0 B11R1.24 CCCNc1cc(ccn1)C AIFCHEM-94569021601 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.24 CCCNc1cc(ccn1)Cl AIFCHEM-94569014823 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.24 CCCNc1cccc(c1)Br AIFCHEM-94552679825 [0,0,0,0,0,0|2,1,0]=3 3 B11R1.24 CCCNc1cccc(c1)F AIFCHEM-94579349397 [0,0,0,0,0,0|2,1,0]=3 4 B11R1.24 CCNCc1cccc(c1)C AIFCHEM-94537252418 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.24 CCNCc1cccc(n1)C AIFCHEM-94537414853 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.24 CCNCc1ccnc(c1)Br AIFCHEM-94537426068 [0,0,0,0,0,0|3,1,0]=4 7 B11R1.24 CCNCc1cncc(c1)Br AIFCHEM-94537411205 [0,0,0,0,0,0|3,1,0]=4 8 B11R1.24 CCNCc1cncc(c1)C AIFCHEM-94537415593 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.10 CCNc1cccc(n1)Br AIFCHEM-94537417741 [1,0,0,0,0,0|2,1,0]=4 10 B10R1.10 CCNc1cccc(n1)Cl AIFCHEM-94537421828 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.10 CCNc1ccnc(n1)Cl AIFCHEM-94537425041 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.10 CCNc1cncc(c1)Br AIFCHEM-94537414734 [1,0,0,0,0,0|2,1,0]=4 13 B10R1.10 CCNc1cncc(c1)C AIFCHEM-94524188643 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.10 CCNc1cncc(c1)Cl AIFCHEM-94537418676 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.10 CCNc1cncc(c1)O AIFCHEM-94532888502 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.10 CCNc1cnnc(c1)Cl AIFCHEM-94537419800 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [1,0,0,0,0,0|3,0,0]=4 19 B12R1.17 CCNC(C)c1cccc(c1)Cl AIFCHEM-94537421230 [0,1,0,0,0,0|2,0,0]=3 20 B12R1.17 CCNC(C)c1cccc(c1)F AIFCHEM-94537425058 [0,1,0,0,0,0|2,1,0]=4 21 B12R1.17 CCN[C@@H](C)c1cccc(c1)Cl AIFCHEM-94599591141 [0,1,0,0,0,0|2,0,0]=3 22 B12R1.17 CCN[C@@H](C)c1cccc(c1)F AIFCHEM-94519043752 [0,1,0,0,0,0|2,1,0]=4 23 B12R1.17 CCN[C@H](C)c1cccc(c1)Cl AIFCHEM-94570734528 [0,1,0,0,0,0|2,0,0]=3 24 B12R1.17 CCN[C@H](C)c1cccc(c1)F AIFCHEM-94537420186 [0,1,0,0,0,0|2,1,0]=4 25 B12R1.25 CCCNc1cccc(c1C)Br AIFCHEM-94585196993 [0,1,0,0,0,0|2,1,0]=4 26 B12R1.25 CCCNc1cccc(c1C)C AIFCHEM-94569023327 [0,1,0,0,0,0|3,0,0]=4 27 B12R1.25 CCCNc1cccc(c1F)C AIFCHEM-94569014814 [0,1,0,0,0,0|3,0,0]=4 28 B12R1.25 CCCNc1cccc(c1O)Br AIFCHEM-94569016759 [0,1,0,0,0,0|2,1,0]=4 29 B12R1.25 CCCNc1cncc(c1Cl)Cl AIFCHEM-94569023769 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.25 CCCNc1nccc(c1C)Cl AIFCHEM-94569010662 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.25 CCNCc1cccc(c1C)C AIFCHEM-94537422315 [0,1,0,0,0,0|3,0,0]=4 32 B12R1.25 CCNCc1cccc(c1F)Br AIFCHEM-94537412770 [0,1,0,0,0,0|2,1,0]=4 33 B12R1.25 CCNCc1cccc(c1O)Br AIFCHEM-94537417018 [0,1,0,0,0,0|2,1,0]=4 34 B12R1.25 CCNCc1cccc(c1O)C AIFCHEM-94537417662 [0,1,0,0,0,0|3,0,0]=4 35 B12R1.25 CCNCc1cccc(c1O)F AIFCHEM-94537418038 [0,1,0,0,0,0|2,1,0]=4 36 B12R1.25 CCNCc1cccc(c1O)O AIFCHEM-94537413035 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.28 CCCC=Cc1cccc(c1)F AIFCHEM-6382549502 [0,1,0,0,0,0|1,1,1]=4 38 B12R1.28 CCCCNc1cccc(c1)Br AIFCHEM-94552679827 [0,1,0,0,0,0|1,1,0]=3 39 B12R1.28 CCCCNc1cccc(c1)I AIFCHEM-94523040021 [0,1,0,0,0,0|1,1,0]=3 40 B12R1.28 CCCCNc1ccnc(c1)Br AIFCHEM-94523041478 [0,1,0,0,0,0|2,1,0]=4 41 B12R1.28 CCCCNc1ccnc(c1)F AIFCHEM-94523033648 [0,1,0,0,0,0|2,1,0]=4 42 B12R1.28 CCCCNc1cncc(c1)I AIFCHEM-94523035566 [0,1,0,0,0,0|2,1,0]=4 43 B12R1.28 CCCNCc1cccc(c1)O AIFCHEM-94569022018 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.28 CCCNCc1cccc(n1)Br AIFCHEM-5853283410 [0,1,0,0,0,0|2,1,0]=4 45 B12R1.28 CCCNCc1cccc(n1)Cl AIFCHEM-94569013145 [0,1,0,0,0,0|2,0,0]=3 46 B12R1.28 CCCNCc1cccc(n1)F AIFCHEM-94521368095 [0,1,0,0,0,0|2,1,0]=4 47 B12R1.28 CCCNCc1ccnc(c1)C AIFCHEM-5790952841 [0,1,0,0,0,0|3,0,0]=4 48 B12R1.28 CCCNCc1ccnc(c1)O AIFCHEM-5853495193 [0,1,0,0,0,0|3,0,0]=4 49 B12R1.28 COCC=Cc1cccc(c1)N AIFCHEM-94552694627 [0,1,0,0,0,0|2,0,1]=4 50 B12R1.28 Cc1cccc(c1)CNCC#N AIFCHEM-94558706853 [0,1,0,0,0,0|3,0,0]=4 51 B12R1.28 FCCNCc1ccnc(c1)Cl AIFCHEM-5800418282 [0,1,0,0,0,0|3,0,0]=4 52 B12R1.28 N#CCNCc1cccc(c1)F AIFCHEM-94558705933 [0,1,0,0,0,0|2,1,0]=4 53 B12R1.28 N#CCNCc1cccc(c1)I AIFCHEM-94558707245 [0,1,0,0,0,0|2,1,0]=4 54 B12R1.50 CC(CO)Nc1cccc(c1)Cl AIFCHEM-94523487703 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.50 CCN(C)Cc1cccc(c1)F AIFCHEM-94563258775 [0,1,0,0,0,0|2,1,0]=4 56 B12R1.50 CCN(C)Cc1cccc(c1)O AIFCHEM-94563254727 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.50 CCN(C)Cc1cccc(n1)Cl AIFCHEM-6118661081 [0,1,0,0,0,0|3,0,0]=4 58 B12R1.100 CCCNc1cc(cc(c1)Br)Cl AIFCHEM-94569024749 [0,1,0,0,0,0|2,0,0]=3 59 B12R1.100 CCCNc1cc(cc(c1)F)F AIFCHEM-94569017963 [0,1,0,0,0,0|2,1,0]=4 60 B12R1.100 CCCNc1cc(cc(c1)I)I AIFCHEM-94569017682 [0,1,0,0,0,0|2,1,0]=4 61 B12R1.100 CCCNc1cc(cc(c1)O)C AIFCHEM-94569022321 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.100 CCNCc1cc(cc(c1)C)C AIFCHEM-94537425460 [0,1,0,0,0,0|3,0,0]=4 63 B12R1.226 CC(C)CNc1ccnc(c1)Cl AIFCHEM-94572974872 [0,1,0,0,0,0|3,0,0]=4 64 B12R1.226 CC(C)NCc1cccc(c1)Br AIFCHEM-94520539518 [0,1,0,0,0,0|2,1,0]=4 65 B12R1.226 CC(C)NCc1cccc(c1)I AIFCHEM-94520541615 [0,1,0,0,0,0|2,1,0]=4 66 B12R1.374 CCCNc1cc(ccc1Br)Br AIFCHEM-94570336825 [0,1,0,0,0,0|2,1,0]=4 67 B12R1.374 CCCNc1cc(ccc1Br)I AIFCHEM-94569009317 [0,1,0,0,0,0|2,1,0]=4 68 B12R1.374 CCCNc1cc(ccc1C)Br AIFCHEM-94569018213 [0,1,0,0,0,0|2,1,0]=4 69 B12R1.374 CCCNc1cc(ccc1Cl)C AIFCHEM-94569024602 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.374 CCCNc1cc(ccc1F)Cl AIFCHEM-94569015331 [0,1,0,0,0,0|2,0,0]=3 71 B12R1.374 CCCNc1cc(ccc1F)O AIFCHEM-94569020737 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.374 CCCNc1cc(ccc1O)Br AIFCHEM-94569018465 [0,1,0,0,0,0|2,1,0]=4 73 B12R1.374 CCCNc1cc(ccc1O)O AIFCHEM-94569015160 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.374 CCCNc1cc(ncc1Br)Cl AIFCHEM-94569023143 [0,1,0,0,0,0|3,0,0]=4 75 B12R1.374 CCNCc1cc(ccc1C)C AIFCHEM-94537427224 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.374 CCNCc1cc(ccc1O)Br AIFCHEM-94537417084 [0,1,0,0,0,0|2,1,0]=4 77 B12R1.374 CCNCc1cc(ccc1O)C AIFCHEM-94577948395 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.374 CCNCc1cc(ccc1O)Cl AIFCHEM-94537421158 [0,1,0,0,0,0|2,0,0]=3 79 B12R1.374 CCNCc1cc(ccc1O)F AIFCHEM-94537412553 [0,1,0,0,0,0|2,1,0]=4 80 B12R1.382 CCCNc1cccc(c1)C#N AIFCHEM-94571669059 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.385 CCCNc1cc(c(cn1)C)Cl AIFCHEM-94569008695 [0,1,0,0,0,0|3,0,0]=4 82 B12R1.385 CCCNc1ccc(c(c1)Br)Cl AIFCHEM-94569022782 [0,1,0,0,0,0|2,1,0]=4 83 B12R1.385 CCCNc1ccc(c(c1)C)Br AIFCHEM-94569015014 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.385 CCCNc1ccc(c(c1)Cl)Br AIFCHEM-94569015441 [0,1,0,0,0,0|2,0,0]=3 85 B12R1.385 CCCNc1ccc(c(c1)I)Cl AIFCHEM-94569020145 [0,1,0,0,0,0|2,1,0]=4 86 B12R1.385 CCCNc1ccc(c(n1)Cl)Br AIFCHEM-94569017784 [0,1,0,0,0,0|3,0,0]=4 87 B12R1.385 CCCNc1cnc(c(c1)Cl)Cl AIFCHEM-94569024796 [0,1,0,0,0,0|3,0,0]=4 88 B12R1.385 CCNCc1ccc(c(c1)Br)F AIFCHEM-94537417927 [0,1,0,0,0,0|2,1,0]=4 89 B12R1.385 CCNCc1ccc(c(c1)C)F AIFCHEM-94537419376 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.385 CCNCc1ccc(c(c1)Cl)C AIFCHEM-94537424345 [0,1,0,0,0,0|2,0,0]=3 91 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl AIFCHEM-94537411446 [0,1,0,0,0,0|2,0,0]=3 92 B12R1.385 CCNCc1ccc(c(c1)F)Br AIFCHEM-94537423164 [0,1,0,0,0,0|2,1,0]=4 93 B12R1.385 CCNCc1ccc(c(c1)O)O AIFCHEM-94537416373 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [2,0,0,0,0,0|2,0,0]=4 95 B11R1.13 CCNc1cccc(c1C)I AIFCHEM-94537416735 [1,1,0,0,0,0|1,1,0]=4 96 B11R1.13 CCNc1cccc(c1Cl)C AIFCHEM-94537419793 [1,1,0,0,0,0|2,0,0]=4 97 B11R1.13 CCNc1cccc(c1Cl)Cl AIFCHEM-94537423466 [1,1,0,0,0,0|1,0,0]=3 98 B11R1.13 CCNc1cccc(c1Cl)F AIFCHEM-94537418350 [1,1,0,0,0,0|1,1,0]=4 99 B11R1.13 CCNc1cccc(c1I)Br AIFCHEM-94537415858 [1,1,0,0,0,0|1,1,0]=4 100 B11R1.13 CCNc1cccc(c1I)F AIFCHEM-94537413542 [1,1,0,0,0,0|1,1,0]=4 101 B11R1.13 CCNc1cccc(c1O)Br AIFCHEM-94537419676 [1,1,0,0,0,0|1,1,0]=4 102 B11R1.13 CCNc1cccc(c1O)I AIFCHEM-94537427792 [1,1,0,0,0,0|1,1,0]=4 103 B11R1.13 CCNc1ccnc(c1C)Cl AIFCHEM-94537425486 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.13 CCNc1ccnc(c1Cl)Cl AIFCHEM-94537417282 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.23 CCN(C)c1cccc(c1)Br AIFCHEM-94537415946 [1,1,0,0,0,0|1,1,0]=4 106 B11R1.34 CCNc1cc(cc(c1)Br)Br AIFCHEM-94561187166 [1,1,0,0,0,0|1,1,0]=4 107 B11R1.34 CCNc1cc(cc(c1)Br)C AIFCHEM-94537425037 [1,1,0,0,0,0|1,1,0]=4 108 B11R1.34 CCNc1cc(cc(c1)F)F AIFCHEM-94537420880 [1,1,0,0,0,0|1,1,0]=4 109 B11R1.182 CCNc1cc(ccc1Br)F AIFCHEM-94537411223 [1,1,0,0,0,0|1,1,0]=4 110 B11R1.182 CCNc1cc(ccc1Br)O AIFCHEM-94537411237 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.182 CCNc1cc(ccc1C)O AIFCHEM-94537419711 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.182 CCNc1cc(ccc1Cl)Br AIFCHEM-94537423469 [1,1,0,0,0,0|1,1,0]=4 113 B11R1.182 CCNc1cc(ccc1Cl)Cl AIFCHEM-94586538814 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.182 CCNc1cc(ccc1I)C AIFCHEM-94537414464 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.182 CCNc1cc(ncc1Br)Cl AIFCHEM-94537426060 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.189 CCNc1cccc(c1)OC AIFCHEM-94573851857 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.192 CCNc1ccc(c(c1)C)Cl AIFCHEM-94537419953 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.192 CCNc1ccc(c(c1)Cl)Br AIFCHEM-94537418358 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.192 CCNc1ccc(c(c1)Cl)Cl AIFCHEM-94563320197 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.192 CCNc1ccc(c(c1)F)C AIFCHEM-94537421787 [1,1,0,0,0,0|1,1,0]=4 121 B11R1.192 CCNc1ccc(c(c1)F)I AIFCHEM-94537424115 [1,1,0,0,0,0|1,1,0]=4 122 B11R1.192 CCNc1ccc(c(c1)I)O AIFCHEM-94537426737 [1,1,0,0,0,0|1,1,0]=4 123 B11R1.192 CCNc1ccc(c(c1)O)O AIFCHEM-94537416152 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.1 CCCNc1ccc(cc1)F AIFCHEM-94569015457 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.1 CCNCc1ccc(cc1)Cl AIFCHEM-94537411696 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.1 CCNCc1ccc(cc1)F AIFCHEM-94530368408 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.17 CCCNc1ccccc1F AIFCHEM-94569019341 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.17 CCNCc1ccccc1F AIFCHEM-94520796946 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.17 CCNCc1ccccc1O AIFCHEM-94537427248 [1,1,0,0,0,0|2,0,0]=4 130 B11R1.28 CCCNCc1ccncc1 AIFCHEM-5790435281 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.40 CCN(C)Cc1ccccc1 AIFCHEM-94537411577 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.27 CCCNCc1cc(cs1)Cl AIFCHEM-94521370322 [0,1,0,0,1,0|2,0,0]=4 133 B11R1.27 CCCNCc1ccc(s1)Cl AIFCHEM-5853190788 [0,1,0,0,1,0|2,0,0]=4 134 B13R1.18 CCCCN(C)c1cccc(c1)Cl AIFCHEM-94523040904 [0,2,0,0,0,0|1,0,0]=3 135 B13R1.18 CCCNC(=O)c1cccc(c1)Cl AIFCHEM-94521379007 [0,2,0,0,0,0|1,0,1]=4 136 B13R1.18 CCCNC(C)c1cccc(c1)Cl AIFCHEM-94569018313 [0,2,0,0,0,0|1,0,0]=3 137 B13R1.18 CCCN[C@@H](C)c1cccc(c1)Cl AIFCHEM-94569021460 [0,2,0,0,0,0|1,0,0]=3 138 B13R1.18 CCCN[C@@H](C)c1cccc(c1)O AIFCHEM-94569016771 [0,2,0,0,0,0|2,0,0]=4 139 B13R1.18 CCCN[C@H](C)c1cccc(c1)Cl AIFCHEM-94569013764 [0,2,0,0,0,0|1,0,0]=3 140 B13R1.18 CCCN[C@H](C)c1cccc(c1)O AIFCHEM-94569023112 [0,2,0,0,0,0|2,0,0]=4 141 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl AIFCHEM-94572983928 [0,2,0,0,0,0|2,0,0]=4 142 B13R1.446 CCCN(C)c1cc(ccc1C)Cl AIFCHEM-94569018523 [0,2,0,0,0,0|2,0,0]=4 143 B13R1.446 CCNC(C)c1cc(ccc1F)Cl AIFCHEM-94542866319 [0,2,0,0,0,0|2,0,0]=4 144 B13R1.446 CCN[C@@H](C)c1cc(ccc1F)Cl AIFCHEM-94537415372 [0,2,0,0,0,0|2,0,0]=4 145 B13R1.446 CCN[C@@H](C)c1cc(ccc1O)Cl AIFCHEM-94537413611 [0,2,0,0,0,0|2,0,0]=4 146 B13R1.446 CCN[C@H](C)c1cc(ccc1O)Cl AIFCHEM-94537413615 [0,2,0,0,0,0|2,0,0]=4 147 B13R1.450 CCCN(C)c1cc(cc(c1)Cl)Cl AIFCHEM-94569010160 [0,2,0,0,0,0|2,0,0]=4 148 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)Cl AIFCHEM-94583786479 [0,2,0,0,0,0|2,0,0]=4 149 B13R1.466 CCN[C@@H](C)c1ccc(c(c1)Cl)Cl AIFCHEM-94549769915 [0,2,0,0,0,0|2,0,0]=4 150 B13R1.466 CCN[C@H](C)c1ccc(c(c1)Cl)Cl AIFCHEM-94537415842 [0,2,0,0,0,0|2,0,0]=4 151 B13R1.16 CCCCNc1cccc(c1C)C AIFCHEM-94523042557 [0,2,0,0,0,0|2,0,0]=4 152 B13R1.16 CCCCNc1cccc(c1O)Br AIFCHEM-94523035989 [0,2,0,0,0,0|1,1,0]=4 153 B13R1.16 CCCNCc1cccc(c1Br)F AIFCHEM-5790791185 [0,2,0,0,0,0|1,1,0]=4 154 B13R1.16 CCCNCc1cccc(c1C)Cl AIFCHEM-5875358541 [0,2,0,0,0,0|1,0,0]=3 155 B13R1.16 CCCNCc1cccc(c1Cl)Cl AIFCHEM-94521370703 [0,2,0,0,0,0|1,0,0]=3 156 B13R1.16 CCCNCc1cccc(c1F)Br AIFCHEM-5790382392 [0,2,0,0,0,0|1,1,0]=4 157 B13R1.16 CCCNCc1cccc(c1O)Br AIFCHEM-94569014101 [0,2,0,0,0,0|1,1,0]=4 158 B13R1.16 CCCNCc1cccc(c1O)C AIFCHEM-94569014745 [0,2,0,0,0,0|2,0,0]=4 159 B13R1.16 CCCNCc1cccc(c1O)Cl AIFCHEM-94521367896 [0,2,0,0,0,0|1,0,0]=3 160 B13R1.16 CCCNCc1cccc(c1O)F AIFCHEM-5853175912 [0,2,0,0,0,0|1,1,0]=4 161 B13R1.16 CCCNCc1cccc(c1O)I AIFCHEM-5814655033 [0,2,0,0,0,0|1,1,0]=4 162 B13R1.16 CCCNCc1cccc(c1O)O AIFCHEM-5875428302 [0,2,0,0,0,0|2,0,0]=4 163 B13R1.16 CCCNCc1ccnc(c1Cl)Cl AIFCHEM-5814422172 [0,2,0,0,0,0|2,0,0]=4 164 B13R1.16 CCCNCc1cncc(c1Cl)Cl AIFCHEM-5875474029 [0,2,0,0,0,0|2,0,0]=4 165 B13R1.16 Cc1c(cccc1CNCCO)Cl AIFCHEM-6389665904 [0,2,0,0,0,0|2,0,0]=4 166 B13R1.16 N#CCNCc1cccc(c1Br)Cl AIFCHEM-94558707449 [0,2,0,0,0,0|2,0,0]=4 167 B13R1.16 N#CCNCc1cccc(c1Cl)Cl AIFCHEM-94558706948 [0,2,0,0,0,0|2,0,0]=4 168 B13R1.16 OCCNCc1cccc(c1O)Cl AIFCHEM-94577777249 [0,2,0,0,0,0|2,0,0]=4 169 B13R1.16 Oc1c(cccc1CNCCF)Cl AIFCHEM-5861617629 [0,2,0,0,0,0|2,0,0]=4 170 B13R1.40 CCN(C)Cc1cccc(c1C)Cl AIFCHEM-94563260799 [0,2,0,0,0,0|2,0,0]=4 171 B13R1.40 CCN(C)Cc1cccc(c1O)Cl AIFCHEM-94563256983 [0,2,0,0,0,0|2,0,0]=4 172 B13R1.123 CCCNc1cc(cc(c1Cl)Cl)Cl AIFCHEM-94569014380 [0,2,0,0,0,0|2,0,0]=4 173 B13R1.123 CCCNc1cc(cc(c1F)Br)Cl AIFCHEM-94597744713 [0,2,0,0,0,0|2,0,0]=4 174 B13R1.123 CCCNc1cc(cc(c1I)C)Cl AIFCHEM-94569009540 [0,2,0,0,0,0|2,0,0]=4 175 B13R1.123 CCNCc1cc(cc(c1F)Cl)Br AIFCHEM-94537418224 [0,2,0,0,0,0|2,0,0]=4 176 B13R1.150 CC(C)NCc1cccc(c1Br)Cl AIFCHEM-94520541819 [0,2,0,0,0,0|2,0,0]=4 177 B13R1.150 CC(C)NCc1cccc(c1Cl)Cl AIFCHEM-94520541318 [0,2,0,0,0,0|2,0,0]=4 178 B13R1.150 CC(C)NCc1cccc(c1O)Cl AIFCHEM-94520538511 [0,2,0,0,0,0|2,0,0]=4 179 B13R1.3395 CCNCc1c(ccc(c1F)Cl)Cl AIFCHEM-94537427070 [0,2,0,0,0,0|2,0,0]=4 180 B13R1.3516 CCCNc1cccc(c1OC)Cl AIFCHEM-94569019343 [0,2,0,0,0,0|2,0,0]=4 181 B13R1.3518 CCCNc1ccc(c(c1C)Cl)Br AIFCHEM-94569020826 [0,2,0,0,0,0|2,0,0]=4 182 B13R1.6 CCCCCNc1cccc(c1)Cl AIFCHEM-94523487542 [0,2,0,0,0,0|1,0,0]=3 183 B13R1.6 CCCCCNc1cccc(c1)F AIFCHEM-94551429309 [0,2,0,0,0,0|1,1,0]=4 184 B13R1.6 CCCCCNc1cccc(c1)I AIFCHEM-94551435232 [0,2,0,0,0,0|1,1,0]=4 185 B13R1.6 CCCCNCc1cccc(c1)F AIFCHEM-5694770333 [0,2,0,0,0,0|1,1,0]=4 186 B13R1.6 CCCCNCc1cccc(n1)Cl AIFCHEM-94523033726 [0,2,0,0,0,0|2,0,0]=4 187 B13R1.6 CCNCCCc1cccc(c1)Cl AIFCHEM-94537417360 [0,2,0,0,0,0|0,0,0]=2 188 B13R1.6 CCNCCOc1cccc(c1)Cl AIFCHEM-94537424039 [0,2,0,0,0,0|0,0,0]=2 189 B13R1.6 COCCNCc1cccc(c1)I AIFCHEM-6058009349 [0,2,0,0,0,0|1,1,0]=4 190 B13R1.6 COCCNCc1cccc(c1)O AIFCHEM-6048027115 [0,2,0,0,0,0|2,0,0]=4 191 B13R1.6 COCCNCc1cccc(n1)Cl AIFCHEM-6038714550 [0,2,0,0,0,0|2,0,0]=4 192 B13R1.6 CSCCCNc1cc(ccn1)Cl AIFCHEM-94546178965 [0,2,0,0,0,0|2,0,0]=4 193 B13R1.6 CSCCCNc1cccc(c1)Br AIFCHEM-94552684912 [0,2,0,0,0,0|1,1,0]=4 194 B13R1.6 CSCCCNc1cccc(c1)O AIFCHEM-94552449503 [0,2,0,0,0,0|2,0,0]=4 195 B13R1.6 CSCCNCc1cc(ccn1)Cl AIFCHEM-94598923445 [0,2,0,0,0,0|2,0,0]=4 196 B13R1.6 CSCCNCc1cccc(c1)F AIFCHEM-94598922458 [0,2,0,0,0,0|1,1,0]=4 197 B13R1.6 CSCCNCc1cccc(c1)O AIFCHEM-5848592153 [0,2,0,0,0,0|2,0,0]=4 198 B13R1.6 Cc1cccc(c1)CCNCC#N AIFCHEM-94590815231 [0,2,0,0,0,0|1,0,0]=3 199 B13R1.6 Cc1cccc(c1)CCNCCO AIFCHEM-94590809668 [0,2,0,0,0,0|1,0,0]=3 200 B13R1.15 CCC(C)CNc1cccc(c1)O AIFCHEM-5657361707 [0,2,0,0,0,0|2,0,0]=4 201 B13R1.15 CCC(C)CNc1cncc(c1)Cl AIFCHEM-5674164169 [0,2,0,0,0,0|2,0,0]=4 202 B13R1.20 CCCC(C)Nc1cccc(c1)Br AIFCHEM-94552678942 [0,2,0,0,0,0|1,1,0]=4 203 B13R1.20 CCCC(C)Nc1cncc(c1)Cl AIFCHEM-94606115408 [0,2,0,0,0,0|2,0,0]=4 204 B13R1.20 CCCN(C)Cc1cc(ccn1)Cl AIFCHEM-5808634289 [0,2,0,0,0,0|2,0,0]=4 205 B13R1.20 CCCN(C)Cc1cncc(c1)Cl AIFCHEM-5825225205 [0,2,0,0,0,0|2,0,0]=4 206 B13R1.20 COCC(C)Nc1cccc(c1)C AIFCHEM-94565747617 [0,2,0,0,0,0|2,0,0]=4 207 B13R1.20 COCC(C)Nc1cccc(c1)Cl AIFCHEM-94523491911 [0,2,0,0,0,0|1,0,0]=3 208 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523498229 [0,2,0,0,0,0|1,0,1]=4 209 B13R1.55 CCCCNc1cc(cc(c1)Br)C AIFCHEM-94523041350 [0,2,0,0,0,0|1,1,0]=4 210 B13R1.55 CCCCNc1cc(cc(c1)Cl)Cl AIFCHEM-94589168132 [0,2,0,0,0,0|1,0,0]=3 211 B13R1.55 CCCCNc1cc(cc(c1)I)I AIFCHEM-94523036912 [0,2,0,0,0,0|1,1,0]=4 212 B13R1.55 CCCCNc1cc(cc(n1)Cl)I AIFCHEM-94523028212 [0,2,0,0,0,0|2,0,0]=4 213 B13R1.55 CCCNCc1cc(cc(c1)Br)Br AIFCHEM-94558117728 [0,2,0,0,0,0|1,1,0]=4 214 B13R1.55 CCCNCc1cc(cc(c1)Br)F AIFCHEM-5791172309 [0,2,0,0,0,0|1,1,0]=4 215 B13R1.55 CCCNCc1cc(cc(c1)C)C AIFCHEM-94569022543 [0,2,0,0,0,0|2,0,0]=4 216 B13R1.55 CCCNCc1cc(cc(c1)F)O AIFCHEM-94569015120 [0,2,0,0,0,0|1,1,0]=4 217 B13R1.55 CCCNCc1cc(nc(c1)Cl)Cl AIFCHEM-5792605114 [0,2,0,0,0,0|2,0,0]=4 218 B13R1.55 Cc1cc(cc(c1)CNCCF)Cl AIFCHEM-5871213070 [0,2,0,0,0,0|2,0,0]=4 219 B13R1.55 Cc1cc(cc(c1)CNCCO)Cl AIFCHEM-94577775166 [0,2,0,0,0,0|2,0,0]=4 220 B13R1.55 FCCNCc1cc(cc(c1)Br)Cl AIFCHEM-5871146305 [0,2,0,0,0,0|2,0,0]=4 221 B13R1.55 N#CCNCc1cc(cc(c1)Cl)O AIFCHEM-94558704012 [0,2,0,0,0,0|2,0,0]=4 222 B13R1.55 OCCNCc1cc(cc(c1)Br)Cl AIFCHEM-94577777194 [0,2,0,0,0,0|2,0,0]=4 223 B13R1.149 CC(O)CNCc1cccc(c1)I AIFCHEM-6472397370 [0,2,0,0,0,0|1,1,0]=4 224 B13R1.149 CN(C)CCNc1cc(ccn1)I AIFCHEM-94564767551 [0,2,0,0,0,0|1,1,0]=4 225 B13R1.149 CN(C)CCNc1cccc(c1)Cl AIFCHEM-94564756755 [0,2,0,0,0,0|0,0,0]=2 226 B13R1.149 CN(C)CCNc1cccc(n1)Br AIFCHEM-6310235476 [0,2,0,0,0,0|1,1,0]=4 227 B13R1.149 C[C@@H](O)CNCc1cccc(c1)I AIFCHEM-6491308892 [0,2,0,0,0,0|1,1,0]=4 228 B13R1.149 C[C@H](O)CNCc1cccc(c1)I AIFCHEM-6492983779 [0,2,0,0,0,0|1,1,0]=4 229 B13R1.149 Cc1cccc(c1)CNCC(C)C AIFCHEM-94563723600 [0,2,0,0,0,0|2,0,0]=4 230 B13R1.149 Cc1ccnc(c1)NCCN(C)C AIFCHEM-94564769262 [0,2,0,0,0,0|2,0,0]=4 231 B13R1.149 FC(F)CNCc1cccc(c1)Cl AIFCHEM-5987136164 [0,2,0,0,0,0|2,0,0]=4 232 B13R1.149 O=C(O)CNCc1cccc(c1)Cl AIFCHEM-94542885656 [0,2,0,0,0,0|2,0,0]=4 233 B13R1.656 CCCCNc1cc(ccc1Br)Cl AIFCHEM-94523042013 [0,2,0,0,0,0|1,0,0]=3 234 B13R1.656 CCCCNc1cc(ccc1Cl)Br AIFCHEM-94523039782 [0,2,0,0,0,0|1,1,0]=4 235 B13R1.656 CCCCNc1cc(ccc1F)F AIFCHEM-94523037125 [0,2,0,0,0,0|1,1,0]=4 236 B13R1.656 CCCCNc1cc(cnc1Br)Cl AIFCHEM-94523043251 [0,2,0,0,0,0|2,0,0]=4 237 B13R1.656 CCCCNc1cc(cnc1C)Cl AIFCHEM-94523043049 [0,2,0,0,0,0|2,0,0]=4 238 B13R1.656 CCCNCc1cc(ccc1C)Br AIFCHEM-5790508067 [0,2,0,0,0,0|1,1,0]=4 239 B13R1.656 CCCNCc1cc(ccc1C)Cl AIFCHEM-94569016721 [0,2,0,0,0,0|1,0,0]=3 240 B13R1.656 CCCNCc1cc(ccc1Cl)C AIFCHEM-94521367239 [0,2,0,0,0,0|2,0,0]=4 241 B13R1.656 CCCNCc1cc(ccc1Cl)Cl AIFCHEM-5875440022 [0,2,0,0,0,0|1,0,0]=3 242 B13R1.656 CCCNCc1cc(ccc1Cl)O AIFCHEM-94521371166 [0,2,0,0,0,0|2,0,0]=4 243 B13R1.656 CCCNCc1cc(ccc1F)F AIFCHEM-94533430189 [0,2,0,0,0,0|1,1,0]=4 244 B13R1.656 CCCNCc1cc(ccc1O)Br AIFCHEM-5790611825 [0,2,0,0,0,0|1,1,0]=4 245 B13R1.656 CCCNCc1cc(ccc1O)C AIFCHEM-94569015066 [0,2,0,0,0,0|2,0,0]=4 246 B13R1.656 CCCNCc1cc(ccc1O)Cl AIFCHEM-94521370715 [0,2,0,0,0,0|1,0,0]=3 247 B13R1.656 CCCNCc1cc(ccc1O)F AIFCHEM-94569009636 [0,2,0,0,0,0|1,1,0]=4 248 B13R1.656 CCCNCc1cc(ccc1O)I AIFCHEM-5853381453 [0,2,0,0,0,0|1,1,0]=4 249 B13R1.656 CCCNCc1cc(ccc1O)O AIFCHEM-5790937787 [0,2,0,0,0,0|2,0,0]=4 250 B13R1.656 CCCNCc1nc(ccc1Br)Cl AIFCHEM-94521365928 [0,2,0,0,0,0|2,0,0]=4 251 B13R1.656 OCCNCc1cc(ccc1O)Cl AIFCHEM-94577780068 [0,2,0,0,0,0|2,0,0]=4 252 B13R1.656 Oc1ccc(cc1CNCCF)Cl AIFCHEM-5800501185 [0,2,0,0,0,0|2,0,0]=4 253 B13R1.666 CCCNCc1cccc(c1)CC AIFCHEM-94521369079 [0,2,0,0,0,0|2,0,0]=4 254 B13R1.669 CCCCNc1cc(c(cn1)I)Cl AIFCHEM-94523040569 [0,2,0,0,0,0|2,0,0]=4 255 B13R1.669 CCCCNc1ccc(c(c1)Br)C AIFCHEM-94523041664 [0,2,0,0,0,0|1,1,0]=4 256 B13R1.669 CCCCNc1ccc(c(c1)C)Cl AIFCHEM-94583424537 [0,2,0,0,0,0|2,0,0]=4 257 B13R1.669 CCCCNc1ccc(c(c1)Cl)Br AIFCHEM-94523034671 [0,2,0,0,0,0|1,0,0]=3 258 B13R1.669 CCCCNc1ccc(c(c1)Cl)F AIFCHEM-94523037120 [0,2,0,0,0,0|1,0,0]=3 259 B13R1.669 CCCCNc1ccc(c(c1)Cl)O AIFCHEM-94523037464 [0,2,0,0,0,0|1,0,0]=3 260 B13R1.669 CCCCNc1ccc(c(c1)F)O AIFCHEM-94559733224 [0,2,0,0,0,0|1,1,0]=4 261 B13R1.669 CCCCNc1ccc(c(c1)I)Cl AIFCHEM-94523039375 [0,2,0,0,0,0|1,1,0]=4 262 B13R1.669 CCCCNc1ccc(c(c1)O)F AIFCHEM-94523027552 [0,2,0,0,0,0|2,0,0]=4 263 B13R1.669 CCCNCc1ccc(c(c1)C)F AIFCHEM-94569016459 [0,2,0,0,0,0|2,0,0]=4 264 B13R1.669 CCCNCc1ccc(c(c1)F)F AIFCHEM-5790616451 [0,2,0,0,0,0|1,1,0]=4 265 B13R1.669 CCCNCc1ccc(c(c1)F)I AIFCHEM-94521365669 [0,2,0,0,0,0|1,1,0]=4 266 B13R1.669 CCCNCc1ccc(c(c1)O)Br AIFCHEM-5792696110 [0,2,0,0,0,0|2,0,0]=4 267 B13R1.669 CCCNCc1ccc(c(c1)O)O AIFCHEM-94569013456 [0,2,0,0,0,0|2,0,0]=4 268 B13R1.669 CCCNCc1cnc(c(c1)Cl)O AIFCHEM-94521370644 [0,2,0,0,0,0|2,0,0]=4 269 B13R1.669 Cc1ccc(cc1Cl)CNCCO AIFCHEM-6411709093 [0,2,0,0,0,0|2,0,0]=4 270 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl AIFCHEM-94535596079 [0,2,0,0,0,0|2,0,0]=4 271 B13R1.2872 CCN(C)Cc1cc(ccc1Br)Cl AIFCHEM-6173113625 [0,2,0,0,0,0|2,0,0]=4 272 B13R1.2872 CCN(C)Cc1cc(ccc1C)Cl AIFCHEM-6124758351 [0,2,0,0,0,0|2,0,0]=4 273 B13R1.2872 CCN(C)Cc1cc(ccc1O)Cl AIFCHEM-6097648541 [0,2,0,0,0,0|2,0,0]=4 274 B13R1.2879 CCN(C)Cc1ccc(c(c1)Cl)C AIFCHEM-94563258156 [0,2,0,0,0,0|2,0,0]=4 275 B13R1.136 CCCNc1cc(c(c(c1)Cl)C)Cl AIFCHEM-94569019834 [0,2,0,0,0,0|2,0,0]=4 276 B13R1.136 CCCNc1cc(c(c(c1)Cl)Cl)C AIFCHEM-94569019418 [0,2,0,0,0,0|2,0,0]=4 277 B13R1.3420 CC(C)CNc1cc(cc(c1)Br)Cl AIFCHEM-94572987003 [0,2,0,0,0,0|2,0,0]=4 278 B13R1.3420 CC(C)NCc1cc(cc(c1)Cl)Cl AIFCHEM-94520536378 [0,2,0,0,0,0|2,0,0]=4 279 B13R1.3420 CC(C)NCc1cc(cc(c1)Cl)F AIFCHEM-94520542586 [0,2,0,0,0,0|2,0,0]=4 280 B13R1.3420 Cc1cc(cc(c1)CNC(C)C)Cl AIFCHEM-94520536428 [0,2,0,0,0,0|2,0,0]=4 281 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br AIFCHEM-94590031293 [0,2,0,0,0,0|2,0,0]=4 282 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F AIFCHEM-5841829334 [0,2,0,0,0,0|2,0,0]=4 283 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl AIFCHEM-94589407195 [0,2,0,0,0,0|2,0,0]=4 284 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl AIFCHEM-94570248829 [0,2,0,0,0,0|2,0,0]=4 285 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl AIFCHEM-94535596130 [0,2,0,0,0,0|2,0,0]=4 286 B13R1.893 CC(C)NCc1cc(ccc1Br)Cl AIFCHEM-94520538238 [0,2,0,0,0,0|2,0,0]=4 287 B13R1.893 CC(C)NCc1cc(ccc1I)Cl AIFCHEM-94520536263 [0,2,0,0,0,0|2,0,0]=4 288 B13R1.893 CC(C)NCc1cc(ccc1O)Cl AIFCHEM-94520541330 [0,2,0,0,0,0|2,0,0]=4 289 B13R1.556 CCCNc1cc(ccc1CC)Cl AIFCHEM-94569018107 [0,2,0,0,0,0|2,0,0]=4 290 B13R1.1630 CCCNc1cc(c(cc1C)Br)Cl AIFCHEM-94569017041 [0,2,0,0,0,0|2,0,0]=4 291 B13R1.1630 CCCNc1cc(c(cc1Cl)Br)Cl AIFCHEM-94569014673 [0,2,0,0,0,0|2,0,0]=4 292 B13R1.1630 CCCNc1cc(c(cc1I)F)Cl AIFCHEM-94569023068 [0,2,0,0,0,0|2,0,0]=4 293 B13R1.577 CCCNc1ccc(c(c1)Cl)CO AIFCHEM-94569019373 [0,2,0,0,0,0|2,0,0]=4 294 B13R1.577 CCCNc1ccc(c(c1)Cl)OC AIFCHEM-94584568796 [0,2,0,0,0,0|2,0,0]=4 295 B13R2.662 CCN1CCc2c1ccc(c2)Br AIFCHEM-94537418612 [0,1,0,1,0,0|0,1,0]=3 296 B13R2.662 CCN1CCc2c1ccc(c2)F AIFCHEM-94537418893 [0,1,0,1,0,0|0,1,0]=3 297 B13R2.662 CCN1CCc2c1ccc(c2)O AIFCHEM-94537427205 [0,1,0,1,0,0|1,0,0]=3 298 B13R2.662 CCN1CCc2c1ccc(n2)Br AIFCHEM-94537414004 [0,1,0,1,0,0|1,1,0]=4 299 B13R2.662 CCN1CCc2c1cnc(c2)Cl AIFCHEM-94537413061 [0,1,0,1,0,0|1,0,0]=3 300 B13R2.2091 CCN1CCc2c1c(ccc2)Br AIFCHEM-94537423754 [0,1,0,1,0,0|0,1,0]=3 301 B13R2.2091 CCN1CCc2c1c(ccc2)C AIFCHEM-94537424119 [0,1,0,1,0,0|1,0,0]=3 302 B13R2.3021 Cc1cccc(c1)NC2COC2 AIFCHEM-6122882906 [0,1,0,1,0,0|2,0,0]=4 303 B13R2.3021 Fc1cccc(c1)NC2COC2 AIFCHEM-94579353785 [0,1,0,1,0,0|1,1,0]=4 304 B13R2.5331 Brc1cccc(c1)CNC2CC2 AIFCHEM-94573315531 [0,1,0,1,0,0|1,1,0]=4 305 B13R2.5331 Clc1ccnc(c1)NCC2CC2 AIFCHEM-5902775340 [0,1,0,1,0,0|2,0,0]=4