0,1,0|0,0,0]=2 89 B11R1.22 c1cc(ccc1C(=O)CBr)Br AS05097 [0,1,0,0,1,0|2,0,0]=4 90 B11R1.22 c1cc(ccc1C(=O)CBr)Cl AS01180 [0,1,0,0,1,0|2,0,0]=4 91 B11R1.22 c1cc(ccc1C(=O)CBr)I AS05120 [0,1,0,0,1,0|2,0,0]=4 92 B11R1.22 c1cc(ccc1C(=O)CBr)N AS05064 [0,1,0,0,1,0|2,0,0]=4 93 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS04020 [0,1,0,0,1,0|2,0,0]=4 94 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS05102 [0,1,0,0,1,0|2,0,0]=4 95 B11R1.22 c1cc(ccc1C(=O)CCl)Cl AS05154 [0,1,0,0,1,0|2,0,0]=4 96 B11R1.22 c1cc(ccc1C(=O)CCl)O AS05143 [0,1,0,0,1,0|2,0,0]=4 97 B11R1.22 c1cc(ccc1C(=O)CN)Br AS05065 [0,1,0,0,1,0|2,0,0]=4 98 B11R1.22 c1cc(ccc1C(=O)CN)Cl AS05073 [0,1,0,0,1,0|2,0,0]=4 99 B11R1.22 c1cc(ccc1C(=O)CN)F AS05082 [0,1,0,0,1,0|2,0,0]=4 100 B11R1.22 c1cc(ccc1C(=O)NN)Br AS00928 [0,1,0,0,1,0|2,0,0]=4 101 B11R1.22 c1cc(ccc1C(=O)NN)Cl AS02684 [0,1,0,0,1,0|2,0,0]=4 102 B11R1.22 c1cc(ccc1C(=O)NN)F AS00306 [0,1,0,0,1,0|2,0,0]=4 103 B11R1.22 c1cc(ccc1C(=O)NN)I AS02957 [0,1,0,0,1,0|2,0,0]=4 104 B11R1.22 c1cc(ccc1C(=O)NN)O AS00896 [0,1,0,0,1,0|2,0,0]=4 105 B11R1.23 CCC(=O)c1cccc(c1)Br AS03827 [0,1,0,0,1,0|1,0,0]=3 106 B11R1.23 CCC(=O)c1cccc(c1)C AS07217 [0,1,0,0,1,0|1,0,0]=3 107 B11R1.23 CCC(=O)c1cccc(c1)N AS05233 [0,1,0,0,1,0|1,0,0]=3 108 B11R1.23 CCC(=O)c1cccc(c1)O AS05242 [0,1,0,0,1,0|1,0,0]=3 109 B11R1.23 CNC(=O)c1cccc(c1)N AS06601 [0,1,0,0,1,0|1,0,0]=3 110 B11R1.23 COC(=O)c1cc(ccn1)Br AS04714 [0,1,0,0,1,0|1,0,0]=3 111 B11R1.23 COC(=O)c1cccc(c1)Br AS03616 [0,1,0,0,1,0|0,0,0]=2 112 B11R1.23 COC(=O)c1cccc(c1)I AS02317 [0,1,0,0,1,0|0,0,0]=2 113 B11R1.23 COC(=O)c1ccnc(c1)Br AS04445 [0,1,0,0,1,0|1,0,0]=3 114 B11R1.23 Cc1cccc(c1)C(=O)OC AS02466 [0,1,0,0,1,0|0,0,0]=2 115 B11R1.23 c1cc(cc(c1)Br)C(=O)CBr AS05096 [0,1,0,0,1,0|2,0,0]=4 116 B11R1.23 c1cc(cc(c1)Br)C(=O)NN AS00927 [0,1,0,0,1,0|2,0,0]=4 117 B11R1.23 c1cc(cc(c1)Cl)C(=O)CBr AS05100 [0,1,0,0,1,0|2,0,0]=4 118 B11R1.23 c1cc(cc(c1)Cl)C(=O)CCl AS05153 [0,1,0,0,1,0|2,0,0]=4 119 B11R1.23 c1cc(cc(c1)Cl)C(=O)NN AS02683 [0,1,0,0,1,0|2,0,0]=4 120 B11R1.23 c1cc(cc(c1)Cl)C(=O)OO AS04620 [0,1,0,0,1,0|1,0,0]=3 121 B11R1.23 c1cc(cc(c1)F)C(=O)CCl AS04006 [0,1,0,0,1,0|2,0,0]=4 122 B11R1.23 c1cc(cc(c1)F)C(=O)NN AS02956 [0,1,0,0,1,0|2,0,0]=4 123 B11R1.23 c1cc(cc(c1)O)C(=O)CBr AS05116 [0,1,0,0,1,0|2,0,0]=4 124 B11R1.23 c1cc(cc(c1)O)C(=O)CCl AS05142 [0,1,0,0,1,0|2,0,0]=4 125 B11R1.23 c1cc(cc(c1)O)C(=O)NN AS00901 [0,1,0,0,1,0|2,0,0]=4 126 B11R1.222 CCC(=O)c1ccccc1Cl AS06723 [0,1,0,0,1,0|1,0,0]=3 127 B11R1.222 COC(=O)c1ccccc1Br AS03615 [0,1,0,0,1,0|0,0,0]=2 128 B11R1.222 COC(=O)c1ccccc1Cl AS00094 [0,1,0,0,1,0|0,0,0]=2 129 B11R1.222 COC(=O)c1ccccc1F AS01317 [0,1,0,0,1,0|0,0,0]=2 130 B11R1.222 COC(=O)c1ccccc1I AS02316 [0,1,0,0,1,0|0,0,0]=2 131 B11R1.222 COC(=O)c1ccccc1N AS01236 [0,1,0,0,1,0|0,0,0]=2 132 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl AS05099 [0,1,0,0,1,0|2,0,0]=4 133 B11R1.222 c1ccc(c(c1)C(=O)CBr)F AS05110 [0,1,0,0,1,0|2,0,0]=4 134 B11R1.222 c1ccc(c(c1)C(=O)CN)Br AS05062 [0,1,0,0,1,0|2,0,0]=4 135 B11R1.222 c1ccc(c(c1)C(=O)CN)Cl AS05070 [0,1,0,0,1,0|2,0,0]=4 136 B11R1.222 c1ccc(c(c1)C(=O)CN)F AS05081 [0,1,0,0,1,0|2,0,0]=4 137 B11R1.222 c1ccc(c(c1)C(=O)NN)Br AS00926 [0,1,0,0,1,0|2,0,0]=4 138 B11R1.222 c1ccc(c(c1)C(=O)NN)Cl AS02682 [0,1,0,0,1,0|2,0,0]=4 139 B11R1.222 c1ccc(c(c1)C(=O)NN)F AS02953 [0,1,0,0,1,0|2,0,0]=4 140 B11R1.222 c1ccc(c(c1)C(=O)NN)O AS00900 [0,1,0,0,1,0|2,0,0]=4 141 B13R1.14 COC(=O)C=Cc1ccc(cc1)Cl AS06038 [0,1,0,0,0,1|0,0,1]=3 142 B13R1.14 COC(=O)CCc1ccc(cc1)O AS06130 [0,1,0,0,0,1|0,0,0]=2 143 B13R1.15 COC(=O)C=Cc1cccc(c1)Br AS06035 [0,1,0,0,0,1|0,0,1]=3 144 B13R1.15 COC(=O)CCc1cccc(c1)Br AS06128 [0,1,0,0,0,1|0,0,0]=2 145 B13R1.528 COC(=O)CCc1ccccc1Br AS06126 [0,1,0,0,0,1|0,0,0]=2 146 B13R1.19 CCOC(=O)Cc1ccc(cc1)Br AS01235 [0,2,0,0,0,0|0,0,0]=2 147 B13R1.19 CCOC(=O)Cc1ccc(cc1)C AS06120 [0,2,0,0,0,0|0,0,0]=2 148 B13R1.21 COC(=O)[C@@H](c1ccc(cc1)F)N AS06760 [0,2,0,0,0,0|0,0,0]=2 149 B13R1.5 COC(=O)Cc1ccc(cc1)CBr AS06817 [0,2,0,0,0,0|0,0,0]=2 150 B13R1.2879 COC(=O)Cc1ccc(c(c1)Cl)O AS06087 [0,2,0,0,0,0|0,0,0]=2 151 B13R1.91 COC(=O)Cc1ccccc1C#N AS06091 [0,2,0,0,0,0|0,0,0]=2 152 B13R2.33 c1ccc2c(c1)CCC(=O)CC2 AS06277 [0,0,0,1,0,1|1,0,0]=3 153 B9R1.6 c1ccc(cc1)C(=O)Cl AS00010 [1,0,0,0,1,0|1,0,0]=3 154 B9R1.6 c1ccc(cc1)C(=O)O AS04617 [1,0,0,0,1,0|0,0,0]=2 155 B9R1.6 c1ccc(cc1)C(=O)[O-] AS01250 [1,0,0,0,1,0|0,0,1]=3 156 B9R1.6 c1ccc(cc1)[N+](=O)[O-] AS01461 [1,0,0,0,1,0|1,0,1]=4 157 B9R1.11 COC(=O)c1c[nH]nc1 AS07234 [0,0,0,0,2,0|2,0,0]=4