0 B11R2.1 c1ccc2c(c1)c(co2)Br AS06438 [0,0,0,0,0,0|3,0,0]=3 1 B11R2.1 c1ccc2c(c1)c(no2)Cl AS06286 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.1 c1ccc2c(c1)c(no2)O AS06287 [0,0,0,0,0,0|2,0,1]=3 3 B10R2.7 c1cc2cc[nH]c2nc1 AS07114 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.18 c1ccc2c(c1)CC(C2O)Br AS03960 [0,1,0,0,0,0|1,0,2]=4 5 B12R2.132 c1cc2c(cc1Br)C(=O)CO2 AS06367 [0,1,0,0,0,0|2,0,0]=3 6 B12R2.132 c1cc2c(cc1Cl)C(=O)CO2 AS06459 [0,1,0,0,0,0|2,0,0]=3 7 B12R2.132 c1cc2c(cc1F)C(=O)CO2 AS06458 [0,1,0,0,0,0|2,0,0]=3 8 B12R2.612 c1cc2c(cc1Br)COC2=O AS07099 [0,1,0,0,0,0|0,0,0]=1 9 B12R2.612 c1cc2c(cc1Br)OCC2=O AS06368 [0,1,0,0,0,0|2,0,0]=3 10 B12R2.612 c1cc2c(cc1Br)onc2Cl AS06283 [0,1,0,0,0,0|3,0,0]=4 11 B12R2.612 c1cc2c(cc1Cl)CCC2=O AS04658 [0,1,0,0,0,0|1,0,0]=2 12 B12R2.612 c1cc2c(cc1Cl)OCC2=O AS06461 [0,1,0,0,0,0|2,0,0]=3 13 B12R2.612 c1cc2c(cc1Cl)onc2O AS06205 [0,1,0,0,0,0|2,0,1]=4 14 B12R2.612 c1cc2c(cc1F)OCC2=O AS06460 [0,1,0,0,0,0|2,0,0]=3 15 B12R2.612 c1cc2c(cc1O)OCC2=O AS06432 [0,1,0,0,0,0|2,0,0]=3 16 B12R2.2028 c1ccc2c(c1)C(=O)OI2O AS06644 [0,1,0,0,0,0|1,0,0]=2 17 B10R1.15 C=CC(=O)c1ccccc1 AS07048 [0,0,1,0,0,0|1,0,1]=3 18 B10R1.15 CCC(=O)c1ccccc1 AS01141 [0,0,1,0,0,0|1,0,0]=2 19 B10R1.15 CCC(C)c1ccccc1 AS05667 [0,0,1,0,0,0|2,0,1]=4 20 B10R1.15 c1ccc(cc1)C(=NO)N AS06646 [0,0,1,0,0,0|3,0,0]=4 21 B10R1.15 c1ccc(cc1)C(=O)C#N AS04664 [0,0,1,0,0,0|2,0,0]=3 22 B10R1.15 c1ccc(cc1)C(=O)CBr AS01145 [0,0,1,0,0,0|2,0,0]=3 23 B10R1.15 c1ccc(cc1)C(=O)CCl AS01163 [0,0,1,0,0,0|2,0,0]=3 24 B10R1.15 c1ccc(cc1)C(=O)NN AS01560 [0,0,1,0,0,0|2,0,0]=3 25 B10R1.17 c1ccc(cc1)C#CC=O AS06906 [0,0,1,0,0,0|1,0,1]=3 26 B10R1.17 c1ccc(cc1)CCCBr AS03468 [0,0,1,0,0,0|2,0,1]=4 27 B10R1.17 c1ccc(cc1)CN=C=S AS04379 [0,0,1,0,0,0|1,1,1]=4 28 B10R1.20 CCc1ccccc1C=O AS04433 [0,0,1,0,0,0|1,0,0]=2 29 B10R1.20 CCc1ccccc1OC AS02573 [0,0,1,0,0,0|3,0,0]=4 30 B10R1.20 COc1ccccc1CCl AS05988 [0,0,1,0,0,0|3,0,0]=4 31 B10R1.20 COc1ccccc1CO AS03989 [0,0,1,0,0,0|2,0,0]=3 32 B10R1.20 c1ccc(c(c1)C=O)C=O AS03002 [0,0,1,0,0,0|0,0,2]=3 33 B10R1.20 c1ccc(c(c1)CBr)C#N AS00647 [0,0,1,0,0,0|2,0,1]=4 34 B10R1.20 c1ccc(c(c1)CBr)CBr AS00651 [0,0,1,0,0,0|2,0,1]=4 35 B10R1.20 c1ccc(c(c1)CO)C#N AS02592 [0,0,1,0,0,0|1,0,1]=3 36 B10R1.20 c1ccc(c(c1)CO)CO AS05939 [0,0,1,0,0,0|0,0,2]=3 37 B10R1.61 B(c1ccccc1Br)(O)O AS04470 [0,0,1,0,0,0|2,0,1]=4 38 B10R1.61 CC(=O)c1c(cccn1)F AS04769 [0,0,1,0,0,0|3,0,0]=4 39 B10R1.61 CC(=O)c1ccccc1Br AS01164 [0,0,1,0,0,0|2,0,0]=3 40 B10R1.61 CC(=O)c1ccccc1Cl AS01142 [0,0,1,0,0,0|2,0,0]=3 41 B10R1.61 CC(=O)c1ccccc1F AS01129 [0,0,1,0,0,0|2,0,0]=3 42 B10R1.61 CC(=O)c1ccccc1I AS03911 [0,0,1,0,0,0|2,0,0]=3 43 B10R1.61 CC(=O)c1ccccc1O AS01159 [0,0,1,0,0,0|2,0,0]=3 44 B10R1.61 CC(c1ccccc1Br)O AS03463 [0,0,1,0,0,0|2,0,1]=4 45 B10R1.61 CC(c1ccccc1Cl)O AS02837 [0,0,1,0,0,0|2,0,1]=4 46 B10R1.61 CC(c1ccccc1F)O AS00893 [0,0,1,0,0,0|2,0,1]=4 47 B10R1.61 Cc1ccccc1[N+](=O)[O-] AS00108 [0,0,1,0,0,0|1,0,1]=3 48 B10R1.61 c1cc(c(nc1)F)C(=O)O AS04848 [0,0,1,0,0,0|2,0,0]=3 49 B10R1.61 c1ccc(c(c1)C(=O)Cl)I AS00019 [0,0,1,0,0,0|2,0,0]=3 50 B10R1.61 c1ccc(c(c1)C(=O)N)Br AS00918 [0,0,1,0,0,0|2,0,0]=3 51 B10R1.61 c1ccc(c(c1)C(=O)N)Cl AS02678 [0,0,1,0,0,0|2,0,0]=3 52 B10R1.61 c1ccc(c(c1)C(=O)N)F AS00829 [0,0,1,0,0,0|2,0,0]=3 53 B10R1.61 c1ccc(c(c1)C(=O)N)I AS02212 [0,0,1,0,0,0|2,0,0]=3 54 B10R1.61 c1ccc(c(c1)C(=O)O)Br AS00760 [0,0,1,0,0,0|1,0,0]=2 55 B10R1.61 c1ccc(c(c1)C(=O)O)Cl AS00802 [0,0,1,0,0,0|1,0,0]=2 56 B10R1.61 c1ccc(c(c1)C(=O)O)F AS00814 [0,0,1,0,0,0|1,0,0]=2 57 B10R1.61 c1ccc(c(c1)C(=O)O)I AS02216 [0,0,1,0,0,0|1,0,0]=2 58 B10R1.61 c1ccc(c(c1)C(=O)[O-])F AS00773 [0,0,1,0,0,0|1,0,1]=3 59 B10R1.61 c1ccc(c(c1)N)[N+](=O)[O-] AS01504 [0,0,1,0,0,0|2,0,1]=4 60 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Br AS03439 [0,0,1,0,0,0|2,0,1]=4 61 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F AS01522 [0,0,1,0,0,0|2,0,1]=4 62 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F AS04477 [0,0,1,0,0,0|2,0,1]=4 63 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F AS05721 [0,0,1,0,0,0|2,0,1]=4 64 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])I AS02273 [0,0,1,0,0,0|2,0,1]=4 65 B12R2.24 Cc1nc2ccccc2nn1 AS06650 [0,0,0,0,0,1|3,0,0]=4 66 B12R2.24 c1ccc2cc(ccc2c1)Br AS02431 [0,0,0,0,0,1|2,0,1]=4 67 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 AS06210 [0,0,0,0,0,1|1,0,0]=2 68 B12R2.1081 c1ccc2c(c1)cccc2Cl AS02472 [0,0,0,0,0,1|2,0,1]=4 69 B12R2.1081 c1ccc2c(c1)cccc2F AS02917 [0,0,0,0,0,1|2,0,1]=4 70 B12R2.1081 c1ccc2c(c1)cccc2I AS06208 [0,0,0,0,0,1|2,0,1]=4 71 B12R2.1081 c1ccc2c(c1)cccc2N AS02473 [0,0,0,0,0,1|2,0,1]=4 72 B9R1.6 c1ccc(cc1)C(=O)Cl AS00010 [1,0,1,0,0,0|1,0,0]=3 73 B9R1.6 c1ccc(cc1)C(=O)O AS04617 [1,0,1,0,0,0|0,0,0]=2 74 B9R1.6 c1ccc(cc1)C(=O)[O-] AS01250 [1,0,1,0,0,0|0,0,1]=3 75 B9R1.6 c1ccc(cc1)[N+](=O)[O-] AS01461 [1,0,1,0,0,0|1,0,1]=4 76 B9R1.8 c1ccc(cc1)CC#N AS01366 [1,0,1,0,0,0|1,0,1]=4 77 B9R1.8 c1ccc(cc1)CCCl AS00650 [1,0,1,0,0,0|1,0,1]=4 78 B9R1.8 c1ccc(cc1)CCN AS00484 [1,0,1,0,0,0|1,0,1]=4 79 B9R1.8 c1ccc(cc1)CCO AS00558 [1,0,1,0,0,0|0,0,2]=4 80 B9R1.8 c1ccc(cc1)CON AS04494 [1,0,1,0,0,0|1,0,0]=3 81 B9R1.8 c1ccc(cc1)N=C=O AS04076 [1,0,1,0,0,0|1,0,1]=4 82 B9R1.15 C=Cc1ccccc1Br AS03804 [1,0,1,0,0,0|2,0,0]=4 83 B9R1.15 C=Cc1ccccc1F AS03294 [1,0,1,0,0,0|2,0,0]=4 84 B9R1.15 CCc1ccccc1Br AS03252 [1,0,1,0,0,0|2,0,0]=4 85 B9R1.15 CCc1ccccc1I AS02158 [1,0,1,0,0,0|2,0,0]=4 86 B9R1.15 CSc1ccccc1O AS04298 [1,0,1,0,0,0|2,0,0]=4 87 B9R1.15 Cc1ccccc1C=O AS02777 [1,0,1,0,0,0|0,0,0]=2 88 B9R1.15 Cc1ccccc1CBr AS02052 [1,0,1,0,0,0|1,0,1]=4 89 B9R1.15 Cc1ccccc1CCl AS03843 [1,0,1,0,0,0|1,0,1]=4 90 B9R1.15 Cc1ccccc1CN AS00380 [1,0,1,0,0,0|1,0,1]=4 91 B9R1.15 Cc1ccccc1NN AS02962 [1,0,1,0,0,0|2,0,0]=4 92 B9R1.15 Cc1ccccc1OC AS01015 [1,0,1,0,0,0|2,0,0]=4 93 B9R1.15 Cc1ccccc1SC AS04306 [1,0,1,0,0,0|2,0,0]=4 94 B9R1.15 c1ccc(c(c1)C#N)O AS02648 [1,0,1,0,0,0|1,0,1]=4 95 B9R1.15 c1ccc(c(c1)C=O)Br AS03776 [1,0,1,0,0,0|1,0,0]=3 96 B9R1.15 c1ccc(c(c1)C=O)F AS02999 [1,0,1,0,0,0|1,0,0]=3 97 B9R1.15 c1ccc(c(c1)C=O)I AS03914 [1,0,1,0,0,0|1,0,0]=3 98 B9R1.15 c1ccc(c(c1)C=O)N AS04430 [1,0,1,0,0,0|1,0,0]=3 99 B9R1.15 c1ccc(c(c1)C=O)O AS03003 [1,0,1,0,0,0|0,0,0]=2 100 B9R1.15 c1ccc(c(c1)C=O)O AS07244 [1,0,1,0,0,0|0,0,0]=2 101 B9R1.15 c1ccc(c(c1)CBr)Br AS02057 [1,0,1,0,0,0|2,0,0]=4 102 B9R1.15 c1ccc(c(c1)CBr)Cl AS02065 [1,0,1,0,0,0|2,0,0]=4 103 B9R1.15 c1ccc(c(c1)CBr)F AS00662 [1,0,1,0,0,0|2,0,0]=4 104 B9R1.15 c1ccc(c(c1)CBr)I AS00633 [1,0,1,0,0,0|2,0,0]=4 105 B9R1.15 c1ccc(c(c1)CCl)F AS00659 [1,0,1,0,0,0|2,0,0]=4 106 B9R1.15 c1ccc(c(c1)CN)Br AS02252 [1,0,1,0,0,0|2,0,0]=4 107 B9R1.15 c1ccc(c(c1)CN)Br AS03101 [1,0,1,0,0,0|2,0,0]=4 108 B9R1.15 c1ccc(c(c1)CN)Cl AS00369 [1,0,1,0,0,0|2,0,0]=4 109 B9R1.15 c1ccc(c(c1)CN)Cl AS02687 [1,0,1,0,0,0|2,0,0]=4 110 B9R1.15 c1ccc(c(c1)CN)F AS00832 [1,0,1,0,0,0|2,0,0]=4 111 B9R1.15 c1ccc(c(c1)CN)F AS01936 [1,0,1,0,0,0|2,0,0]=4 112 B9R1.15 c1ccc(c(c1)CN)I AS02221 [1,0,1,0,0,0|2,0,0]=4 113 B9R1.15 c1ccc(c(c1)CN)I AS02299 [1,0,1,0,0,0|2,0,0]=4 114 B9R1.15 c1ccc(c(c1)CN)N AS06598 [1,0,1,0,0,0|2,0,0]=4 115 B9R1.15 c1ccc(c(c1)CO)Br AS03952 [1,0,1,0,0,0|1,0,0]=3 116 B9R1.15 c1ccc(c(c1)CO)Cl AS03963 [1,0,1,0,0,0|1,0,0]=3 117 B9R1.15 c1ccc(c(c1)CO)F AS03976 [1,0,1,0,0,0|1,0,0]=3 118 B9R1.15 c1ccc(c(c1)CO)I AS03985 [1,0,1,0,0,0|1,0,0]=3 119 B9R1.15 c1ccc(c(c1)CO)N AS00575 [1,0,1,0,0,0|1,0,0]=3 120 B9R1.15 c1ccc(c(c1)CO)O AS00547 [1,0,1,0,0,0|0,0,1]=3 121 B11R1.16 CCOC(=O)c1ccccn1 AS01278 [0,1,1,0,0,0|1,0,0]=3 122 B11R1.16 c1ccc(cc1)C(=O)CCN AS05234 [0,1,1,0,0,0|1,0,0]=3 123 B11R1.16 c1ccc(cc1)C(=O)N=C=O AS04369 [0,1,1,0,0,0|1,0,1]=4 124 B11R1.16 c1ccc(cc1)C(=O)N=C=S AS00355 [0,1,1,0,0,0|1,0,1]=4 125 B11R1.22 CCC(=O)c1ccc(cc1)Br AS03828 [0,1,1,0,0,0|1,0,0]=3 126 B11R1.22 CCC(=O)c1ccc(cc1)Cl AS03849 [0,1,1,0,0,0|1,0,0]=3 127 B11R1.22 CCC(=O)c1ccc(cc1)F AS03904 [0,1,1,0,0,0|1,0,0]=3 128 B11R1.22 COC(=O)c1ccc(cc1)Br AS03617 [0,1,1,0,0,0|0,0,0]=2 129 B11R1.22 COC(=O)c1ccc(cc1)Cl AS02923 [0,1,1,0,0,0|0,0,0]=2 130 B11R1.22 COC(=O)c1ccc(cc1)F AS01318 [0,1,1,0,0,0|0,0,0]=2 131 B11R1.22 COC(=O)c1ccc(cc1)I AS02318 [0,1,1,0,0,0|0,0,0]=2 132 B11R1.22 COC(=O)c1ccc(cc1)O AS01626 [0,1,1,0,0,0|0,0,0]=2 133 B11R1.22 Cc1ccc(cc1)C(=O)CN AS05091 [0,1,1,0,0,0|2,0,0]=4 134 B11R1.22 Cc1ccc(cc1)C(=O)OC AS01339 [0,1,1,0,0,0|0,0,0]=2 135 B11R1.22 c1cc(ccc1C(=O)CBr)Br AS05097 [0,1,1,0,0,0|2,0,0]=4 136 B11R1.22 c1cc(ccc1C(=O)CBr)Cl AS01180 [0,1,1,0,0,0|2,0,0]=4 137 B11R1.22 c1cc(ccc1C(=O)CBr)I AS05120 [0,1,1,0,0,0|2,0,0]=4 138 B11R1.22 c1cc(ccc1C(=O)CBr)N AS05064 [0,1,1,0,0,0|2,0,0]=4 139 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS04020 [0,1,1,0,0,0|2,0,0]=4 140 B11R1.22 c1cc(ccc1C(=O)CCl)Br AS05102 [0,1,1,0,0,0|2,0,0]=4 141 B11R1.22 c1cc(ccc1C(=O)CCl)Cl AS05154 [0,1,1,0,0,0|2,0,0]=4 142 B11R1.22 c1cc(ccc1C(=O)CCl)O AS05143 [0,1,1,0,0,0|2,0,0]=4 143 B11R1.22 c1cc(ccc1C(=O)CN)Br AS05065 [0,1,1,0,0,0|2,0,0]=4 144 B11R1.22 c1cc(ccc1C(=O)CN)Cl AS05073 [0,1,1,0,0,0|2,0,0]=4 145 B11R1.22 c1cc(ccc1C(=O)CN)F AS05082 [0,1,1,0,0,0|2,0,0]=4 146 B11R1.22 c1cc(ccc1C(=O)NN)Br AS00928 [0,1,1,0,0,0|2,0,0]=4 147 B11R1.22 c1cc(ccc1C(=O)NN)Cl AS02684 [0,1,1,0,0,0|2,0,0]=4 148 B11R1.22 c1cc(ccc1C(=O)NN)F AS00306 [0,1,1,0,0,0|2,0,0]=4 149 B11R1.22 c1cc(ccc1C(=O)NN)I AS02957 [0,1,1,0,0,0|2,0,0]=4 150 B11R1.22 c1cc(ccc1C(=O)NN)O AS00896 [0,1,1,0,0,0|2,0,0]=4 151 B11R1.23 CCC(=O)c1cccc(c1)Br AS03827 [0,1,1,0,0,0|1,0,0]=3 152 B11R1.23 CCC(=O)c1cccc(c1)C AS07217 [0,1,1,0,0,0|1,0,0]=3 153 B11R1.23 CCC(=O)c1cccc(c1)N AS05233 [0,1,1,0,0,0|1,0,0]=3 154 B11R1.23 CCC(=O)c1cccc(c1)O AS05242 [0,1,1,0,0,0|1,0,0]=3 155 B11R1.23 CNC(=O)c1cccc(c1)N AS06601 [0,1,1,0,0,0|1,0,0]=3 156 B11R1.23 COC(=O)c1cc(ccn1)Br AS04714 [0,1,1,0,0,0|1,0,0]=3 157 B11R1.23 COC(=O)c1cccc(c1)Br AS03616 [0,1,1,0,0,0|0,0,0]=2 158 B11R1.23 COC(=O)c1cccc(c1)I AS02317 [0,1,1,0,0,0|0,0,0]=2 159 B11R1.23 COC(=O)c1ccnc(c1)Br AS04445 [0,1,1,0,0,0|1,0,0]=3 160 B11R1.23 Cc1cccc(c1)C(=O)OC AS02466 [0,1,1,0,0,0|0,0,0]=2 161 B11R1.23 c1cc(cc(c1)Br)C(=O)CBr AS05096 [0,1,1,0,0,0|2,0,0]=4 162 B11R1.23 c1cc(cc(c1)Br)C(=O)NN AS00927 [0,1,1,0,0,0|2,0,0]=4 163 B11R1.23 c1cc(cc(c1)Cl)C(=O)CBr AS05100 [0,1,1,0,0,0|2,0,0]=4 164 B11R1.23 c1cc(cc(c1)Cl)C(=O)CCl AS05153 [0,1,1,0,0,0|2,0,0]=4 165 B11R1.23 c1cc(cc(c1)Cl)C(=O)NN AS02683 [0,1,1,0,0,0|2,0,0]=4 166 B11R1.23 c1cc(cc(c1)Cl)C(=O)OO AS04620 [0,1,1,0,0,0|1,0,0]=3 167 B11R1.23 c1cc(cc(c1)F)C(=O)CCl AS04006 [0,1,1,0,0,0|2,0,0]=4 168 B11R1.23 c1cc(cc(c1)F)C(=O)NN AS02956 [0,1,1,0,0,0|2,0,0]=4 169 B11R1.23 c1cc(cc(c1)O)C(=O)CBr AS05116 [0,1,1,0,0,0|2,0,0]=4 170 B11R1.23 c1cc(cc(c1)O)C(=O)CCl AS05142 [0,1,1,0,0,0|2,0,0]=4 171 B11R1.23 c1cc(cc(c1)O)C(=O)NN AS00901 [0,1,1,0,0,0|2,0,0]=4 172 B11R1.36 c1ccc(cc1)C(=O)C(F)F AS05165 [0,1,1,0,0,0|2,0,0]=4 173 B11R1.222 CCC(=O)c1ccccc1Cl AS06723 [0,1,1,0,0,0|1,0,0]=3 174 B11R1.222 COC(=O)c1ccccc1Br AS03615 [0,1,1,0,0,0|0,0,0]=2 175 B11R1.222 COC(=O)c1ccccc1Cl AS00094 [0,1,1,0,0,0|0,0,0]=2 176 B11R1.222 COC(=O)c1ccccc1F AS01317 [0,1,1,0,0,0|0,0,0]=2 177 B11R1.222 COC(=O)c1ccccc1I AS02316 [0,1,1,0,0,0|0,0,0]=2 178 B11R1.222 COC(=O)c1ccccc1N AS01236 [0,1,1,0,0,0|0,0,0]=2 179 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl AS05099 [0,1,1,0,0,0|2,0,0]=4 180 B11R1.222 c1ccc(c(c1)C(=O)CBr)F AS05110 [0,1,1,0,0,0|2,0,0]=4 181 B11R1.222 c1ccc(c(c1)C(=O)CN)Br AS05062 [0,1,1,0,0,0|2,0,0]=4 182 B11R1.222 c1ccc(c(c1)C(=O)CN)Cl AS05070 [0,1,1,0,0,0|2,0,0]=4 183 B11R1.222 c1ccc(c(c1)C(=O)CN)F AS05081 [0,1,1,0,0,0|2,0,0]=4 184 B11R1.222 c1ccc(c(c1)C(=O)NN)Br AS00926 [0,1,1,0,0,0|2,0,0]=4 185 B11R1.222 c1ccc(c(c1)C(=O)NN)Cl AS02682 [0,1,1,0,0,0|2,0,0]=4 186 B11R1.222 c1ccc(c(c1)C(=O)NN)F AS02953 [0,1,1,0,0,0|2,0,0]=4 187 B11R1.222 c1ccc(c(c1)C(=O)NN)O AS00900 [0,1,1,0,0,0|2,0,0]=4 188 B11R1.1 c1cc(ccc1CN=C=O)F AS06152 [0,1,1,0,0,0|1,0,1]=4 189 B11R1.24 c1cc(cc(c1)F)CN=C=O AS04384 [0,1,1,0,0,0|1,0,1]=4 190 B11R1.28 c1ccc(cc1)CCN=C=O AS04375 [0,1,1,0,0,0|1,0,1]=4 191 B11R1.91 CC(=O)COc1ccccc1 AS05273 [0,1,1,0,0,0|2,0,0]=4 192 B11R1.91 CC(=O)OCc1ccccc1 AS01460 [0,1,1,0,0,0|0,0,0]=2 193 B11R1.91 c1ccc(cc1)C=CC(=O)O AS07055 [0,1,1,0,0,0|1,0,1]=4 194 B11R1.37 CCc1cc(ccc1C=O)O AS06473 [0,1,1,0,0,0|1,0,0]=3 195 B11R1.37 COc1cc(ccc1C=O)Br AS02782 [0,1,1,0,0,0|2,0,0]=4 196 B11R1.37 COc1cc(ccc1C=O)Cl AS03934 [0,1,1,0,0,0|2,0,0]=4 197 B11R1.37 COc1cc(ccc1C=O)Cl AS05560 [0,1,1,0,0,0|2,0,0]=4 198 B11R1.37 COc1cc(ccc1C=O)F AS03036 [0,1,1,0,0,0|2,0,0]=4 199 B11R1.37 COc1cc(ccc1C=O)O AS06309 [0,1,1,0,0,0|2,0,0]=4 200 B11R1.37 COc1cc(ccc1CO)Br AS00555 [0,1,1,0,0,0|2,0,0]=4 201 B11R1.37 COc1cc(ccc1CO)Cl AS04003 [0,1,1,0,0,0|2,0,0]=4 202 B11R1.37 COc1cc(ccc1CO)F AS03982 [0,1,1,0,0,0|2,0,0]=4 203 B11R1.37 COc1ccc(cc1C=O)Br AS02976 [0,1,1,0,0,0|2,0,0]=4 204 B11R1.37 COc1ccc(cc1C=O)Cl AS03846 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.37 COc1ccc(cc1C=O)Cl AS05561 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.37 COc1ccc(cc1C=O)F AS03897 [0,1,1,0,0,0|2,0,0]=4 207 B11R1.37 COc1ccc(cc1CO)Br AS00560 [0,1,1,0,0,0|2,0,0]=4 208 B11R1.37 COc1ccc(cc1CO)F AS00599 [0,1,1,0,0,0|2,0,0]=4 209 B11R1.37 Cc1ccc(c(c1)C#N)C=O AS06373 [0,1,1,0,0,0|1,0,1]=4 210 B11R1.37 c1cc(c(cc1F)CO)C#N AS05963 [0,1,1,0,0,0|1,0,1]=4 211 B11R1.41 c1ccc(c(c1)CCBr)C=O AS06680 [0,1,1,0,0,0|1,0,0]=3 212 B11R1.53 CC(=O)c1ccccc1OC AS05203 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.53 CC(C)c1ccccc1C=O AS06366 [0,1,1,0,0,0|1,0,0]=3 214 B11R1.53 CC(c1ccccc1OC)O AS04413 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.53 c1ccc(c(c1)C#N)C(=O)O AS00846 [0,1,1,0,0,0|1,0,1]=4 216 B11R1.53 c1ccc(c(c1)C(=O)O)NN AS04612 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.53 c1ccc(c(c1)C=O)[N+](=O)[O-] AS02851 [0,1,1,0,0,0|1,0,1]=4 218 B11R1.53 c1ccc(c(c1)CBr)[N+](=O)[O-] AS02058 [0,1,1,0,0,0|2,0,0]=4 219 B11R1.53 c1ccc(c(c1)CCl)C(=O)O AS00738 [0,1,1,0,0,0|1,0,0]=3 220 B11R1.53 c1ccc(c(c1)CO)[N+](=O)[O-] AS00572 [0,1,1,0,0,0|1,0,0]=3 221 B11R1.265 CCc1cccc(c1C=O)O AS06356 [0,1,1,0,0,0|1,0,0]=3 222 B11R1.265 COc1c(cccc1Cl)C=O AS05558 [0,1,1,0,0,0|2,0,0]=4 223 B11R1.265 COc1c(cccc1Cl)C=O AS06905 [0,1,1,0,0,0|2,0,0]=4 224 B11R1.265 COc1c(cccc1F)C=O AS01462 [0,1,1,0,0,0|2,0,0]=4 225 B11R1.265 COc1c(cccc1F)C=O AS04977 [0,1,1,0,0,0|2,0,0]=4 226 B11R1.265 COc1cccc(c1C=O)F AS03034 [0,1,1,0,0,0|2,0,0]=4 227 B11R1.265 CSc1cccc(c1C=O)Cl AS06292 [0,1,1,0,0,0|2,0,0]=4 228 B11R1.265 Cc1cccc(c1C=O)OC AS07021 [0,1,1,0,0,0|2,0,0]=4 229 B11R1.265 c1cc(c(c(c1)Cl)C=O)C#N AS04564 [0,1,1,0,0,0|1,0,1]=4 230 B11R1.156 CC(=O)c1c(cccc1Cl)Cl AS04032 [0,1,1,0,0,0|2,0,0]=4 231 B11R1.156 CC(=O)c1c(cccc1Cl)Cl AS05155 [0,1,1,0,0,0|2,0,0]=4 232 B11R1.156 CC(=O)c1c(cccc1Cl)F AS05137 [0,1,1,0,0,0|2,0,0]=4 233 B11R1.156 CC(=O)c1c(cccc1F)F AS01189 [0,1,1,0,0,0|2,0,0]=4 234 B11R1.156 CC(=O)c1c(cccc1F)O AS01204 [0,1,1,0,0,0|2,0,0]=4 235 B11R1.156 Cc1cccc(c1C(=O)O)C AS00752 [0,1,1,0,0,0|0,0,0]=2 236 B11R1.156 Cc1cccc(c1C(=O)O)Cl AS00924 [0,1,1,0,0,0|0,0,0]=2 237 B11R1.156 Cc1cccc(c1C(=O)O)F AS00945 [0,1,1,0,0,0|0,0,0]=2 238 B11R1.156 Cc1cccc(c1C(=O)O)N AS00734 [0,1,1,0,0,0|0,0,0]=2 239 B11R1.156 Cc1cccc(c1[N+](=O)[O-])Br AS06336 [0,1,1,0,0,0|1,0,1]=4 240 B11R1.156 Cc1cccc(c1[N+](=O)[O-])F AS02033 [0,1,1,0,0,0|1,0,1]=4 241 B11R1.156 Cc1cccc(c1[N+](=O)[O-])O AS05505 [0,1,1,0,0,0|1,0,1]=4 242 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Cl AS03129 [0,1,1,0,0,0|1,0,0]=3 243 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F AS01799 [0,1,1,0,0,0|1,0,0]=3 244 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)N AS00804 [0,1,1,0,0,0|1,0,0]=3 245 B11R1.156 c1cc(c(c(c1)Cl)C(=O)Cl)Cl AS00029 [0,1,1,0,0,0|2,0,0]=4 246 B11R1.156 c1cc(c(c(c1)Cl)C(=O)Cl)F AS00040 [0,1,1,0,0,0|2,0,0]=4 247 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)Cl AS00751 [0,1,1,0,0,0|1,0,0]=3 248 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)F AS00966 [0,1,1,0,0,0|1,0,0]=3 249 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)N AS00733 [0,1,1,0,0,0|1,0,0]=3 250 B11R1.156 c1cc(c(c(c1)F)C(=O)Cl)F AS00034 [0,1,1,0,0,0|2,0,0]=4 251 B11R1.156 c1cc(c(c(c1)F)C(=O)N)F AS05891 [0,1,1,0,0,0|2,0,0]=4 252 B11R1.156 c1cc(c(c(c1)F)C(=O)O)F AS00819 [0,1,1,0,0,0|1,0,0]=3 253 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N AS00980 [0,1,1,0,0,0|1,0,0]=3 254 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O AS01855 [0,1,1,0,0,0|1,0,0]=3 255 B11R1.156 c1cc(c(c(c1)F)C(=O)[O-])F AS00783 [0,1,1,0,0,0|1,0,1]=4 256 B11R1.156 c1cc(c(c(c1)I)C(=O)Cl)F AS01862 [0,1,1,0,0,0|2,0,0]=4 257 B11R1.156 c1cc(c(c(c1)I)C(=O)N)Cl AS05888 [0,1,1,0,0,0|2,0,0]=4 258 B11R1.156 c1cc(c(c(c1)I)C(=O)O)F AS00149 [0,1,1,0,0,0|1,0,0]=3 259 B11R1.156 c1cc(c(c(c1)O)C(=O)O)O AS04461 [0,1,1,0,0,0|1,0,0]=3 260 B11R1.159 B(c1cccc(c1C)F)(O)O AS04505 [0,1,1,0,0,0|1,0,1]=4 261 B11R1.159 CC(=O)c1cccc(c1Br)Br AS07165 [0,1,1,0,0,0|2,0,0]=4 262 B11R1.159 CC(=O)c1cccc(c1Br)F AS01175 [0,1,1,0,0,0|2,0,0]=4 263 B11R1.159 CC(=O)c1cccc(c1Cl)F AS01143 [0,1,1,0,0,0|2,0,0]=4 264 B11R1.159 CC(=O)c1cccc(c1F)Br AS01156 [0,1,1,0,0,0|2,0,0]=4 265 B11R1.159 CC(=O)c1cccc(c1F)Cl AS05138 [0,1,1,0,0,0|2,0,0]=4 266 B11R1.159 CC(=O)c1cccc(c1F)F AS01188 [0,1,1,0,0,0|2,0,0]=4 267 B11R1.159 CC(=O)c1cccc(c1N)Cl AS05071 [0,1,1,0,0,0|2,0,0]=4 268 B11R1.159 CC(=O)c1cccc(c1O)Br AS05118 [0,1,1,0,0,0|2,0,0]=4 269 B11R1.159 CC(=O)c1cccc(c1O)N AS05085 [0,1,1,0,0,0|2,0,0]=4 270 B11R1.159 Cc1c(cccc1Br)C(=O)O AS00770 [0,1,1,0,0,0|0,0,0]=2 271 B11R1.159 Cc1c(cccc1Br)[N+](=O)[O-] AS03443 [0,1,1,0,0,0|1,0,1]=4 272 B11R1.159 Cc1c(cccc1Cl)C(=O)O AS02815 [0,1,1,0,0,0|0,0,0]=2 273 B11R1.159 Cc1c(cccc1F)C(=O)O AS01872 [0,1,1,0,0,0|0,0,0]=2 274 B11R1.159 Cc1c(cccc1F)[N+](=O)[O-] AS02077 [0,1,1,0,0,0|1,0,1]=4 275 B11R1.159 Cc1c(cccc1I)C(=O)O AS02263 [0,1,1,0,0,0|0,0,0]=2 276 B11R1.159 Cc1c(cccc1I)[N+](=O)[O-] AS07005 [0,1,1,0,0,0|1,0,1]=4 277 B11R1.159 Cc1c(cccc1N)C(=O)O AS00871 [0,1,1,0,0,0|0,0,0]=2 278 B11R1.159 Cc1c(cccc1O)[N+](=O)[O-] AS00187 [0,1,1,0,0,0|1,0,1]=4 279 B11R1.159 Cc1c(cccc1[N+](=O)[O-])N AS06853 [0,1,1,0,0,0|1,0,1]=4 280 B11R1.159 Cc1cccc(c1Br)C(=O)N AS03421 [0,1,1,0,0,0|2,0,0]=4 281 B11R1.159 Cc1cccc(c1Br)C(=O)O AS03424 [0,1,1,0,0,0|1,0,0]=3 282 B11R1.159 Cc1cccc(c1C)C(=O)C AS01169 [0,1,1,0,0,0|1,0,0]=3 283 B11R1.159 Cc1cccc(c1C)C(=O)N AS00808 [0,1,1,0,0,0|1,0,0]=3 284 B11R1.159 Cc1cccc(c1C)C(=O)O AS01852 [0,1,1,0,0,0|0,0,0]=2 285 B11R1.159 Cc1cccc(c1C)C(=O)O AS06831 [0,1,1,0,0,0|0,0,0]=2 286 B11R1.159 Cc1cccc(c1Cl)C(=O)C AS03847 [0,1,1,0,0,0|2,0,0]=4 287 B11R1.159 Cc1cccc(c1Cl)C(=O)N AS02812 [0,1,1,0,0,0|2,0,0]=4 288 B11R1.159 Cc1cccc(c1Cl)C(=O)O AS02814 [0,1,1,0,0,0|1,0,0]=3 289 B11R1.159 Cc1cccc(c1F)C(=O)O AS01870 [0,1,1,0,0,0|1,0,0]=3 290 B11R1.159 Cc1cccc(c1I)C(=O)N AS02258 [0,1,1,0,0,0|2,0,0]=4 291 B11R1.159 Cc1cccc(c1I)C(=O)O AS02261 [0,1,1,0,0,0|1,0,0]=3 292 B11R1.159 Cc1cccc(c1N)C(=O)C AS05090 [0,1,1,0,0,0|2,0,0]=4 293 B11R1.159 c1cc(c(c(c1)Br)Cl)C(=O)O AS03130 [0,1,1,0,0,0|1,0,0]=3 294 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)N AS03285 [0,1,1,0,0,0|2,0,0]=4 295 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O AS01800 [0,1,1,0,0,0|1,0,0]=3 296 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O AS00988 [0,1,1,0,0,0|1,0,0]=3 297 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O AS06341 [0,1,1,0,0,0|1,0,0]=3 298 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)Cl AS00030 [0,1,1,0,0,0|2,0,0]=4 299 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)O AS00737 [0,1,1,0,0,0|1,0,0]=3 300 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)Cl AS00044 [0,1,1,0,0,0|2,0,0]=4 301 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O AS01827 [0,1,1,0,0,0|1,0,0]=3 302 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O AS00973 [0,1,1,0,0,0|1,0,0]=3 303 B11R1.159 c1cc(c(c(c1)F)Cl)C(=O)O AS00964 [0,1,1,0,0,0|1,0,0]=3 304 B11R1.159 c1cc(c(c(c1)F)F)C(=O)Cl AS00037 [0,1,1,0,0,0|2,0,0]=4 305 B11R1.159 c1cc(c(c(c1)F)F)C(=O)N AS00795 [0,1,1,0,0,0|2,0,0]=4 306 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O AS00860 [0,1,1,0,0,0|1,0,0]=3 307 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O AS00974 [0,1,1,0,0,0|1,0,0]=3 308 B11R1.159 c1cc(c(c(c1)F)N)C(=O)N AS05884 [0,1,1,0,0,0|2,0,0]=4 309 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O AS00981 [0,1,1,0,0,0|1,0,0]=3 310 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O AS01538 [0,1,1,0,0,0|1,0,0]=3 311 B11R1.159 c1cc(c(c(c1)F)O)C(=O)O AS01856 [0,1,1,0,0,0|1,0,0]=3 312 B11R1.159 c1cc(c(c(c1)I)F)C(=O)O AS06843 [0,1,1,0,0,0|1,0,0]=3 313 B11R1.159 c1cc(c(c(c1)I)N)C(=O)O AS00148 [0,1,1,0,0,0|1,0,0]=3 314 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O AS01775 [0,1,1,0,0,0|1,0,0]=3 315 B11R1.159 c1cc(c(c(c1)N)N)C(=O)N AS06874 [0,1,1,0,0,0|2,0,0]=4 316 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O AS00805 [0,1,1,0,0,0|1,0,0]=3 317 B11R1.159 c1cc(c(c(c1)O)Br)C(=O)O AS06314 [0,1,1,0,0,0|1,0,0]=3 318 B11R1.159 c1cc(c(c(c1)O)I)C(=O)O AS06486 [0,1,1,0,0,0|1,0,0]=3 319 B11R1.159 c1cnc(c(c1C(=O)O)F)Cl AS04807 [0,1,1,0,0,0|2,0,0]=4 320 B11R1.166 B(c1ccc(cc1C)C)(O)O AS04994 [0,1,1,0,0,0|1,0,1]=4 321 B11R1.166 B(c1ccc(cc1C)O)(O)O AS07187 [0,1,1,0,0,0|1,0,1]=4 322 B11R1.166 CC(=O)c1ccc(cc1Br)Br AS03852 [0,1,1,0,0,0|2,0,0]=4 323 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01149 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01174 [0,1,1,0,0,0|2,0,0]=4 325 B11R1.166 CC(=O)c1ccc(cc1Br)N AS05248 [0,1,1,0,0,0|2,0,0]=4 326 B11R1.166 CC(=O)c1ccc(cc1Br)O AS05117 [0,1,1,0,0,0|2,0,0]=4 327 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl AS03861 [0,1,1,0,0,0|2,0,0]=4 328 B11R1.166 CC(=O)c1ccc(cc1Cl)F AS04025 [0,1,1,0,0,0|2,0,0]=4 329 B11R1.166 CC(=O)c1ccc(cc1Cl)N AS05072 [0,1,1,0,0,0|2,0,0]=4 330 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05144 [0,1,1,0,0,0|2,0,0]=4 331 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05258 [0,1,1,0,0,0|2,0,0]=4 332 B11R1.166 CC(=O)c1ccc(cc1F)Br AS01131 [0,1,1,0,0,0|2,0,0]=4 333 B11R1.166 CC(=O)c1ccc(cc1F)Cl AS04005 [0,1,1,0,0,0|2,0,0]=4 334 B11R1.166 CC(=O)c1ccc(cc1F)F AS01190 [0,1,1,0,0,0|2,0,0]=4 335 B11R1.166 CC(=O)c1ccc(cc1F)O AS01200 [0,1,1,0,0,0|2,0,0]=4 336 B11R1.166 CC(=O)c1ccc(cc1N)F AS06564 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.166 CC(=O)c1ccc(cc1O)Cl AS05146 [0,1,1,0,0,0|2,0,0]=4 338 B11R1.166 CC(=O)c1ccc(cc1O)F AS01201 [0,1,1,0,0,0|2,0,0]=4 339 B11R1.166 CC(=O)c1ccc(cc1O)N AS05250 [0,1,1,0,0,0|2,0,0]=4 340 B11R1.166 CC(=O)c1ccc(cc1O)O AS01140 [0,1,1,0,0,0|2,0,0]=4 341 B11R1.166 Cc1cc(ccc1C(=O)C)Cl AS05148 [0,1,1,0,0,0|1,0,0]=3 342 B11R1.166 Cc1cc(ccc1C(=O)C)F AS01144 [0,1,1,0,0,0|1,0,0]=3 343 B11R1.166 Cc1cc(ccc1C(=O)C)F AS03900 [0,1,1,0,0,0|1,0,0]=3 344 B11R1.166 Cc1cc(ccc1C(=O)C)O AS04594 [0,1,1,0,0,0|1,0,0]=3 345 B11R1.166 Cc1cc(ccc1C(=O)O)Br AS01811 [0,1,1,0,0,0|0,0,0]=2 346 B11R1.166 Cc1cc(ccc1C(=O)O)Cl AS00772 [0,1,1,0,0,0|0,0,0]=2 347 B11R1.166 Cc1cc(ccc1C(=O)O)F AS01874 [0,1,1,0,0,0|0,0,0]=2 348 B11R1.166 Cc1cc(ccc1C(=O)O)F AS04999 [0,1,1,0,0,0|0,0,0]=2 349 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])Cl AS06939 [0,1,1,0,0,0|1,0,1]=4 350 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F AS02081 [0,1,1,0,0,0|1,0,1]=4 351 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])O AS00180 [0,1,1,0,0,0|1,0,1]=4 352 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O AS00875 [0,1,1,0,0,0|1,0,0]=3 353 B11R1.166 Cc1ccc(c(c1)C)C(=O)Cl AS00021 [0,1,1,0,0,0|1,0,0]=3 354 B11R1.166 Cc1ccc(c(c1)C)C(=O)O AS03894 [0,1,1,0,0,0|0,0,0]=2 355 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O AS00152 [0,1,1,0,0,0|1,0,0]=3 356 B11R1.166 Cc1ccc(c(c1)F)C(=O)O AS00764 [0,1,1,0,0,0|1,0,0]=3 357 B11R1.166 Cc1ccc(c(c1)N)C(=O)O AS00771 [0,1,1,0,0,0|1,0,0]=3 358 B11R1.166 Cc1ccc(c(c1)O)C(=O)C AS05195 [0,1,1,0,0,0|2,0,0]=4 359 B11R1.166 c1cc(c(cc1Br)Br)C(=O)N AS05890 [0,1,1,0,0,0|2,0,0]=4 360 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O AS03514 [0,1,1,0,0,0|1,0,0]=3 361 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O AS01793 [0,1,1,0,0,0|1,0,0]=3 362 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O AS03132 [0,1,1,0,0,0|1,0,0]=3 363 B11R1.166 c1cc(c(cc1Br)F)C(=O)Cl AS00047 [0,1,1,0,0,0|2,0,0]=4 364 B11R1.166 c1cc(c(cc1Br)F)C(=O)O AS03290 [0,1,1,0,0,0|1,0,0]=3 365 B11R1.166 c1cc(c(cc1Br)I)C(=O)O AS00147 [0,1,1,0,0,0|1,0,0]=3 366 B11R1.166 c1cc(c(cc1Br)N)C(=O)O AS00990 [0,1,1,0,0,0|1,0,0]=3 367 B11R1.166 c1cc(c(cc1Br)O)C(=O)N AS03343 [0,1,1,0,0,0|2,0,0]=4 368 B11R1.166 c1cc(c(cc1Br)O)C(=O)O AS00769 [0,1,1,0,0,0|1,0,0]=3 369 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O AS03128 [0,1,1,0,0,0|1,0,0]=3 370 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O AS00780 [0,1,1,0,0,0|1,0,0]=3 371 B11R1.166 c1cc(c(cc1Cl)F)C(=O)Cl AS00041 [0,1,1,0,0,0|2,0,0]=4 372 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O AS02730 [0,1,1,0,0,0|1,0,0]=3 373 B11R1.166 c1cc(c(cc1Cl)I)C(=O)O AS03067 [0,1,1,0,0,0|1,0,0]=3 374 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N AS05883 [0,1,1,0,0,0|2,0,0]=4 375 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O AS00756 [0,1,1,0,0,0|1,0,0]=3 376 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O AS02762 [0,1,1,0,0,0|1,0,0]=3 377 B11R1.166 c1cc(c(cc1F)Br)C(=O)Cl AS00048 [0,1,1,0,0,0|2,0,0]=4 378 B11R1.166 c1cc(c(cc1F)Br)C(=O)O AS00970 [0,1,1,0,0,0|1,0,0]=3 379 B11R1.166 c1cc(c(cc1F)Cl)C(=O)Cl AS00039 [0,1,1,0,0,0|2,0,0]=4 380 B11R1.166 c1cc(c(cc1F)Cl)C(=O)O AS00965 [0,1,1,0,0,0|1,0,0]=3 381 B11R1.166 c1cc(c(cc1F)F)C(=O)Cl AS00033 [0,1,1,0,0,0|2,0,0]=4 382 B11R1.166 c1cc(c(cc1F)F)C(=O)N AS00796 [0,1,1,0,0,0|2,0,0]=4 383 B11R1.166 c1cc(c(cc1F)F)C(=O)O AS00811 [0,1,1,0,0,0|1,0,0]=3 384 B11R1.166 c1cc(c(cc1F)F)C(=O)[O-] AS00779 [0,1,1,0,0,0|1,0,1]=4 385 B11R1.166 c1cc(c(cc1F)I)C(=O)O AS00944 [0,1,1,0,0,0|1,0,0]=3 386 B11R1.166 c1cc(c(cc1F)N)C(=O)O AS00975 [0,1,1,0,0,0|1,0,0]=3 387 B11R1.166 c1cc(c(cc1F)O)C(=O)O AS01858 [0,1,1,0,0,0|1,0,0]=3 388 B11R1.166 c1cc(c(cc1I)Cl)C(=O)O AS03064 [0,1,1,0,0,0|1,0,0]=3 389 B11R1.166 c1cc(c(cc1I)F)C(=O)O AS01860 [0,1,1,0,0,0|1,0,0]=3 390 B11R1.166 c1cc(c(cc1I)O)C(=O)O AS02196 [0,1,1,0,0,0|1,0,0]=3 391 B11R1.166 c1cc(c(cc1N)F)C(=O)O AS01776 [0,1,1,0,0,0|1,0,0]=3 392 B11R1.166 c1cc(c(cc1O)F)C(=O)O AS01854 [0,1,1,0,0,0|1,0,0]=3 393 B11R1.166 c1cc(c(cc1O)I)C(=O)O AS06293 [0,1,1,0,0,0|1,0,0]=3 394 B11R1.166 c1cc(c(cc1O)O)C(=O)O AS00962 [0,1,1,0,0,0|1,0,0]=3 395 B11R1.167 CC(=O)c1cc(ccc1Br)Br AS03853 [0,1,1,0,0,0|2,0,0]=4 396 B11R1.167 CC(=O)c1cc(ccc1Br)F AS04021 [0,1,1,0,0,0|2,0,0]=4 397 B11R1.167 CC(=O)c1cc(ccc1Cl)Br AS01133 [0,1,1,0,0,0|2,0,0]=4 398 B11R1.167 CC(=O)c1cc(ccc1Cl)Br AS03788 [0,1,1,0,0,0|2,0,0]=4 399 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl AS03862 [0,1,1,0,0,0|2,0,0]=4 400 B11R1.167 CC(=O)c1cc(ccc1Cl)F AS05136 [0,1,1,0,0,0|2,0,0]=4 401 B11R1.167 CC(=O)c1cc(ccc1F)Br AS05112 [0,1,1,0,0,0|2,0,0]=4 402 B11R1.167 CC(=O)c1cc(ccc1F)F AS01191 [0,1,1,0,0,0|2,0,0]=4 403 B11R1.167 CC(=O)c1cc(ccc1F)N AS05083 [0,1,1,0,0,0|2,0,0]=4 404 B11R1.167 CC(=O)c1cc(ccc1F)O AS05186 [0,1,1,0,0,0|2,0,0]=4 405 B11R1.167 CC(=O)c1cc(ccc1I)F AS04405 [0,1,1,0,0,0|2,0,0]=4 406 B11R1.167 CC(=O)c1cc(ccc1I)F AS07228 [0,1,1,0,0,0|2,0,0]=4 407 B11R1.167 CC(=O)c1cc(ccc1N)Br AS05066 [0,1,1,0,0,0|2,0,0]=4 408 B11R1.167 CC(=O)c1cc(ccc1O)Br AS01134 [0,1,1,0,0,0|2,0,0]=4 409 B11R1.167 CC(=O)c1cc(ccc1O)Cl AS03839 [0,1,1,0,0,0|2,0,0]=4 410 B11R1.167 CC(=O)c1cc(ccc1O)F AS01202 [0,1,1,0,0,0|2,0,0]=4 411 B11R1.167 CC(=O)c1cc(ccc1O)N AS05086 [0,1,1,0,0,0|2,0,0]=4 412 B11R1.167 CC(=O)c1cc(ccc1O)O AS05179 [0,1,1,0,0,0|2,0,0]=4 413 B11R1.167 Cc1ccc(c(c1)C(=O)C)F AS01155 [0,1,1,0,0,0|2,0,0]=4 414 B11R1.167 Cc1ccc(c(c1)C(=O)Cl)F AS00025 [0,1,1,0,0,0|2,0,0]=4 415 B11R1.167 Cc1ccc(c(c1)C(=O)N)N AS05885 [0,1,1,0,0,0|2,0,0]=4 416 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br AS03425 [0,1,1,0,0,0|1,0,0]=3 417 B11R1.167 Cc1ccc(c(c1)C(=O)O)C AS00745 [0,1,1,0,0,0|0,0,0]=2 418 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl AS00923 [0,1,1,0,0,0|1,0,0]=3 419 B11R1.167 Cc1ccc(c(c1)C(=O)O)F AS01871 [0,1,1,0,0,0|1,0,0]=3 420 B11R1.167 Cc1ccc(c(c1)C(=O)O)I AS02262 [0,1,1,0,0,0|1,0,0]=3 421 B11R1.167 Cc1ccc(c(c1)C(=O)O)N AS00870 [0,1,1,0,0,0|1,0,0]=3 422 B11R1.167 Cc1ccc(cc1C(=O)C)F AS01179 [0,1,1,0,0,0|1,0,0]=3 423 B11R1.167 Cc1ccc(cc1C(=O)O)Br AS03427 [0,1,1,0,0,0|0,0,0]=2 424 B11R1.167 Cc1ccc(cc1C(=O)O)Cl AS02816 [0,1,1,0,0,0|0,0,0]=2 425 B11R1.167 Cc1ccc(cc1C(=O)O)F AS02485 [0,1,1,0,0,0|0,0,0]=2 426 B11R1.167 Cc1ccc(cc1C(=O)O)F AS05000 [0,1,1,0,0,0|0,0,0]=2 427 B11R1.167 Cc1ccc(cc1C(=O)O)I AS00855 [0,1,1,0,0,0|0,0,0]=2 428 B11R1.167 Cc1ccc(cc1C(=O)O)N AS01782 [0,1,1,0,0,0|0,0,0]=2 429 B11R1.167 Cc1ccc(cc1C(=O)O)O AS06485 [0,1,1,0,0,0|0,0,0]=2 430 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])Br AS02045 [0,1,1,0,0,0|1,0,1]=4 431 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])Cl AS06857 [0,1,1,0,0,0|1,0,1]=4 432 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])F AS02080 [0,1,1,0,0,0|1,0,1]=4 433 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])I AS02330 [0,1,1,0,0,0|1,0,1]=4 434 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])N AS06938 [0,1,1,0,0,0|1,0,1]=4 435 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])O AS05506 [0,1,1,0,0,0|1,0,1]=4 436 B11R1.167 c1c(cnc(c1C(=O)O)F)Cl AS04824 [0,1,1,0,0,0|2,0,0]=4 437 B11R1.167 c1cc(c(cc1Br)C(=O)N)Br AS03511 [0,1,1,0,0,0|2,0,0]=4 438 B11R1.167 c1cc(c(cc1Br)C(=O)N)Cl AS03125 [0,1,1,0,0,0|2,0,0]=4 439 B11R1.167 c1cc(c(cc1Br)C(=O)N)I AS03359 [0,1,1,0,0,0|2,0,0]=4 440 B11R1.167 c1cc(c(cc1Br)C(=O)O)Br AS03515 [0,1,1,0,0,0|1,0,0]=3 441 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl AS00872 [0,1,1,0,0,0|1,0,0]=3 442 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl AS03133 [0,1,1,0,0,0|1,0,0]=3 443 B11R1.167 c1cc(c(cc1Br)C(=O)O)F AS03291 [0,1,1,0,0,0|1,0,0]=3 444 B11R1.167 c1cc(c(cc1Br)C(=O)O)I AS00873 [0,1,1,0,0,0|1,0,0]=3 445 B11R1.167 c1cc(c(cc1Br)C(=O)O)N AS00984 [0,1,1,0,0,0|1,0,0]=3 446 B11R1.167 c1cc(c(cc1Br)C(=O)O)O AS03670 [0,1,1,0,0,0|1,0,0]=3 447 B11R1.167 c1cc(c(cc1Cl)C(=O)Cl)F AS00043 [0,1,1,0,0,0|2,0,0]=4 448 B11R1.167 c1cc(c(cc1Cl)C(=O)N)Cl AS02859 [0,1,1,0,0,0|2,0,0]=4 449 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Br AS00799 [0,1,1,0,0,0|1,0,0]=3 450 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Cl AS00768 [0,1,1,0,0,0|1,0,0]=3 451 B11R1.167 c1cc(c(cc1Cl)C(=O)O)F AS02960 [0,1,1,0,0,0|1,0,0]=3 452 B11R1.167 c1cc(c(cc1Cl)C(=O)O)I AS00876 [0,1,1,0,0,0|1,0,0]=3 453 B11R1.167 c1cc(c(cc1Cl)C(=O)O)N AS01120 [0,1,1,0,0,0|1,0,0]=3 454 B11R1.167 c1cc(c(cc1F)C(=O)Cl)Br AS00049 [0,1,1,0,0,0|2,0,0]=4 455 B11R1.167 c1cc(c(cc1F)C(=O)Cl)Cl AS00042 [0,1,1,0,0,0|2,0,0]=4 456 B11R1.167 c1cc(c(cc1F)C(=O)Cl)F AS00036 [0,1,1,0,0,0|2,0,0]=4 457 B11R1.167 c1cc(c(cc1F)C(=O)O)Br AS00971 [0,1,1,0,0,0|1,0,0]=3 458 B11R1.167 c1cc(c(cc1F)C(=O)O)Cl AS00967 [0,1,1,0,0,0|1,0,0]=3 459 B11R1.167 c1cc(c(cc1F)C(=O)O)F AS00859 [0,1,1,0,0,0|1,0,0]=3 460 B11R1.167 c1cc(c(cc1F)C(=O)O)I AS01863 [0,1,1,0,0,0|1,0,0]=3 461 B11R1.167 c1cc(c(cc1F)C(=O)O)N AS00978 [0,1,1,0,0,0|1,0,0]=3 462 B11R1.167 c1cc(c(cc1F)C(=O)O)O AS01286 [0,1,1,0,0,0|1,0,0]=3 463 B11R1.167 c1cc(c(cc1F)C(=O)[O-])F AS00774 [0,1,1,0,0,0|1,0,1]=4 464 B11R1.167 c1cc(c(cc1I)C(=O)N)Cl AS03059 [0,1,1,0,0,0|2,0,0]=4 465 B11R1.167 c1cc(c(cc1I)C(=O)N)O AS02195 [0,1,1,0,0,0|2,0,0]=4 466 B11R1.167 c1cc(c(cc1I)C(=O)O)Br AS03363 [0,1,1,0,0,0|1,0,0]=3 467 B11R1.167 c1cc(c(cc1I)C(=O)O)Cl AS03065 [0,1,1,0,0,0|1,0,0]=3 468 B11R1.167 c1cc(c(cc1I)C(=O)O)F AS02181 [0,1,1,0,0,0|1,0,0]=3 469 B11R1.167 c1cc(c(cc1I)C(=O)O)I AS02131 [0,1,1,0,0,0|1,0,0]=3 470 B11R1.167 c1cc(c(cc1I)C(=O)O)N AS02983 [0,1,1,0,0,0|1,0,0]=3 471 B11R1.167 c1cc(c(cc1I)C(=O)O)O AS02197 [0,1,1,0,0,0|1,0,0]=3 472 B11R1.167 c1cc(c(cc1N)C(=O)O)Br AS01769 [0,1,1,0,0,0|1,0,0]=3 473 B11R1.167 c1cc(c(cc1N)C(=O)O)Cl AS01771 [0,1,1,0,0,0|1,0,0]=3 474 B11R1.167 c1cc(c(cc1N)C(=O)O)F AS00979 [0,1,1,0,0,0|1,0,0]=3 475 B11R1.167 c1cc(c(cc1O)C(=O)O)F AS01285 [0,1,1,0,0,0|1,0,0]=3 476 B11R1.167 c1cc(c(cc1O)C(=O)O)O AS04641 [0,1,1,0,0,0|1,0,0]=3 477 B11R1.167 c1cc(c(cc1O)C(=O)[O-])O AS04440 [0,1,1,0,0,0|1,0,1]=4 478 B11R1.167 c1cc(nc(c1Cl)C(=O)O)Br AS04698 [0,1,1,0,0,0|2,0,0]=4 479 B11R2.36 Cc1ccc2c(c1)cco2 AS06433 [1,1,0,0,0,0|2,0,0]=4 480 B11R2.36 Cc1ccc2ccsc2c1 AS06413 [1,1,0,0,0,0|2,0,0]=4 481 B11R2.36 c1cc(cc2c1cc[nH]2)F AS02103 [1,1,0,0,0,0|2,0,0]=4 482 B11R2.36 c1cc(cc2c1cco2)O AS06445 [1,1,0,0,0,0|2,0,0]=4 483 B11R2.36 c1cc(cc2c1ccs2)Br AS06370 [1,1,0,0,0,0|2,0,0]=4 484 B11R2.36 c1cc2c(cc1Br)CCO2 AS06345 [1,1,0,0,0,0|2,0,0]=4 485 B11R2.36 c1cc2c(cc1Br)OCC2 AS06451 [1,1,0,0,0,0|2,0,0]=4 486 B11R2.36 c1cc2c(cc1I)CCO2 AS06344 [1,1,0,0,0,0|2,0,0]=4 487 B11R2.36 c1cc2c(cc1N)CCO2 AS06343 [1,1,0,0,0,0|2,0,0]=4 488 B11R2.36 c1cc2c(cc[nH]2)cc1F AS02102 [1,1,0,0,0,0|2,0,0]=4 489 B11R2.36 c1cc2c(cco2)cc1Br AS06418 [1,1,0,0,0,0|2,0,0]=4 490 B11R2.36 c1cc2c(cco2)cc1Cl AS06428 [1,1,0,0,0,0|2,0,0]=4 491 B11R2.36 c1cc2c(cco2)cc1F AS06429 [1,1,0,0,0,0|2,0,0]=4 492 B11R2.36 c1cc2c(ccs2)cc1Br AS06396 [1,1,0,0,0,0|2,0,0]=4 493 B11R2.106 Cc1cccc2c1ccs2 AS06380 [1,1,0,0,0,0|2,0,0]=4 494 B11R2.106 Cc1cccc2c1occ2 AS06434 [1,1,0,0,0,0|2,0,0]=4 495 B11R2.106 c1cc(c2ccoc2c1)O AS06427 [1,1,0,0,0,0|2,0,0]=4 496 B11R2.106 c1cc(c2ccsc2c1)F AS06415 [1,1,0,0,0,0|2,0,0]=4 497 B11R2.106 c1cc2c(c(c1)F)CCN2 AS06054 [1,1,0,0,0,0|2,0,0]=4 498 B11R2.106 c1cc2c(cc[nH]2)c(c1)F AS02112 [1,1,0,0,0,0|2,0,0]=4 499 B11R2.106 c1cc2c(ccs2)c(c1)Br AS06414 [1,1,0,0,0,0|2,0,0]=4 500 B11R2.106 c1cc2cc[nH]c2c(c1)F AS02114 [1,1,0,0,0,0|2,0,0]=4 501 B11R2.106 c1cc2ccoc2c(c1)Br AS06376 [1,1,0,0,0,0|2,0,0]=4 502 B11R2.106 c1cc2ccoc2c(c1)Cl AS06439 [1,1,0,0,0,0|2,0,0]=4 503 B11R2.106 c1cc2ccoc2c(c1)F AS06440 [1,1,0,0,0,0|2,0,0]=4 504 B13R2.155 c1cc2c(cc1Br)NC(=O)CO2 AS06318 [0,1,0,0,0,1|2,0,0]=4 505 B13R2.155 c1cc2c(cc1Cl)NC(=O)CO2 AS06308 [0,1,0,0,0,1|2,0,0]=4 506 B13R2.155 c1cc2c(cc1O)NC(=O)CO2 AS06389 [0,1,0,0,0,1|2,0,0]=4 507 B13R2.162 c1cc2c(c(c1)F)NC(=O)CO2 AS06288 [0,1,0,0,0,1|2,0,0]=4 508 B13R2.3683 c1cc2c(cc1Br)OCC(=O)N2 AS06276 [0,1,0,0,0,1|2,0,0]=4 509 B13R2.3683 c1cc2c(cc1F)OCC(=O)N2 AS06337 [0,1,0,0,0,1|2,0,0]=4 510 B13R2.3683 c1cc2c(cc1O)OCC(=O)N2 AS06333 [0,1,0,0,0,1|2,0,0]=4 511 B13R2.5179 c1cc2c(c(c1)O)OCC(=O)N2 AS06393 [0,1,0,0,0,1|2,0,0]=4 512 B13R2.342 c1cc2c(c(c1)O)CCCC2=O AS02947 [0,1,0,0,0,1|1,0,0]=3 513 B13R2.72 c1ccc2c(c1)c(c[nH]2)C(=O)O AS06042 [0,2,0,0,0,0|2,0,0]=4 514 B13R2.72 c1ccc2c(c1)c(cs2)C(=O)O AS06612 [0,2,0,0,0,0|2,0,0]=4 515 B13R2.2136 c1cc2c(cc1Br)c(co2)C=O AS06349 [0,2,0,0,0,0|2,0,0]=4 516 B13R2.3028 c1cc2c(cc1Br)C(=O)C(=O)N2 AS04548 [0,2,0,0,0,0|2,0,0]=4 517 B13R2.3028 c1cc2c(cc1Cl)C(=O)C(=O)N2 AS06263 [0,2,0,0,0,0|2,0,0]=4 518 B13R2.3028 c1cc2c(cc1F)C(=O)C(=O)N2 AS05050 [0,2,0,0,0,0|2,0,0]=4 519 B13R2.4825 c1cc2c(c(c1)F)NC(=O)C2=O AS02428 [0,2,0,0,0,0|2,0,0]=4 520 B13R2.3742 c1c(cc(c2c1C(=O)CO2)Cl)Cl AS06450 [0,2,0,0,0,0|2,0,0]=4 521 B13R2.5187 c1cc2c(cc1Cl)C(=O)OC2=O AS07188 [0,2,0,0,0,0|0,0,1]=3 522 B13R2.5187 c1cc2c(cc1F)C(=O)OC2=O AS02025 [0,2,0,0,0,0|0,0,1]=3 523 B13R2.4857 Cc1cccc2c1C(=O)OC2=O AS06169 [0,2,0,0,0,0|0,0,1]=3 524 B13R2.4857 c1cc2c(c(c1)Cl)C(=O)OC2=O AS07189 [0,2,0,0,0,0|0,0,1]=3 525 B13R2.4857 c1cc2c(c(c1)F)C(=O)OC2=O AS02023 [0,2,0,0,0,0|0,0,1]=3 526 B9R1.11 COC(=O)c1c[nH]nc1 AS07234 [0,0,1,0,1,0|2,0,0]=4 527 B11R1.86 CC(=O)Cc1ccccc1Br AS05236 [0,0,1,0,0,1|2,0,0]=4 528 B11R1.86 CC(=O)Nc1ccccc1I AS02199 [0,0,1,0,0,1|2,0,0]=4 529 B11R1.86 CC(=O)Nc1ccccc1O AS00888 [0,0,1,0,0,1|2,0,0]=4 530 B11R1.86 CC(=O)Oc1ccccc1Br AS02339 [0,0,1,0,0,1|2,0,0]=4 531 B11R1.86 CC(=O)Oc1ccccc1F AS02345 [0,0,1,0,0,1|2,0,0]=4 532 B11R1.86 CC(=O)Oc1ccccc1I AS02979 [0,0,1,0,0,1|2,0,0]=4 533 B11R1.86 Cc1ccccc1NC(=O)C AS00877 [0,0,1,0,0,1|1,0,0]=3 534 B11R1.86 c1ccc(c(c1)CC(=O)O)Br AS00524 [0,0,1,0,0,1|1,0,0]=3 535 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl AS05022 [0,0,1,0,0,1|1,0,0]=3 536 B11R1.86 c1ccc(c(c1)CC(=O)O)F AS00497 [0,0,1,0,0,1|1,0,0]=3 537 B11R1.86 c1ccc(c(c1)CC(=O)O)I AS00532 [0,0,1,0,0,1|1,0,0]=3 538 B13R2.33 c1ccc2c(c1)CCC(=O)CC2 AS06277 [0,0,0,0,0,2|1,0,0]=3 539 B13R2.5252 c1ccc2c(c1)C(=O)CCCN2 AS06635 [0,0,0,0,0,2|1,0,0]=3