0 B11R1.605 c1cc(c(c(c1)Cl)CC#N)Cl AS01962 [0,0,0,0,0,0|0,1,2]=3 1 B11R1.605 c1cc(c(c(c1)Cl)N=C=O)Cl AS04398 [0,0,0,0,0,0|2,1,1]=4 2 B11R1.605 c1cc(c(c(c1)Cl)N=C=S)F AS04460 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.605 c1cc(c(c(c1)F)CC#N)F AS01965 [0,0,0,0,0,0|0,1,2]=3 4 B11R1.605 c1cc(c(c(c1)F)N=C=O)F AS00725 [0,0,0,0,0,0|2,1,1]=4 5 B11R1.605 c1cc(c(c(c1)F)N=C=S)F AS00360 [0,0,0,0,0,0|2,1,1]=4 6 B10R1.4 CCOc1ccccc1Br AS03446 [1,0,0,0,0,0|2,1,0]=4 7 B10R1.4 CCOc1ccccc1C AS07155 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.4 CCOc1ccccc1F AS02636 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.4 CCOc1ccccc1N AS01513 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.4 COCc1ccccc1Br AS03400 [1,0,0,0,0,0|2,1,0]=4 11 B10R1.4 COCc1ccccc1Br AS03402 [1,0,0,0,0,0|2,1,0]=4 12 B10R1.4 Cc1ccccc1CC#N AS01367 [1,0,0,0,0,0|1,0,2]=4 13 B10R1.4 c1ccc(c(c1)C=NO)F AS00301 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.4 c1ccc(c(c1)CC#N)Br AS01641 [1,0,0,0,0,0|0,1,2]=4 15 B10R1.4 c1ccc(c(c1)CC#N)F AS01388 [1,0,0,0,0,0|0,0,2]=3 16 B10R1.4 c1ccc(c(c1)CC#N)I AS01645 [1,0,0,0,0,0|0,1,2]=4 17 B10R1.4 c1ccc(c(c1)CC#N)N AS06069 [1,0,0,0,0,0|1,0,2]=4 18 B10R1.4 c1ccc(c(c1)CCBr)F AS02432 [1,0,0,0,0,0|1,0,0]=2 19 B10R1.4 c1ccc(c(c1)CCN)F AS00483 [1,0,0,0,0,0|0,0,0]=1 20 B10R1.4 c1ccc(c(c1)CCO)Br AS06007 [1,0,0,0,0,0|1,1,0]=3 21 B10R1.4 c1ccc(c(c1)CCO)Cl AS00582 [1,0,0,0,0,0|1,0,0]=2 22 B10R1.4 c1ccc(c(c1)CCO)F AS00577 [1,0,0,0,0,0|1,0,0]=2 23 B10R1.4 c1ccc(c(c1)N=C=O)Cl AS04125 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.4 c1ccc(c(c1)N=C=O)F AS00717 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.4 c1ccc(c(c1)N=C=S)F AS00353 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.245 CCc1c(cccc1O)N AS06592 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.245 COc1c(cccc1Br)Br AS04210 [1,0,0,0,0,0|1,2,0]=4 28 B10R1.245 COc1c(cccc1Br)F AS01362 [1,0,0,0,0,0|1,1,0]=3 29 B10R1.245 COc1c(cccc1Br)N AS04318 [1,0,0,0,0,0|2,1,0]=4 30 B10R1.245 COc1c(cccc1Br)O AS06582 [1,0,0,0,0,0|2,1,0]=4 31 B10R1.245 COc1c(cccc1Cl)Cl AS02856 [1,0,0,0,0,0|1,1,0]=3 32 B10R1.245 COc1c(cccc1Cl)F AS04322 [1,0,0,0,0,0|1,0,0]=2 33 B10R1.245 COc1c(cccc1Cl)O AS06537 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.245 COc1c(cccc1F)F AS01806 [1,0,0,0,0,0|1,1,0]=3 35 B10R1.245 COc1c(cccc1F)N AS04084 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.245 COc1c(cccc1I)F AS01394 [1,0,0,0,0,0|1,1,0]=3 37 B10R1.245 CSc1c(cccc1Br)O AS06501 [1,0,0,0,0,0|2,1,0]=4 38 B10R1.245 Cc1cccc(c1C#N)Cl AS05821 [1,0,0,0,0,0|1,0,2]=4 39 B10R1.245 Cc1cccc(c1C#N)F AS01681 [1,0,0,0,0,0|1,0,2]=4 40 B10R1.245 Cc1cccc(c1C=O)Cl AS04631 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.245 Cc1cccc(c1C=O)F AS04975 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.245 Cc1cccc(c1CBr)C AS02056 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.245 Cc1cccc(c1CCl)C AS00711 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.245 Cc1cccc(c1OC)C AS02543 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.245 Cc1cccc(c1OC)Cl AS04240 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.245 c1cc(c(c(c1)Br)C#N)Cl AS05794 [1,0,0,0,0,0|0,1,2]=4 47 B10R1.245 c1cc(c(c(c1)Br)C#N)F AS01622 [1,0,0,0,0,0|0,1,2]=4 48 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl AS04968 [1,0,0,0,0,0|1,1,1]=4 49 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl AS05527 [1,0,0,0,0,0|1,1,1]=4 50 B10R1.245 c1cc(c(c(c1)Br)C=O)F AS03800 [1,0,0,0,0,0|1,1,1]=4 51 B10R1.245 c1cc(c(c(c1)Cl)C#N)Cl AS02651 [1,0,0,0,0,0|0,1,2]=4 52 B10R1.245 c1cc(c(c(c1)Cl)C#N)F AS02661 [1,0,0,0,0,0|0,0,2]=3 53 B10R1.245 c1cc(c(c(c1)Cl)C#N)N AS01597 [1,0,0,0,0,0|1,0,2]=4 54 B10R1.245 c1cc(c(c(c1)Cl)C#N)N AS06492 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.245 c1cc(c(c(c1)Cl)C#N)O AS05816 [1,0,0,0,0,0|1,0,2]=4 56 B10R1.245 c1cc(c(c(c1)Cl)C=O)F AS03022 [1,0,0,0,0,0|1,0,1]=3 57 B10R1.245 c1cc(c(c(c1)Cl)C=O)O AS05552 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.245 c1cc(c(c(c1)Cl)CBr)Cl AS01829 [1,0,0,0,0,0|1,1,0]=3 59 B10R1.245 c1cc(c(c(c1)Cl)CBr)F AS00683 [1,0,0,0,0,0|1,0,0]=2 60 B10R1.245 c1cc(c(c(c1)Cl)CCl)Cl AS00007 [1,0,0,0,0,0|1,1,0]=3 61 B10R1.245 c1cc(c(c(c1)Cl)CCl)F AS00672 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.245 c1cc(c(c(c1)Cl)CN)F AS02306 [1,0,0,0,0,0|0,0,0]=1 63 B10R1.245 c1cc(c(c(c1)Cl)CN)F AS02738 [1,0,0,0,0,0|0,0,0]=1 64 B10R1.245 c1cc(c(c(c1)Cl)CO)Cl AS00606 [1,0,0,0,0,0|1,1,0]=3 65 B10R1.245 c1cc(c(c(c1)Cl)CO)F AS03967 [1,0,0,0,0,0|1,0,0]=2 66 B10R1.245 c1cc(c(c(c1)F)C#N)F AS02658 [1,0,0,0,0,0|0,1,2]=4 67 B10R1.245 c1cc(c(c(c1)F)C#N)N AS01604 [1,0,0,0,0,0|1,0,2]=4 68 B10R1.245 c1cc(c(c(c1)F)C#N)O AS01676 [1,0,0,0,0,0|1,0,2]=4 69 B10R1.245 c1cc(c(c(c1)F)C=O)F AS01453 [1,0,0,0,0,0|1,1,1]=4 70 B10R1.245 c1cc(c(c(c1)F)C=O)O AS03081 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.245 c1cc(c(c(c1)F)CBr)F AS00704 [1,0,0,0,0,0|1,1,0]=3 72 B10R1.245 c1cc(c(c(c1)F)CCl)F AS00689 [1,0,0,0,0,0|1,1,0]=3 73 B10R1.245 c1cc(c(c(c1)F)CN)F AS02302 [1,0,0,0,0,0|0,1,0]=2 74 B10R1.245 c1cc(c(c(c1)F)CO)F AS00613 [1,0,0,0,0,0|1,1,0]=3 75 B10R1.245 c1cc(c(c(c1)F)NN)F AS02002 [1,0,0,0,0,0|1,1,0]=3 76 B10R1.245 c1cc(c(c(c1)F)NN)F AS06154 [1,0,0,0,0,0|1,1,0]=3 77 B10R1.245 c1cc(c(c(c1)I)C#N)Cl AS05819 [1,0,0,0,0,0|0,1,2]=4 78 B10R1.245 c1cc(c(c(c1)I)C#N)F AS02670 [1,0,0,0,0,0|0,1,2]=4 79 B10R1.245 c1cc(c(c(c1)I)C=O)F AS03885 [1,0,0,0,0,0|1,1,1]=4 80 B10R1.245 c1cc(c(c(c1)I)CO)F AS05973 [1,0,0,0,0,0|1,1,0]=3 81 B10R1.245 c1cnc(c(c1I)CO)F AS04840 [1,0,0,0,0,0|2,1,0]=4 82 B12R1.497 c1cc(c(c(c1F)CC#N)F)F AS02365 [0,1,0,0,0,0|0,1,2]=4 83 B12R1.1009 c1cc(c(c(c1)Cl)CC(=O)O)F AS00537 [0,1,0,0,0,0|1,0,1]=3 84 B12R1.1009 c1cc(c(c(c1)Cl)NC(=S)N)Cl AS02414 [0,1,0,0,0,0|1,1,1]=4 85 B12R1.1009 c1cc(c(c(c1)F)CC(=O)O)F AS02172 [0,1,0,0,0,0|1,1,1]=4 86 B12R1.1095 CCOc1c(cc(cc1F)Br)F AS07038 [0,1,0,0,0,0|2,1,0]=4 87 B12R1.1095 c1c(cc(c(c1F)CC#N)F)F AS01981 [0,1,0,0,0,0|0,1,2]=4 88 B12R1.1095 c1c(cc(c(c1F)CC#N)F)F AS02367 [0,1,0,0,0,0|0,1,2]=4 89 B12R1.1112 COc1cccc(c1CC#N)F AS02331 [0,1,0,0,0,0|1,0,2]=4 90 B12R1.1112 c1cc(c(c(c1)F)OCBr)C#N AS02371 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.3441 CC(c1c(cccc1Cl)Cl)NN AS07050 [0,1,0,0,0,0|1,1,0]=3 92 B12R1.3441 c1cc(c(c(c1)F)C(=O)CBr)F AS05253 [0,1,0,0,0,0|1,1,1]=4 93 B12R2.202 c1cc2c(c(c1)F)CC(=O)N2 AS02113 [0,0,0,1,0,0|2,0,1]=4 94 B12R2.202 c1cc2c(c(c1)F)sc(n2)N AS06200 [0,0,0,1,0,0|2,0,1]=4 95 B12R2.1081 c1cc2c(c(c1)N)CCCC2 AS02443 [0,0,0,1,0,0|3,0,0]=4 96 B9R1.8 c1ccc(cc1)CC#N AS01366 [2,0,0,0,0,0|0,0,2]=4 97 B9R1.8 c1ccc(cc1)CCCl AS00650 [2,0,0,0,0,0|1,0,0]=3 98 B9R1.8 c1ccc(cc1)CCN AS00484 [2,0,0,0,0,0|0,0,0]=2 99 B9R1.8 c1ccc(cc1)CCO AS00558 [2,0,0,0,0,0|1,0,0]=3 100 B9R1.8 c1ccc(cc1)CON AS04494 [2,0,0,0,0,0|1,0,0]=3 101 B9R1.8 c1ccnc(c1)CCCl AS04932 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.15 C=Cc1ccccc1F AS03294 [2,0,0,0,0,0|0,0,2]=4 103 B9R1.15 CCc1ccccc1Br AS03252 [2,0,0,0,0,0|0,1,0]=3 104 B9R1.15 CCc1ccccc1I AS02158 [2,0,0,0,0,0|0,1,0]=3 105 B9R1.15 CNc1ccccc1N AS04592 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.15 COc1ccccc1Br AS02357 [2,0,0,0,0,0|1,1,0]=4 107 B9R1.15 COc1ccccc1Cl AS02676 [2,0,0,0,0,0|1,0,0]=3 108 B9R1.15 COc1ccccc1F AS01803 [2,0,0,0,0,0|1,0,0]=3 109 B9R1.15 COc1ccccc1I AS02206 [2,0,0,0,0,0|1,1,0]=4 110 B9R1.15 COc1ccccc1N AS01503 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.15 COc1ccncc1Cl AS04708 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.15 CSc1ccccc1Br AS04291 [2,0,0,0,0,0|1,1,0]=4 113 B9R1.15 CSc1ccccc1Cl AS04287 [2,0,0,0,0,0|1,0,0]=3 114 B9R1.15 CSc1ccccc1F AS04284 [2,0,0,0,0,0|1,0,0]=3 115 B9R1.15 CSc1ccccc1I AS04299 [2,0,0,0,0,0|1,1,0]=4 116 B9R1.15 CSc1ccccc1N AS04281 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.15 CSc1ccccc1O AS04298 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.15 Cc1ccccc1CBr AS02052 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.15 Cc1ccccc1CCl AS03843 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.15 Cc1ccccc1CN AS00380 [2,0,0,0,0,0|1,0,0]=3 121 B9R1.15 Cc1ccccc1NN AS02962 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.15 Cc1ccccc1OC AS01015 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.15 Cc1ccccc1SC AS04306 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.15 c1ccc(c(c1)C#N)Cl AS03713 [2,0,0,0,0,0|0,0,2]=4 125 B9R1.15 c1ccc(c(c1)C#N)F AS03734 [2,0,0,0,0,0|0,0,2]=4 126 B9R1.15 c1ccc(c(c1)C=O)F AS02999 [2,0,0,0,0,0|1,0,1]=4 127 B9R1.15 c1ccc(c(c1)CBr)Br AS02057 [2,0,0,0,0,0|1,1,0]=4 128 B9R1.15 c1ccc(c(c1)CBr)Cl AS02065 [2,0,0,0,0,0|1,0,0]=3 129 B9R1.15 c1ccc(c(c1)CBr)F AS00662 [2,0,0,0,0,0|1,0,0]=3 130 B9R1.15 c1ccc(c(c1)CBr)I AS00633 [2,0,0,0,0,0|1,1,0]=4 131 B9R1.15 c1ccc(c(c1)CCl)F AS00659 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.15 c1ccc(c(c1)CN)Br AS02252 [2,0,0,0,0,0|0,1,0]=3 133 B9R1.15 c1ccc(c(c1)CN)Br AS03101 [2,0,0,0,0,0|0,1,0]=3 134 B9R1.15 c1ccc(c(c1)CN)Cl AS00369 [2,0,0,0,0,0|0,0,0]=2 135 B9R1.15 c1ccc(c(c1)CN)Cl AS02687 [2,0,0,0,0,0|0,0,0]=2 136 B9R1.15 c1ccc(c(c1)CN)F AS00832 [2,0,0,0,0,0|0,0,0]=2 137 B9R1.15 c1ccc(c(c1)CN)F AS01936 [2,0,0,0,0,0|0,0,0]=2 138 B9R1.15 c1ccc(c(c1)CN)I AS02221 [2,0,0,0,0,0|0,1,0]=3 139 B9R1.15 c1ccc(c(c1)CN)I AS02299 [2,0,0,0,0,0|0,1,0]=3 140 B9R1.15 c1ccc(c(c1)CN)N AS06598 [2,0,0,0,0,0|1,0,0]=3 141 B9R1.15 c1ccc(c(c1)CO)Br AS03952 [2,0,0,0,0,0|1,1,0]=4 142 B9R1.15 c1ccc(c(c1)CO)Cl AS03963 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.15 c1ccc(c(c1)CO)F AS03976 [2,0,0,0,0,0|1,0,0]=3 144 B9R1.15 c1ccc(c(c1)CO)I AS03985 [2,0,0,0,0,0|1,1,0]=4 145 B9R1.15 c1ccc(c(c1)CO)N AS00575 [2,0,0,0,0,0|2,0,0]=4 146 B9R1.15 c1ccc(c(c1)CO)O AS00547 [2,0,0,0,0,0|2,0,0]=4 147 B9R1.15 c1ccc(c(c1)NN)Br AS02014 [2,0,0,0,0,0|1,1,0]=4 148 B9R1.15 c1ccc(c(c1)NN)Cl AS01997 [2,0,0,0,0,0|1,0,0]=3 149 B9R1.15 c1ccc(c(c1)NN)F AS02017 [2,0,0,0,0,0|1,0,0]=3 150 B9R1.15 c1ccc(c(c1)NN)F AS02959 [2,0,0,0,0,0|1,0,0]=3 151 B9R1.3 Cc1c(cccc1Br)Br AS03583 [2,0,0,0,0,0|0,2,0]=4 152 B9R1.3 Cc1c(cccc1Br)Cl AS00103 [2,0,0,0,0,0|0,1,0]=3 153 B9R1.3 Cc1c(cccc1Br)F AS03334 [2,0,0,0,0,0|0,1,0]=3 154 B9R1.3 Cc1c(cccc1Br)N AS04060 [2,0,0,0,0,0|1,1,0]=4 155 B9R1.3 Cc1c(cccc1Cl)Cl AS02896 [2,0,0,0,0,0|0,1,0]=3 156 B9R1.3 Cc1c(cccc1Cl)F AS00105 [2,0,0,0,0,0|0,0,0]=2 157 B9R1.3 Cc1c(cccc1Cl)N AS05331 [2,0,0,0,0,0|1,0,0]=3 158 B9R1.3 Cc1c(cccc1Cl)O AS02821 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.3 Cc1c(cccc1F)F AS00141 [2,0,0,0,0,0|0,1,0]=3 160 B9R1.3 Cc1c(cccc1F)N AS04090 [2,0,0,0,0,0|1,0,0]=3 161 B9R1.3 Cc1c(cccc1F)O AS01397 [2,0,0,0,0,0|1,0,0]=3 162 B9R1.3 Cc1c(cccc1I)Br AS03373 [2,0,0,0,0,0|0,2,0]=4 163 B9R1.3 Cc1c(cccc1I)Cl AS01025 [2,0,0,0,0,0|0,1,0]=3 164 B9R1.3 Cc1c(cccc1I)F AS02190 [2,0,0,0,0,0|0,1,0]=3 165 B9R1.3 Cc1c(ccnc1Cl)I AS04931 [2,0,0,0,0,0|1,1,0]=4 166 B9R1.3 Cc1cccc(c1Br)F AS02047 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.3 Cc1cccc(c1C)Br AS00263 [2,0,0,0,0,0|1,1,0]=4 168 B9R1.3 Cc1cccc(c1C)Cl AS02701 [2,0,0,0,0,0|1,0,0]=3 169 B9R1.3 Cc1cccc(c1C)F AS01577 [2,0,0,0,0,0|1,0,0]=3 170 B9R1.3 Cc1cccc(c1C)I AS02150 [2,0,0,0,0,0|1,1,0]=4 171 B9R1.3 Cc1cccc(c1C)N AS01547 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.3 Cc1cccc(c1C)O AS00199 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.3 Cc1cccc(c1Cl)Cl AS02894 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.3 Cc1cccc(c1F)Cl AS02063 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.3 Cc1cccc(c1F)F AS02068 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.3 Cc1cccc(c1I)Cl AS03078 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.3 Cc1cccc(c1I)F AS02032 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.3 Cc1cccc(c1I)F AS05019 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.3 Cc1cccc(c1N)Br AS05299 [2,0,0,0,0,0|1,1,0]=4 180 B9R1.3 Cc1cccc(c1N)C AS01550 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.3 Cc1cccc(c1N)Cl AS06940 [2,0,0,0,0,0|1,0,0]=3 182 B9R1.3 Cc1cccc(c1N)F AS04089 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.3 Cc1cccc(c1N)N AS00446 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.3 Cc1cccc(c1N)O AS05432 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.3 Cc1cccc(c1O)Cl AS04496 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.3 Cc1cccc(c1O)F AS05495 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.3 c1cc(c(c(c1)Br)Br)F AS05697 [2,0,0,0,0,0|1,1,0]=4 188 B9R1.3 c1cc(c(c(c1)Br)Cl)Cl AS03181 [2,0,0,0,0,0|1,1,0]=4 189 B9R1.3 c1cc(c(c(c1)Br)Cl)F AS01224 [2,0,0,0,0,0|1,1,0]=4 190 B9R1.3 c1cc(c(c(c1)Br)F)Cl AS01223 [2,0,0,0,0,0|1,1,0]=4 191 B9R1.3 c1cc(c(c(c1)Br)F)F AS01011 [2,0,0,0,0,0|1,1,0]=4 192 B9R1.3 c1cc(c(c(c1)Br)N)Br AS00472 [2,0,0,0,0,0|0,2,0]=4 193 B9R1.3 c1cc(c(c(c1)Br)N)Cl AS05285 [2,0,0,0,0,0|0,1,0]=3 194 B9R1.3 c1cc(c(c(c1)Br)N)F AS01511 [2,0,0,0,0,0|0,1,0]=3 195 B9R1.3 c1cc(c(c(c1)Br)N)O AS05407 [2,0,0,0,0,0|1,1,0]=4 196 B9R1.3 c1cc(c(c(c1)Br)O)Cl AS06586 [2,0,0,0,0,0|1,1,0]=4 197 B9R1.3 c1cc(c(c(c1)Br)O)F AS00388 [2,0,0,0,0,0|1,1,0]=4 198 B9R1.3 c1cc(c(c(c1)Cl)Br)Cl AS03184 [2,0,0,0,0,0|1,1,0]=4 199 B9R1.3 c1cc(c(c(c1)Cl)Cl)Cl AS00242 [2,0,0,0,0,0|1,1,0]=4 200 B9R1.3 c1cc(c(c(c1)Cl)Cl)F AS01227 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.3 c1cc(c(c(c1)Cl)Cl)N AS01518 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.3 c1cc(c(c(c1)Cl)F)F AS01529 [2,0,0,0,0,0|1,0,0]=3 203 B9R1.3 c1cc(c(c(c1)Cl)F)N AS00335 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.3 c1cc(c(c(c1)Cl)F)N AS04482 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.3 c1cc(c(c(c1)Cl)F)N AS05324 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.3 c1cc(c(c(c1)Cl)F)O AS01377 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.3 c1cc(c(c(c1)Cl)I)Cl AS00286 [2,0,0,0,0,0|1,1,0]=4 208 B9R1.3 c1cc(c(c(c1)Cl)I)N AS05329 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.3 c1cc(c(c(c1)Cl)I)O AS05467 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.3 c1cc(c(c(c1)Cl)N)Cl AS01523 [2,0,0,0,0,0|0,1,0]=3 211 B9R1.3 c1cc(c(c(c1)Cl)N)F AS00332 [2,0,0,0,0,0|0,0,0]=2 212 B9R1.3 c1cc(c(c(c1)Cl)O)Cl AS04577 [2,0,0,0,0,0|1,1,0]=4 213 B9R1.3 c1cc(c(c(c1)Cl)O)F AS00394 [2,0,0,0,0,0|1,0,0]=3 214 B9R1.3 c1cc(c(c(c1)Cl)O)O AS06480 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.3 c1cc(c(c(c1)F)Br)F AS01068 [2,0,0,0,0,0|1,1,0]=4 216 B9R1.3 c1cc(c(c(c1)F)Br)N AS04053 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.3 c1cc(c(c(c1)F)Br)O AS00201 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.3 c1cc(c(c(c1)F)Cl)F AS02693 [2,0,0,0,0,0|1,1,0]=4 219 B9R1.3 c1cc(c(c(c1)F)Cl)N AS04067 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.3 c1cc(c(c(c1)F)Cl)O AS05465 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.3 c1cc(c(c(c1)F)F)F AS04481 [2,0,0,0,0,0|1,1,0]=4 222 B9R1.3 c1cc(c(c(c1)F)F)N AS00340 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.3 c1cc(c(c(c1)F)F)O AS00198 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.3 c1cc(c(c(c1)F)I)F AS03092 [2,0,0,0,0,0|1,1,0]=4 225 B9R1.3 c1cc(c(c(c1)F)I)N AS04078 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.3 c1cc(c(c(c1)F)I)N AS06966 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.3 c1cc(c(c(c1)F)N)F AS00339 [2,0,0,0,0,0|0,1,0]=3 228 B9R1.3 c1cc(c(c(c1)F)N)N AS05686 [2,0,0,0,0,0|1,0,0]=3 229 B9R1.3 c1cc(c(c(c1)F)O)F AS00191 [2,0,0,0,0,0|1,1,0]=4 230 B9R1.3 c1cc(c(c(c1)F)O)O AS01419 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.3 c1cc(c(c(c1)I)Br)F AS06323 [2,0,0,0,0,0|1,1,0]=4 232 B9R1.3 c1cc(c(c(c1)I)Cl)Cl AS03084 [2,0,0,0,0,0|1,1,0]=4 233 B9R1.3 c1cc(c(c(c1)I)F)Cl AS01537 [2,0,0,0,0,0|1,1,0]=4 234 B9R1.3 c1cc(c(c(c1)I)F)F AS05705 [2,0,0,0,0,0|1,1,0]=4 235 B9R1.3 c1cc(c(c(c1)I)N)Cl AS05328 [2,0,0,0,0,0|0,1,0]=3 236 B9R1.3 c1cc(c(c(c1)I)O)Cl AS06544 [2,0,0,0,0,0|1,1,0]=4 237 B11R1.13 c1cc(c(c(c1)Cl)Cl)CC#N AS01668 [1,1,0,0,0,0|0,0,2]=4 238 B11R1.13 c1cc(c(c(c1)Cl)F)CC#N AS01955 [1,1,0,0,0,0|0,0,2]=4 239 B11R1.13 c1cc(c(c(c1)F)F)CC#N AS01724 [1,1,0,0,0,0|0,0,2]=4 240 B11R1.17 CCCOc1ccccc1F AS00939 [1,1,0,0,0,0|1,0,0]=3 241 B11R1.41 c1ccc(c(c1)CCBr)C=O AS06680 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.81 CCCc1ccc(cc1O)O AS06999 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.81 CCOc1ccc(cc1Cl)F AS02749 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.81 CCOc1ccc(cc1F)Cl AS02753 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.81 c1cc(c(cc1Br)F)CC#N AS06079 [1,1,0,0,0,0|0,0,2]=4 246 B11R1.81 c1cc(c(cc1Cl)Cl)CC#N AS01670 [1,1,0,0,0,0|0,0,2]=4 247 B11R1.81 c1cc(c(cc1Cl)Cl)CCO AS00584 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.81 c1cc(c(cc1Cl)F)CC#N AS01958 [1,1,0,0,0,0|0,0,2]=4 249 B11R1.81 c1cc(c(cc1F)Cl)CC#N AS01678 [1,1,0,0,0,0|0,0,2]=4 250 B11R1.81 c1cc(c(cc1F)F)CC#N AS01719 [1,1,0,0,0,0|0,0,2]=4 251 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl AS05022 [1,1,0,0,0,0|1,0,1]=4 252 B11R1.86 c1ccc(c(c1)CC(=O)O)F AS00497 [1,1,0,0,0,0|1,0,1]=4 253 B11R1.86 c1ccc(c(c1)NC(=S)N)F AS06852 [1,1,0,0,0,0|1,0,1]=4 254 B11R1.182 CCOc1cc(ccc1Cl)F AS02750 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.182 CCOc1cc(ccc1F)Cl AS02755 [1,1,0,0,0,0|2,0,0]=4 256 B11R1.182 Cc1ccc(c(c1)CCO)C AS00587 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.182 c1cc(c(cc1Cl)CC#N)Cl AS01671 [1,1,0,0,0,0|0,0,2]=4 258 B11R1.182 c1cc(c(cc1Cl)CC#N)F AS01960 [1,1,0,0,0,0|0,0,2]=4 259 B11R1.182 c1cc(c(cc1Cl)CCN)Cl AS00491 [1,1,0,0,0,0|0,0,0]=2 260 B11R1.182 c1cc(c(cc1Cl)CCO)Cl AS00592 [1,1,0,0,0,0|1,0,0]=3 261 B11R1.182 c1cc(c(cc1F)CC#N)Cl AS01702 [1,1,0,0,0,0|0,0,2]=4 262 B11R1.182 c1cc(c(cc1F)CC#N)F AS01725 [1,1,0,0,0,0|0,0,2]=4 263 B11R1.222 CCC(=O)c1ccccc1Cl AS06723 [1,1,0,0,0,0|1,0,1]=4 264 B11R1.222 CCC(C)c1ccccc1N AS05311 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl AS05099 [1,1,0,0,0,0|1,0,1]=4 266 B11R1.222 c1ccc(c(c1)C(=O)CBr)F AS05110 [1,1,0,0,0,0|1,0,1]=4 267 B11R1.222 c1ccc(c(c1)C(=O)CN)Br AS05062 [1,1,0,0,0,0|0,1,1]=4 268 B11R1.222 c1ccc(c(c1)C(=O)CN)Cl AS05070 [1,1,0,0,0,0|0,0,1]=3 269 B11R1.222 c1ccc(c(c1)C(=O)CN)F AS05081 [1,1,0,0,0,0|0,0,1]=3 270 B11R1.222 c1ccc(c(c1)C(=O)NN)Cl AS02682 [1,1,0,0,0,0|1,0,1]=4 271 B11R1.222 c1ccc(c(c1)C(=O)NN)F AS02953 [1,1,0,0,0,0|1,0,1]=4 272 B11R1.72 COc1c(ccc(c1Cl)F)F AS04263 [1,1,0,0,0,0|1,0,0]=3 273 B11R1.72 COc1c(ccc(c1F)Cl)F AS04264 [1,1,0,0,0,0|1,1,0]=4 274 B11R1.72 COc1c(ccc(c1F)F)F AS01412 [1,1,0,0,0,0|1,1,0]=4 275 B11R1.72 COc1c(ccc(c1F)F)N AS05420 [1,1,0,0,0,0|2,0,0]=4 276 B11R1.72 Cc1ccc(c(c1Cl)OC)F AS04266 [1,1,0,0,0,0|1,0,0]=3 277 B11R1.72 Cc1ccc(c(c1F)OC)Cl AS04267 [1,1,0,0,0,0|1,0,0]=3 278 B11R1.72 Cc1ccc(c(c1F)OC)F AS04253 [1,1,0,0,0,0|1,1,0]=4 279 B11R1.72 c1cc(c(c(c1F)C=O)Cl)F AS05547 [1,1,0,0,0,0|1,0,1]=4 280 B11R1.72 c1cc(c(c(c1F)CBr)Cl)F AS05954 [1,1,0,0,0,0|1,0,0]=3 281 B11R1.72 c1cc(c(c(c1F)CBr)F)F AS01861 [1,1,0,0,0,0|1,1,0]=4 282 B11R1.72 c1cc(c(c(c1F)CN)Cl)F AS06016 [1,1,0,0,0,0|0,0,0]=2 283 B11R1.72 c1cc(c(c(c1F)CN)F)F AS00481 [1,1,0,0,0,0|0,1,0]=3 284 B11R1.72 c1cc(c(c(c1F)F)C=O)Cl AS05549 [1,1,0,0,0,0|1,0,1]=4 285 B11R1.156 CC(=O)c1c(cccc1Cl)Cl AS04032 [1,1,0,0,0,0|0,1,1]=4 286 B11R1.156 CC(=O)c1c(cccc1Cl)Cl AS05155 [1,1,0,0,0,0|0,1,1]=4 287 B11R1.156 CC(=O)c1c(cccc1Cl)F AS05137 [1,1,0,0,0,0|0,0,1]=3 288 B11R1.156 CC(=O)c1c(cccc1F)F AS01189 [1,1,0,0,0,0|0,1,1]=4 289 B11R1.156 CC(=O)c1c(cccc1F)O AS01204 [1,1,0,0,0,0|1,0,1]=4 290 B11R1.156 CC(C)c1c(cccc1O)N AS06513 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.156 CC(c1c(cccc1Cl)Cl)Cl AS07051 [1,1,0,0,0,0|0,1,0]=3 292 B11R1.156 CC(c1c(cccc1Cl)Cl)O AS07052 [1,1,0,0,0,0|0,1,0]=3 293 B11R1.156 c1cc(c(c(c1)Cl)C(=O)Cl)F AS00040 [1,1,0,0,0,0|1,0,1]=4 294 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)F AS00966 [1,1,0,0,0,0|1,0,1]=4 295 B11R1.156 c1cc(c(c(c1)Cl)[N+](=O)[O-])F AS05676 [1,1,0,0,0,0|2,0,0]=4 296 B11R1.156 c1cc(c(c(c1)F)C(=O)N)F AS05891 [1,1,0,0,0,0|0,1,1]=4 297 B11R1.156 c1cc(c(c(c1)I)C(=O)N)Cl AS05888 [1,1,0,0,0,0|0,1,1]=4 298 B11R1.265 COc1c(cccc1Cl)C=O AS05558 [1,1,0,0,0,0|2,0,0]=4 299 B11R1.265 COc1c(cccc1Cl)C=O AS06905 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.265 COc1c(cccc1F)C=O AS01462 [1,1,0,0,0,0|2,0,0]=4 301 B11R1.265 COc1c(cccc1F)C=O AS04977 [1,1,0,0,0,0|2,0,0]=4 302 B11R1.265 COc1cccc(c1CN)F AS06022 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.265 COc1cccc(c1OC)F AS05713 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.265 c1cc(c(c(c1)Cl)CBr)C#N AS02601 [1,1,0,0,0,0|2,0,0]=4 305 B11R1.265 c1cc(c(c(c1)F)CBr)C#N AS02604 [1,1,0,0,0,0|2,0,0]=4 306 B11R1.464 COc1c(cc(cc1Br)Br)F AS03547 [1,1,0,0,0,0|1,1,0]=4 307 B11R1.464 COc1c(cc(cc1Br)F)F AS01275 [1,1,0,0,0,0|1,1,0]=4 308 B11R1.464 COc1c(cc(cc1Br)N)F AS04961 [1,1,0,0,0,0|1,1,0]=4 309 B11R1.464 COc1c(cc(cc1Cl)Br)F AS04261 [1,1,0,0,0,0|1,0,0]=3 310 B11R1.464 COc1c(cc(cc1F)Br)F AS04262 [1,1,0,0,0,0|1,1,0]=4 311 B11R1.464 COc1c(cc(cc1F)Cl)F AS05462 [1,1,0,0,0,0|1,1,0]=4 312 B11R1.464 COc1c(cc(cc1F)F)F AS04254 [1,1,0,0,0,0|1,1,0]=4 313 B11R1.464 COc1c(cc(cc1F)I)F AS06834 [1,1,0,0,0,0|1,1,0]=4 314 B11R1.464 COc1c(cc(cc1F)N)F AS00331 [1,1,0,0,0,0|1,1,0]=4 315 B11R1.464 c1c(cc(c(c1F)C#N)Cl)Cl AS05828 [1,1,0,0,0,0|0,0,2]=4 316 B11R1.464 c1c(cc(c(c1F)C=O)Cl)Cl AS05576 [1,1,0,0,0,0|1,0,1]=4 317 B11R1.464 c1c(cc(c(c1F)CBr)F)Br AS05942 [1,1,0,0,0,0|1,1,0]=4 318 B11R1.464 c1c(cc(c(c1F)CBr)F)F AS01868 [1,1,0,0,0,0|1,1,0]=4 319 B11R1.464 c1c(cc(c(c1F)CN)F)F AS00482 [1,1,0,0,0,0|0,1,0]=3 320 B11R1.464 c1c(cc(c(c1F)CO)F)Br AS05941 [1,1,0,0,0,0|1,1,0]=4 321 B11R1.464 c1c(cc(c(c1F)CO)F)F AS06003 [1,1,0,0,0,0|1,1,0]=4 322 B13R1.4453 CCOC(=O)c1c(cccc1Cl)F AS06909 [0,2,0,0,0,0|1,0,1]=4 323 B11R2.106 c1cc2c(c(c1)F)CCN2 AS06054 [1,0,0,1,0,0|0,0,0]=2 324 B11R2.106 c1cc2c(cc[nH]2)c(c1)F AS02112 [1,0,0,1,0,0|0,0,2]=4