0 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.17 CCCNc1ncccn1 AIFCHEM-94569009150 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.17 OCC=Cc1cccnn1 AIFCHEM-6295998276 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.8 CCNc1ccnnc1 AIFCHEM-94537418084 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.8 CCNc1cnccn1 AIFCHEM-94537422176 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.1 CCCNc1ccc(cc1)F AIFCHEM-94569015457 [0,1,0,0,0,0|2,0,0]=3 8 B11R1.1 CCCNc1ccc(cn1)I AIFCHEM-94569015081 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.1 CCCNc1ccc(nc1)C AIFCHEM-94569017543 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.1 CCCNc1ccc(nc1)F AIFCHEM-94569014315 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.1 CCNCc1ccc(cc1)Cl AIFCHEM-94537411696 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.1 CCNCc1ccc(cc1)F AIFCHEM-94530368408 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.1 Cc1ccc(cc1)C=CCO AIFCHEM-6341313267 [0,1,0,0,0,0|1,0,1]=3 14 B11R1.1 Nc1ccc(nc1)C=CCO AIFCHEM-6290912965 [0,1,0,0,0,0|2,0,1]=4 15 B11R1.1 OCC=Cc1ccc(cc1)F AIFCHEM-6361757288 [0,1,0,0,0,0|1,0,1]=3 16 B11R1.17 CCCNc1ccccc1F AIFCHEM-94569019341 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.17 CCCNc1cccnc1C AIFCHEM-94569017542 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.17 CCCNc1cccnc1O AIFCHEM-94569017482 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.17 CCCNc1cnccc1C AIFCHEM-94569017546 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.17 CCCNc1ncccc1C AIFCHEM-94569013329 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.17 CCCNc1ncccc1O AIFCHEM-94569013697 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.17 CCNCc1ccccc1F AIFCHEM-94520796946 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.17 CCNCc1ccccc1O AIFCHEM-94537427248 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.17 Cc1ccncc1C=CCO AIFCHEM-6424106960 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.17 OCC=Cc1ccccc1O AIFCHEM-6364368587 [0,1,0,0,0,0|1,0,1]=3 26 B11R1.24 CCCNc1cc(ccn1)C AIFCHEM-94569021601 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.24 CCCNc1cc(ccn1)Cl AIFCHEM-94569014823 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.24 CCCNc1cccc(c1)Br AIFCHEM-94552679825 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.24 CCCNc1cccc(c1)F AIFCHEM-94579349397 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.24 CCNCc1cccc(c1)C AIFCHEM-94537252418 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.24 Cc1cc(ccn1)C=CCO AIFCHEM-6288997802 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.24 Cc1cccc(c1)C=CCO AIFCHEM-6381275994 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.24 Cc1cccc(n1)C=CCO AIFCHEM-6310808161 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.24 Cc1ccnc(c1)C=CCO AIFCHEM-6260228726 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.24 Nc1cccc(n1)C=CCO AIFCHEM-6434654348 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.24 OCC=Cc1cccc(c1)O AIFCHEM-6420389960 [0,1,0,0,0,0|1,0,1]=3 37 B11R1.24 OCC=Cc1cncc(c1)O AIFCHEM-6406081445 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.28 CCCNCc1ccncc1 AIFCHEM-5790435281 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.28 FCCNCc1ccccn1 AIFCHEM-5801248605 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.28 OCCNCc1ccncn1 AIFCHEM-6389148719 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.28 OCCNCc1ncccn1 AIFCHEM-6481313728 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.40 CCN(C)Cc1ccccc1 AIFCHEM-94537411577 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.40 O=C(CO)Nc1cccnc1 AIFCHEM-94531016168 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.91 CC(C)CNc1ccccn1 AIFCHEM-94572981495 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.91 CC(C)CNc1cccnc1 AIFCHEM-94572981207 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.12 OCC=Cc1ccoc1 AIFCHEM-6192990360 [0,0,0,0,1,0|2,0,1]=4 47 B10R1.1 CC=Cc1ccc(cc1)N AIFCHEM-94608719473 [1,1,0,0,0,0|1,0,1]=4 48 B10R1.1 CCNc1ccc(cc1)C AIFCHEM-94537411875 [1,1,0,0,0,0|1,0,0]=3 49 B10R1.1 CCNc1ccc(nc1)Br AIFCHEM-94537414731 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.1 CCNc1ccc(nc1)F AIFCHEM-94537417232 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.1 CCNc1ccc(nc1)O AIFCHEM-94537412774 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.4 CC=Cc1ccccc1C AIFCHEM-6371242545 [1,1,0,0,0,0|1,0,1]=4 53 B10R1.4 CCNc1ccccc1Br AIFCHEM-94537427481 [1,1,0,0,0,0|1,0,0]=3 54 B10R1.4 CCNc1ccccc1O AIFCHEM-94537427514 [1,1,0,0,0,0|1,0,0]=3 55 B10R1.4 CCNc1cccnc1Br AIFCHEM-94537421189 [1,1,0,0,0,0|2,0,0]=4 56 B10R1.4 CCNc1cccnc1I AIFCHEM-94537418171 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.4 CCNc1ccncc1Br AIFCHEM-94537414732 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.4 CCNc1ccncc1C AIFCHEM-94537417774 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.4 CCNc1ccncc1Cl AIFCHEM-94537417739 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.4 CCNc1ccncc1F AIFCHEM-94537418714 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.4 CCNc1ccncc1I AIFCHEM-94537426496 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.4 CCNc1ncccc1Br AIFCHEM-94537414733 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.4 CCNc1ncccc1C AIFCHEM-94537416246 [1,1,0,0,0,0|2,0,0]=4 64 B10R1.4 CCNc1ncccc1Cl AIFCHEM-94537421147 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.10 CCNc1cccc(n1)Br AIFCHEM-94537417741 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.10 CCNc1cccc(n1)Cl AIFCHEM-94537421828 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.10 CCNc1cncc(c1)Br AIFCHEM-94537414734 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.10 CCNc1cncc(c1)C AIFCHEM-94524188643 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.10 CCNc1cncc(c1)Cl AIFCHEM-94537418676 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.10 CCNc1cncc(c1)O AIFCHEM-94532888502 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.15 CCN(C)c1cccnc1 AIFCHEM-94537417258 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.18 CC(=Cc1ccccc1)C AIFCHEM-6323250098 [1,1,0,0,0,0|1,0,1]=4 73 B12R1.1 CCCCNc1ccc(cc1)C AIFCHEM-94523028188 [0,2,0,0,0,0|2,0,0]=4 74 B12R1.1 CCCCNc1ccc(cc1)F AIFCHEM-94523042368 [0,2,0,0,0,0|2,0,0]=4 75 B12R1.1 COCC=Cc1ccc(cc1)F AIFCHEM-6359501464 [0,2,0,0,0,0|1,0,1]=4 76 B12R1.1 Cc1ccc(cc1)CNCCF AIFCHEM-5861558895 [0,2,0,0,0,0|2,0,0]=4 77 B12R1.1 FCCNCc1ccc(cc1)Cl AIFCHEM-5800462737 [0,2,0,0,0,0|2,0,0]=4 78 B12R1.1 FCCNCc1ccc(cc1)I AIFCHEM-5853759708 [0,2,0,0,0,0|2,0,0]=4 79 B12R1.1 OCCNCc1ccc(cc1)O AIFCHEM-6411472161 [0,2,0,0,0,0|1,0,0]=3 80 B12R1.1 OCCNCc1ccc(cn1)Cl AIFCHEM-94577778244 [0,2,0,0,0,0|2,0,0]=4 81 B12R1.16 CCCN(C)c1ccc(cc1)C AIFCHEM-94569020742 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.16 CCCN(C)c1ccc(cc1)I AIFCHEM-94569022906 [0,2,0,0,0,0|2,0,0]=4 83 B12R1.21 CC(O)C=Cc1ccc(cc1)O AIFCHEM-94601033022 [0,2,0,0,0,0|1,0,1]=4 84 B12R1.21 Cc1ccc(cc1)C=CC(C)O AIFCHEM-94528939842 [0,2,0,0,0,0|1,0,1]=4 85 B12R1.49 CC(CO)Nc1ccc(cc1)F AIFCHEM-94552015989 [0,2,0,0,0,0|1,0,0]=3 86 B12R1.49 Cc1ccc(cn1)NC(C)CO AIFCHEM-6030935790 [0,2,0,0,0,0|2,0,0]=4 87 B12R1.49 O=C(CO)Nc1ccc(cc1)I AIFCHEM-94532683447 [0,2,0,0,0,0|1,0,1]=4 88 B12R1.49 O=C(CO)Nc1ccc(cc1)O AIFCHEM-94532676141 [0,2,0,0,0,0|1,0,1]=4 89 B12R1.69 CCCNc1ccc(cc1Br)Br AIFCHEM-94569020646 [0,2,0,0,0,0|2,0,0]=4 90 B12R1.69 CCCNc1ccc(cc1Br)Cl AIFCHEM-94569023399 [0,2,0,0,0,0|2,0,0]=4 91 B12R1.69 CCCNc1ccc(cc1Br)I AIFCHEM-94569016947 [0,2,0,0,0,0|2,0,0]=4 92 B12R1.69 CCCNc1ccc(cc1C)O AIFCHEM-94569016792 [0,2,0,0,0,0|2,0,0]=4 93 B12R1.69 CCCNc1ccc(cc1Cl)C AIFCHEM-94569020647 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.69 CCCNc1ccc(cc1I)C AIFCHEM-94569016914 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.69 CCCNc1ccc(cc1O)Cl AIFCHEM-94569016810 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.69 Cc1ccc(c(c1)C)C=CCO AIFCHEM-94607013894 [0,2,0,0,0,0|1,0,1]=4 97 B12R1.69 Cc1ccc(c(c1)F)C=CCO AIFCHEM-6337803033 [0,2,0,0,0,0|1,0,1]=4 98 B12R1.69 Nc1cc(ccc1C=CCO)O AIFCHEM-6118720578 [0,2,0,0,0,0|1,0,1]=4 99 B12R1.69 OCC=Cc1ccc(cc1O)O AIFCHEM-6301496114 [0,2,0,0,0,0|1,0,1]=4 100 B12R1.71 CCCNc1ccc(cc1)OC AIFCHEM-94569015005 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.71 CSc1ccc(cc1)C=CCO AIFCHEM-6381160487 [0,2,0,0,0,0|1,0,1]=4 102 B12R1.71 N#Cc1ccc(cc1)C=CCO AIFCHEM-6325207024 [0,2,0,0,0,0|1,0,1]=4 103 B12R1.71 NCc1ccc(cc1)C=CCO AIFCHEM-5598304750 [0,2,0,0,0,0|1,0,1]=4 104 B12R1.385 CCCNc1ccc(c(c1)Br)Cl AIFCHEM-94569022782 [0,2,0,0,0,0|2,0,0]=4 105 B12R1.385 CCCNc1ccc(c(c1)C)Br AIFCHEM-94569015014 [0,2,0,0,0,0|2,0,0]=4 106 B12R1.385 CCCNc1ccc(c(c1)Cl)Br AIFCHEM-94569015441 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.385 CCCNc1ccc(c(c1)I)Cl AIFCHEM-94569020145 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.385 Nc1cc(ccc1F)C=CCO AIFCHEM-6156626666 [0,2,0,0,0,0|1,0,1]=4 109 B12R1.385 OCC=Cc1ccc(c(c1)F)O AIFCHEM-6209350294 [0,2,0,0,0,0|1,0,1]=4 110 B12R1.385 OCC=Cc1ccc(c(c1)O)O AIFCHEM-6413125974 [0,2,0,0,0,0|1,0,1]=4 111 B12R1.30 CCCNC(=O)c1ccccc1 AIFCHEM-94565582226 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.308 CCCN(C)c1ccccc1Br AIFCHEM-94569021465 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.25 CCCNc1cccc(c1C)Br AIFCHEM-94585196993 [0,2,0,0,0,0|2,0,0]=4 114 B12R1.25 CCCNc1cccc(c1C)C AIFCHEM-94569023327 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.25 CCCNc1cccc(c1F)C AIFCHEM-94569014814 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.25 CCCNc1cccc(c1O)Br AIFCHEM-94569016759 [0,2,0,0,0,0|2,0,0]=4 117 B12R1.25 OCC=Cc1cccc(c1O)O AIFCHEM-6309534545 [0,2,0,0,0,0|1,0,1]=4 118 B12R1.121 CCCNc1ccccc1SC AIFCHEM-94569016982 [0,2,0,0,0,0|2,0,0]=4 119 B12R1.121 CCc1ccccc1C=CCO AIFCHEM-6403285681 [0,2,0,0,0,0|1,0,1]=4 120 B12R1.125 CC(C)CNc1ccccc1F AIFCHEM-94582105931 [0,2,0,0,0,0|2,0,0]=4 121 B12R1.125 CC(O)C=Cc1ccccc1F AIFCHEM-6194306919 [0,2,0,0,0,0|1,0,1]=4 122 B12R1.267 CCCNCc1ccccc1Cl AIFCHEM-94555005997 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.267 CCCNCc1ccccc1O AIFCHEM-94592060285 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.267 COCC=Cc1ccccc1F AIFCHEM-6203896649 [0,2,0,0,0,0|1,0,1]=4 125 B12R1.267 COCC=Cc1ccccc1O AIFCHEM-6341471182 [0,2,0,0,0,0|1,0,1]=4 126 B12R1.267 Cc1cccnc1CNCCO AIFCHEM-6463388064 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.267 OCCNCc1ccccc1O AIFCHEM-94532459344 [0,2,0,0,0,0|1,0,0]=3 128 B12R1.267 OCCNCc1cccnc1Br AIFCHEM-94577776039 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.267 OCCNCc1ccncc1Cl AIFCHEM-6481474968 [0,2,0,0,0,0|2,0,0]=4 130 B12R1.267 OCCNCc1ccncc1F AIFCHEM-94577778813 [0,2,0,0,0,0|2,0,0]=4 131 B12R1.267 OCCNCc1ncccc1Br AIFCHEM-6481413800 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.267 Oc1ccccc1CNCCF AIFCHEM-94532465977 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.371 CC(CO)Nc1ccccc1O AIFCHEM-94521333642 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.371 O=C(CO)Nc1ccccc1I AIFCHEM-94532684184 [0,2,0,0,0,0|1,0,1]=4 135 B12R1.374 CCCNc1cc(ccc1Br)Br AIFCHEM-94570336825 [0,2,0,0,0,0|2,0,0]=4 136 B12R1.374 CCCNc1cc(ccc1Br)I AIFCHEM-94569009317 [0,2,0,0,0,0|2,0,0]=4 137 B12R1.374 CCCNc1cc(ccc1C)Br AIFCHEM-94569018213 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.374 CCCNc1cc(ccc1Cl)C AIFCHEM-94569024602 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.374 CCCNc1cc(ccc1F)Cl AIFCHEM-94569015331 [0,2,0,0,0,0|2,0,0]=4 140 B12R1.374 CCCNc1cc(ccc1F)O AIFCHEM-94569020737 [0,2,0,0,0,0|2,0,0]=4 141 B12R1.374 CCCNc1cc(ccc1O)Br AIFCHEM-94569018465 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.374 CCCNc1cc(ccc1O)O AIFCHEM-94569015160 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.374 Nc1ccc(c(c1)C=CCO)F AIFCHEM-5796105624 [0,2,0,0,0,0|1,0,1]=4 144 B12R1.374 OCC=Cc1cc(ccc1F)O AIFCHEM-6316570592 [0,2,0,0,0,0|1,0,1]=4 145 B12R1.1631 Cc1cccc(c1C=CCO)F AIFCHEM-6339770229 [0,2,0,0,0,0|1,0,1]=4 146 B12R1.1631 Cc1cccc(c1C=CCO)N AIFCHEM-5754692448 [0,2,0,0,0,0|1,0,1]=4 147 B12R1.1631 Cc1cccc(c1C=CCO)O AIFCHEM-6378257590 [0,2,0,0,0,0|1,0,1]=4 148 B12R1.1631 Nc1cccc(c1C=CCO)O AIFCHEM-5847428384 [0,2,0,0,0,0|1,0,1]=4 149 B12R1.1631 OCC=Cc1c(cccc1F)F AIFCHEM-6357391618 [0,2,0,0,0,0|1,0,1]=4 150 B12R1.1631 OCC=Cc1c(cccc1F)O AIFCHEM-6381666064 [0,2,0,0,0,0|1,0,1]=4 151 B12R1.28 CCCC=Cc1cccc(c1)F AIFCHEM-6382549502 [0,2,0,0,0,0|2,0,0]=4 152 B12R1.28 CCCCNc1cccc(c1)Br AIFCHEM-94552679827 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.28 CCCCNc1cccc(c1)I AIFCHEM-94523040021 [0,2,0,0,0,0|2,0,0]=4 154 B12R1.28 CCCNCc1cccc(c1)O AIFCHEM-94569022018 [0,2,0,0,0,0|2,0,0]=4 155 B12R1.28 COCC=Cc1cccc(c1)N AIFCHEM-94552694627 [0,2,0,0,0,0|1,0,1]=4 156 B12R1.28 Cc1cc(ccn1)CNCCO AIFCHEM-6481582523 [0,2,0,0,0,0|2,0,0]=4 157 B12R1.28 Cc1cncc(c1)CNCCO AIFCHEM-94577775047 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.28 OCCNCc1cc(ccn1)Br AIFCHEM-94577776143 [0,2,0,0,0,0|2,0,0]=4 159 B12R1.50 CC(CO)Nc1cccc(c1)Cl AIFCHEM-94523487703 [0,2,0,0,0,0|1,0,0]=3 160 B12R1.50 CC(CO)Nc1ccnc(c1)O AIFCHEM-94552259573 [0,2,0,0,0,0|2,0,0]=4 161 B12R1.100 CCCNc1cc(cc(c1)Br)Cl AIFCHEM-94569024749 [0,2,0,0,0,0|2,0,0]=4 162 B12R1.100 CCCNc1cc(cc(c1)F)F AIFCHEM-94569017963 [0,2,0,0,0,0|2,0,0]=4 163 B12R1.100 CCCNc1cc(cc(c1)I)I AIFCHEM-94569017682 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.100 CCCNc1cc(cc(c1)O)C AIFCHEM-94569022321 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.100 Cc1cc(cc(c1)C=CCO)F AIFCHEM-6354116384 [0,2,0,0,0,0|1,0,1]=4 166 B12R1.100 Nc1cc(cc(c1)C=CCO)F AIFCHEM-6050088281 [0,2,0,0,0,0|1,0,1]=4 167 B12R1.382 CCCNc1cccc(c1)C#N AIFCHEM-94571669059 [0,2,0,0,0,0|2,0,0]=4 168 B12R1.382 N#Cc1cccc(c1)C=CCO AIFCHEM-6289569821 [0,2,0,0,0,0|1,0,1]=4 169 B12R1.8 CCNCCOc1cccnc1 AIFCHEM-94537420048 [0,2,0,0,0,0|2,0,0]=4 170 B12R1.8 OCCCNCc1cccnc1 AIFCHEM-94523164274 [0,2,0,0,0,0|2,0,0]=4 171 B12R1.32 CN(CCO)Cc1cccnc1 AIFCHEM-94548505566 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.32 COCC(C)Nc1ccncc1 AIFCHEM-94533893127 [0,2,0,0,0,0|2,0,0]=4 173 B12R1.32 O=C(CCO)Nc1ccccc1 AIFCHEM-94552044770 [0,2,0,0,0,0|1,0,0]=3 174 B12R1.32 O=C(CCO)Nc1ccncc1 AIFCHEM-94533901418 [0,2,0,0,0,0|2,0,0]=4 175 B12R1.252 CC(O)CNCc1ccncc1 AIFCHEM-6416585554 [0,2,0,0,0,0|2,0,0]=4 176 B12R1.252 C[C@@H](O)CNCc1ccncc1 AIFCHEM-6490834951 [0,2,0,0,0,0|2,0,0]=4 177 B12R1.252 C[C@H](O)CNCc1ccncc1 AIFCHEM-6495203428 [0,2,0,0,0,0|2,0,0]=4 178 B12R1.118 CCC(CO)Nc1ccccc1 AIFCHEM-94552035952 [0,2,0,0,0,0|1,0,0]=3 179 B12R1.118 CCC(CO)Nc1cccnc1 AIFCHEM-94531005469 [0,2,0,0,0,0|2,0,0]=4 180 B12R1.118 OCC(CO)Nc1cccnc1 AIFCHEM-94531007839 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.891 CC(C)(O)C=Cc1ccccc1 AIFCHEM-94590917375 [0,2,0,0,0,0|1,0,1]=4 182 B12R2.2 C1=C(CCC1)c2ccccc2 AIFCHEM-94590916958 [0,1,0,1,0,0|2,0,0]=4 183 B12R2.2 C1=C(COC1)c2ccccc2 AIFCHEM-6345845864 [0,1,0,1,0,0|1,0,1]=4 184 B12R2.2058 C(=C1CCC1)c2ccccc2 AIFCHEM-6322825111 [0,1,0,1,0,0|2,0,0]=4 185 B12R2.2058 c1cncc(c1)NC2COC2 AIFCHEM-94531006465 [0,1,0,1,0,0|2,0,0]=4 186 B8R1.8 CCNc1ccsc1 AIFCHEM-94568866699 [1,0,0,0,1,0|2,0,0]=4