0 B10R1.4 CC=Cc1ccccc1C AIFCHEM-6371242545 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.4 CCNc1ccccc1Br AIFCHEM-94537427481 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.4 CCNc1ccccc1O AIFCHEM-94537427514 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.4 CCNc1cccnc1Br AIFCHEM-94537421189 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.4 CCNc1cccnc1I AIFCHEM-94537418171 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.4 CCNc1ccncc1Br AIFCHEM-94537414732 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.4 CCNc1ccncc1C AIFCHEM-94537417774 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.4 CCNc1ccncc1Cl AIFCHEM-94537417739 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.4 CCNc1ccncc1F AIFCHEM-94537418714 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.4 CCNc1ccncc1I AIFCHEM-94537426496 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.4 CCNc1ncccc1Br AIFCHEM-94537414733 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.4 CCNc1ncccc1C AIFCHEM-94537416246 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.4 CCNc1ncccc1Cl AIFCHEM-94537421147 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.13 CC=Cc1cccc(c1O)O AIFCHEM-6323013271 [0,1,0,0,0,0|1,0,2]=4 15 B11R1.13 CCNc1cccc(c1C)I AIFCHEM-94537416735 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.13 CCNc1cccc(c1Cl)C AIFCHEM-94537419793 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.13 CCNc1cccc(c1Cl)Cl AIFCHEM-94537423466 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.13 CCNc1cccc(c1Cl)F AIFCHEM-94537418350 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.13 CCNc1cccc(c1I)Br AIFCHEM-94537415858 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.13 CCNc1cccc(c1I)F AIFCHEM-94537413542 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.13 CCNc1cccc(c1O)Br AIFCHEM-94537419676 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.13 CCNc1cccc(c1O)I AIFCHEM-94537427792 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.17 CCCNc1ccccc1F AIFCHEM-94569019341 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.17 CCCNc1cccnc1C AIFCHEM-94569017542 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.17 CCCNc1cccnc1O AIFCHEM-94569017482 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.17 CCCNc1cnccc1C AIFCHEM-94569017546 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.17 CCCNc1ncccc1C AIFCHEM-94569013329 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.17 CCCNc1ncccc1O AIFCHEM-94569013697 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.17 CCNCc1ccccc1F AIFCHEM-94520796946 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.17 CCNCc1ccccc1O AIFCHEM-94537427248 [0,1,0,0,0,0|1,0,0]=2 31 B11R1.17 CCNCc1cccnc1Br AIFCHEM-94537418026 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.17 CCNCc1ncccc1F AIFCHEM-94537420062 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.17 OCC=Cc1ccccc1O AIFCHEM-6364368587 [0,1,0,0,0,0|1,0,1]=3 34 B11R1.41 CCNc1cccnc1CO AIFCHEM-94537422403 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.41 CCNc1ccncc1OC AIFCHEM-94537422401 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.41 CCNc1ncccc1CO AIFCHEM-94537418922 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.81 CCNc1ccc(cc1Br)Br AIFCHEM-94544662986 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.81 CCNc1ccc(cc1Br)F AIFCHEM-94537411222 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.81 CCNc1ccc(cc1Br)I AIFCHEM-94537419864 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.81 CCNc1ccc(cc1C)Cl AIFCHEM-94537427516 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.81 CCNc1ccc(cc1C)I AIFCHEM-94537414463 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.81 CCNc1ccc(cc1Cl)F AIFCHEM-94537418246 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.81 CCNc1ccc(cc1Cl)O AIFCHEM-94537416872 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.81 CCNc1ccc(cc1F)O AIFCHEM-94576179707 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.81 CCNc1ccc(cc1I)Br AIFCHEM-94537424205 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.81 CCNc1ccc(cc1I)C AIFCHEM-94537419831 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.81 CCNc1ncc(cc1O)Br AIFCHEM-94537421209 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.81 CCNc1ncc(cc1O)Cl AIFCHEM-94537421390 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.86 CC(=O)Nc1ccccc1O AIFCHEM-94605355387 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.182 CCNc1cc(ccc1Br)F AIFCHEM-94537411223 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.182 CCNc1cc(ccc1Br)O AIFCHEM-94537411237 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.182 CCNc1cc(ccc1C)O AIFCHEM-94537419711 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.182 CCNc1cc(ccc1Cl)Br AIFCHEM-94537423469 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.182 CCNc1cc(ccc1Cl)Cl AIFCHEM-94586538814 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.182 CCNc1cc(ccc1I)C AIFCHEM-94537414464 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.222 C/C=C(\C)/c1ccccc1O AIFCHEM-94584219423 [0,1,0,0,0,0|1,0,2]=4 57 B11R1.605 CC=Cc1c(cccc1O)C AIFCHEM-6359042356 [0,1,0,0,0,0|1,0,2]=4 58 B10R1.1 CCNc1ccc(cc1)C AIFCHEM-94537411875 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [1,1,0,0,0,0|2,0,0]=4 61 B12R1.25 CCCNc1cccc(c1C)Br AIFCHEM-94585196993 [0,2,0,0,0,0|2,0,0]=4 62 B12R1.25 CCCNc1cccc(c1C)C AIFCHEM-94569023327 [0,2,0,0,0,0|2,0,0]=4 63 B12R1.25 CCCNc1cccc(c1F)C AIFCHEM-94569014814 [0,2,0,0,0,0|2,0,0]=4 64 B12R1.25 CCCNc1cccc(c1O)Br AIFCHEM-94569016759 [0,2,0,0,0,0|1,0,0]=3 65 B12R1.25 CCCNc1cncc(c1O)Br AIFCHEM-94569008425 [0,2,0,0,0,0|2,0,0]=4 66 B12R1.25 CCNCc1cccc(c1C)C AIFCHEM-94537422315 [0,2,0,0,0,0|2,0,0]=4 67 B12R1.25 CCNCc1cccc(c1F)Br AIFCHEM-94537412770 [0,2,0,0,0,0|2,0,0]=4 68 B12R1.25 CCNCc1cccc(c1O)Br AIFCHEM-94537417018 [0,2,0,0,0,0|1,0,0]=3 69 B12R1.25 CCNCc1cccc(c1O)C AIFCHEM-94537417662 [0,2,0,0,0,0|1,0,0]=3 70 B12R1.25 CCNCc1cccc(c1O)F AIFCHEM-94537418038 [0,2,0,0,0,0|1,0,0]=3 71 B12R1.25 CCNCc1cccc(c1O)O AIFCHEM-94537413035 [0,2,0,0,0,0|1,0,0]=3 72 B12R1.25 OCC=Cc1cccc(c1O)O AIFCHEM-6309534545 [0,2,0,0,0,0|1,0,1]=4 73 B12R1.542 CCNc1cccc(c1CO)Cl AIFCHEM-94537421196 [0,2,0,0,0,0|2,0,0]=4 74 B12R1.542 CCNc1cccc(c1CO)F AIFCHEM-94537418588 [0,2,0,0,0,0|2,0,0]=4 75 B12R1.542 CCNc1cccc(c1OC)C AIFCHEM-94537417145 [0,2,0,0,0,0|2,0,0]=4 76 B12R1.69 CCCNc1ccc(cc1Br)Br AIFCHEM-94569020646 [0,2,0,0,0,0|2,0,0]=4 77 B12R1.69 CCCNc1ccc(cc1Br)Cl AIFCHEM-94569023399 [0,2,0,0,0,0|2,0,0]=4 78 B12R1.69 CCCNc1ccc(cc1Br)I AIFCHEM-94569016947 [0,2,0,0,0,0|2,0,0]=4 79 B12R1.69 CCCNc1ccc(cc1C)O AIFCHEM-94569016792 [0,2,0,0,0,0|2,0,0]=4 80 B12R1.69 CCCNc1ccc(cc1Cl)C AIFCHEM-94569020647 [0,2,0,0,0,0|2,0,0]=4 81 B12R1.69 CCCNc1ccc(cc1I)C AIFCHEM-94569016914 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.69 CCCNc1ccc(cc1O)Cl AIFCHEM-94569016810 [0,2,0,0,0,0|1,0,0]=3 83 B12R1.69 CCCNc1ncc(cc1O)F AIFCHEM-94569008325 [0,2,0,0,0,0|2,0,0]=4 84 B12R1.69 CCNCc1ccc(cc1C)C AIFCHEM-94537427365 [0,2,0,0,0,0|2,0,0]=4 85 B12R1.69 CCNCc1ccc(cc1C)F AIFCHEM-94537425312 [0,2,0,0,0,0|2,0,0]=4 86 B12R1.69 CCNCc1ccc(cc1F)Br AIFCHEM-94591862674 [0,2,0,0,0,0|2,0,0]=4 87 B12R1.69 CCNCc1ccc(cc1F)C AIFCHEM-94537413387 [0,2,0,0,0,0|2,0,0]=4 88 B12R1.69 CCNCc1ccc(cc1O)Br AIFCHEM-94537417660 [0,2,0,0,0,0|1,0,0]=3 89 B12R1.69 CCNCc1ccc(cc1O)F AIFCHEM-94537426255 [0,2,0,0,0,0|1,0,0]=3 90 B12R1.69 OCC=Cc1ccc(cc1O)O AIFCHEM-6301496114 [0,2,0,0,0,0|1,0,1]=4 91 B12R1.121 CCCNc1ccccc1SC AIFCHEM-94569016982 [0,2,0,0,0,0|1,1,0]=4 92 B12R1.121 CCCNc1ncccc1CO AIFCHEM-94569016005 [0,2,0,0,0,0|2,0,0]=4 93 B12R1.121 CCNCc1ccccc1C#N AIFCHEM-94537420512 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.125 CC(=O)NCc1ccccc1O AIFCHEM-94535601059 [0,2,0,0,0,0|1,0,1]=4 95 B12R1.125 CC(C)CNc1ccccc1F AIFCHEM-94582105931 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.125 CC(C)CNc1cccnc1O AIFCHEM-94572979736 [0,2,0,0,0,0|2,0,0]=4 97 B12R1.125 CC(C)NCc1ccccc1O AIFCHEM-94532460180 [0,2,0,0,0,0|1,0,0]=3 98 B12R1.125 CC(C)NCc1cccnc1O AIFCHEM-94541098053 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.125 CC(C)NCc1ccncc1O AIFCHEM-94520538410 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.125 CC(C)NCc1cnccc1O AIFCHEM-94520542511 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.267 CCCC=Cc1ccncc1O AIFCHEM-6375963658 [0,2,0,0,0,0|2,0,0]=4 102 B12R1.267 CCCCNc1cnccc1O AIFCHEM-94523040136 [0,2,0,0,0,0|2,0,0]=4 103 B12R1.267 CCCCNc1ncccc1O AIFCHEM-94523032927 [0,2,0,0,0,0|2,0,0]=4 104 B12R1.267 CCCNCc1ccccc1Cl AIFCHEM-94555005997 [0,2,0,0,0,0|2,0,0]=4 105 B12R1.267 CCCNCc1ccccc1O AIFCHEM-94592060285 [0,2,0,0,0,0|1,0,0]=3 106 B12R1.267 COCC=Cc1ccccc1O AIFCHEM-6341471182 [0,2,0,0,0,0|1,0,1]=4 107 B12R1.267 N#CCNCc1ccccc1Br AIFCHEM-94558707092 [0,2,0,0,0,0|1,0,1]=4 108 B12R1.267 N#CCNCc1ccccc1F AIFCHEM-94558705901 [0,2,0,0,0,0|1,0,1]=4 109 B12R1.267 N#CCNCc1ccccc1O AIFCHEM-94532467514 [0,2,0,0,0,0|0,0,1]=3 110 B12R1.267 OCCNCc1ccccc1O AIFCHEM-94532459344 [0,2,0,0,0,0|1,0,0]=3 111 B12R1.267 Oc1ccccc1CNCCF AIFCHEM-94532465977 [0,2,0,0,0,0|1,0,0]=3 112 B12R1.308 CCCN(C)c1ccccc1Br AIFCHEM-94569021465 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.308 CCNC(C)c1ccccc1O AIFCHEM-94537426788 [0,2,0,0,0,0|1,0,0]=3 114 B12R1.308 CCN[C@@H](C)c1ccccc1O AIFCHEM-94543553652 [0,2,0,0,0,0|1,0,0]=3 115 B12R1.308 CCN[C@H](C)c1ccccc1O AIFCHEM-94537413736 [0,2,0,0,0,0|1,0,0]=3 116 B12R1.371 CC(CO)Nc1ccccc1O AIFCHEM-94521333642 [0,2,0,0,0,0|1,0,0]=3 117 B12R1.371 CCN(C)Cc1ccccc1O AIFCHEM-94563261019 [0,2,0,0,0,0|1,0,0]=3 118 B12R1.371 CCN(C)Cc1ccncc1O AIFCHEM-94563256882 [0,2,0,0,0,0|2,0,0]=4 119 B12R1.374 CCCNc1cc(ccc1Br)Br AIFCHEM-94570336825 [0,2,0,0,0,0|2,0,0]=4 120 B12R1.374 CCCNc1cc(ccc1Br)I AIFCHEM-94569009317 [0,2,0,0,0,0|2,0,0]=4 121 B12R1.374 CCCNc1cc(ccc1C)Br AIFCHEM-94569018213 [0,2,0,0,0,0|2,0,0]=4 122 B12R1.374 CCCNc1cc(ccc1Cl)C AIFCHEM-94569024602 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.374 CCCNc1cc(ccc1F)Cl AIFCHEM-94569015331 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.374 CCCNc1cc(ccc1F)O AIFCHEM-94569020737 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.374 CCCNc1cc(ccc1O)Br AIFCHEM-94569018465 [0,2,0,0,0,0|1,0,0]=3 126 B12R1.374 CCCNc1cc(ccc1O)O AIFCHEM-94569015160 [0,2,0,0,0,0|1,0,0]=3 127 B12R1.374 CCNCc1cc(ccc1C)C AIFCHEM-94537427224 [0,2,0,0,0,0|2,0,0]=4 128 B12R1.374 CCNCc1cc(ccc1O)Br AIFCHEM-94537417084 [0,2,0,0,0,0|1,0,0]=3 129 B12R1.374 CCNCc1cc(ccc1O)C AIFCHEM-94577948395 [0,2,0,0,0,0|1,0,0]=3 130 B12R1.374 CCNCc1cc(ccc1O)Cl AIFCHEM-94537421158 [0,2,0,0,0,0|1,0,0]=3 131 B12R1.374 CCNCc1cc(ccc1O)F AIFCHEM-94537412553 [0,2,0,0,0,0|1,0,0]=3 132 B12R1.1631 CCNCc1c(cccc1Br)O AIFCHEM-94537418656 [0,2,0,0,0,0|1,0,0]=3 133 B12R1.1631 CCNCc1c(cccc1F)C AIFCHEM-94537412417 [0,2,0,0,0,0|2,0,0]=4 134 B12R1.1631 CCNCc1c(cccc1F)O AIFCHEM-94537418182 [0,2,0,0,0,0|1,0,0]=3 135 B12R1.1631 Cc1cccc(c1C=CCO)O AIFCHEM-6378257590 [0,2,0,0,0,0|1,0,1]=4 136 B12R1.1631 Nc1cccc(c1C=CCO)O AIFCHEM-5847428384 [0,2,0,0,0,0|1,0,1]=4 137 B12R1.1631 OCC=Cc1c(cccc1F)O AIFCHEM-6381666064 [0,2,0,0,0,0|1,0,1]=4 138 B12R1.112 CCNc1ccc(cc1CO)Br AIFCHEM-94537418068 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.112 CCNc1ccc(cc1OC)C AIFCHEM-94537421134 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.112 CCNc1ccc(cc1OC)Cl AIFCHEM-94537427225 [0,2,0,0,0,0|2,0,0]=4 141 B12R1.112 CCNc1ccc(cc1OC)O AIFCHEM-94537423576 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.169 CCCc1ccccc1NCC AIFCHEM-94537417191 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.268 CCNc1cc(ccc1OC)F AIFCHEM-94537417734 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.114 CCNc1ccc(cc1O)OC AIFCHEM-94537421384 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.1123 CCNc1cc(c(cc1O)Cl)Br AIFCHEM-94537411652 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.1123 CCNc1cc(c(cc1O)Cl)Cl AIFCHEM-94537419728 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.270 CCNc1cc(ccc1O)C#N AIFCHEM-94537415604 [0,2,0,0,0,0|2,0,0]=4 148 B10R1.21 CCCC=Cc1cccs1 AIFCHEM-94564040480 [0,0,1,1,0,0|1,1,0]=4 149 B10R1.21 CCCC=Cc1ncco1 AIFCHEM-6486072646 [0,0,1,1,0,0|2,0,0]=4