0 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.8 CCNc1ccnnc1 AIFCHEM-94537418084 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 CCNc1cnccn1 AIFCHEM-94537422176 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.8 CCNc1nccnn1 AIFCHEM-94537412256 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.1 CC=Cc1ccc(cn1)F AIFCHEM-6302156631 [0,1,0,0,0,0|1,0,2]=4 5 B10R1.1 CCNc1ccc(cc1)C AIFCHEM-94537411875 [0,1,0,0,0,0|3,0,0]=4 6 B10R1.1 CCNc1ccc(nc1)Br AIFCHEM-94537414731 [0,1,0,0,0,0|2,0,0]=3 7 B10R1.1 CCNc1ccc(nc1)F AIFCHEM-94537417232 [0,1,0,0,0,0|2,0,0]=3 8 B10R1.1 CCNc1ccc(nc1)O AIFCHEM-94537412774 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.1 CCNc1ccc(nn1)Br AIFCHEM-94537426493 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.1 CCNc1cnc(cn1)Br AIFCHEM-94537423315 [0,1,0,0,0,0|1,0,0]=2 11 B10R1.4 CC=Cc1cnccc1F AIFCHEM-6369068956 [0,1,0,0,0,0|1,0,2]=4 12 B10R1.4 CC=Cc1ncc[nH]c1=O AIFCHEM-6293879101 [0,1,0,0,0,0|0,0,3]=4 13 B10R1.4 CCNc1ccccc1Br AIFCHEM-94537427481 [0,1,0,0,0,0|3,0,0]=4 14 B10R1.4 CCNc1ccccc1O AIFCHEM-94537427514 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.4 CCNc1cccnc1Br AIFCHEM-94537421189 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.4 CCNc1cccnc1I AIFCHEM-94537418171 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.4 CCNc1ncccc1Br AIFCHEM-94537414733 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.4 CCNc1ncccc1C AIFCHEM-94537416246 [0,1,0,0,0,0|2,0,0]=3 19 B10R1.4 CCNc1ncccc1Cl AIFCHEM-94537421147 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.4 CCNc1nccnc1Cl AIFCHEM-94537424414 [0,1,0,0,0,0|1,0,0]=2 21 B10R1.10 CC=Cc1cc(ccn1)C AIFCHEM-6229029433 [0,1,0,0,0,0|1,0,2]=4 22 B10R1.10 CC=Cc1cc(ccn1)F AIFCHEM-6308154391 [0,1,0,0,0,0|1,0,2]=4 23 B10R1.10 CCNc1cccc(n1)Br AIFCHEM-94537417741 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.10 CCNc1cccc(n1)Cl AIFCHEM-94537421828 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.10 CCNc1ccnc(n1)Cl AIFCHEM-94537425041 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.10 CCNc1cncc(c1)Br AIFCHEM-94537414734 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.10 CCNc1cncc(c1)C AIFCHEM-94524188643 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.10 CCNc1cncc(c1)Cl AIFCHEM-94537418676 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.10 CCNc1cncc(c1)O AIFCHEM-94532888502 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.10 CCNc1cncc(n1)C AIFCHEM-94537422804 [0,1,0,0,0,0|1,0,0]=2 31 B10R1.10 CCNc1cnnc(c1)Cl AIFCHEM-94537419800 [0,1,0,0,0,0|3,0,0]=4 32 B10R1.10 CCNc1nccc(n1)I AIFCHEM-94537425666 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.15 C/C=C(\C)/c1ccccn1 AIFCHEM-94584209692 [0,1,0,0,0,0|1,0,2]=4 34 B10R1.15 C/C=C(\C)/c1cnccn1 AIFCHEM-94584219793 [0,1,0,0,0,0|0,0,2]=3 35 B10R1.15 CCN(C)c1cccnc1 AIFCHEM-94537417258 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.17 CCCNc1ncccn1 AIFCHEM-94569009150 [0,1,0,0,0,0|2,0,0]=3 38 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.17 CCNCc1cnccn1 AIFCHEM-94537417821 [0,1,0,0,0,0|0,0,0]=1 40 B8R1.8 CC=Cc1ncc[nH]1 AIFCHEM-6407688555 [0,0,0,0,1,0|0,0,3]=4 41 B8R1.8 CCNc1ccsc1 AIFCHEM-94568866699 [0,0,0,0,1,0|2,0,0]=3 42 B8R1.8 CCNc1cnoc1 AIFCHEM-94537412046 [0,0,0,0,1,0|2,0,0]=3 43 B8R1.8 CCNc1cscn1 AIFCHEM-94537423279 [0,0,0,0,1,0|2,0,0]=3 44 B8R1.8 CCNc1nnco1 AIFCHEM-94537420944 [0,0,0,0,1,0|3,0,0]=4 45 B9R1.7 CCNc1cc(n[nH]1)Br AIFCHEM-94548018960 [0,1,0,0,1,0|2,0,0]=4 46 B9R1.7 CCNc1cnn(n1)C AIFCHEM-94537418186 [0,1,0,0,1,0|2,0,0]=4 47 B9R1.7 CCNc1nc(cs1)Br AIFCHEM-94537422116 [0,1,0,0,1,0|2,0,0]=4 48 B9R1.12 CCCNc1cn[nH]c1 AIFCHEM-94569018719 [0,1,0,0,1,0|1,0,0]=3 49 B9R1.12 CCCNc1cncs1 AIFCHEM-94535760097 [0,1,0,0,1,0|1,0,0]=3 50 B9R1.12 CCCNc1cscn1 AIFCHEM-94557114815 [0,1,0,0,1,0|1,0,0]=3 51 B9R1.12 CCNCc1ccco1 AIFCHEM-94594829503 [0,1,0,0,1,0|1,0,0]=3 52 B9R1.12 CCNCc1cocn1 AIFCHEM-94553456429 [0,1,0,0,1,0|1,0,0]=3 53 B9R1.33 CCNc1c[nH]nc1Br AIFCHEM-94537414927 [0,1,0,0,1,0|2,0,0]=4 54 B9R1.33 CCNc1n[nH]cc1Cl AIFCHEM-94537422685 [0,1,0,0,1,0|2,0,0]=4 55 B11R1.1 CCCNc1ccc(cc1)F AIFCHEM-94569015457 [0,2,0,0,0,0|2,0,0]=4 56 B11R1.1 CCCNc1ccc(cn1)I AIFCHEM-94569015081 [0,2,0,0,0,0|1,0,0]=3 57 B11R1.1 CCCNc1ccc(nc1)C AIFCHEM-94569017543 [0,2,0,0,0,0|1,0,0]=3 58 B11R1.1 CCCNc1ccc(nc1)F AIFCHEM-94569014315 [0,2,0,0,0,0|1,0,0]=3 59 B11R1.1 CCNCc1ccc(cc1)Cl AIFCHEM-94537411696 [0,2,0,0,0,0|2,0,0]=4 60 B11R1.1 CCNCc1ccc(cc1)F AIFCHEM-94530368408 [0,2,0,0,0,0|2,0,0]=4 61 B11R1.1 CCNCc1ccc(cn1)F AIFCHEM-94537422895 [0,2,0,0,0,0|1,0,0]=3 62 B11R1.1 CCNCc1ccc(nc1)Br AIFCHEM-94537413218 [0,2,0,0,0,0|1,0,0]=3 63 B11R1.1 CCNCc1ccc(nc1)C AIFCHEM-94537422957 [0,2,0,0,0,0|1,0,0]=3 64 B11R1.1 CCNCc1cnc(cn1)C AIFCHEM-94537414501 [0,2,0,0,0,0|0,0,0]=2 65 B11R1.1 CCNCc1ncc(cn1)Cl AIFCHEM-94537416276 [0,2,0,0,0,0|2,0,0]=4 66 B11R1.1 Cc1cnc(cn1)C=CCO AIFCHEM-6303871943 [0,2,0,0,0,0|0,0,2]=4 67 B11R1.1 OCC=Cc1cnc(cn1)O AIFCHEM-6376252210 [0,2,0,0,0,0|0,0,2]=4 68 B11R1.20 CC(=Cc1cnc(cn1)O)C AIFCHEM-6324170057 [0,2,0,0,0,0|0,0,2]=4 69 B11R1.22 C/C=C(\C)/c1cnc(cn1)O AIFCHEM-94584217910 [0,2,0,0,0,0|0,0,2]=4 70 B11R1.81 CCNc1ccc(nc1Br)Br AIFCHEM-94537421188 [0,2,0,0,0,0|2,0,0]=4 71 B11R1.81 CCNc1ccc(nc1Cl)Cl AIFCHEM-94537423690 [0,2,0,0,0,0|2,0,0]=4 72 B11R1.81 CCNc1ccc(nc1I)F AIFCHEM-94537415129 [0,2,0,0,0,0|2,0,0]=4 73 B11R1.81 CCNc1cnc(cc1Cl)Cl AIFCHEM-94537424899 [0,2,0,0,0,0|2,0,0]=4 74 B11R1.81 CCNc1ncc(cc1Cl)C AIFCHEM-94537420094 [0,2,0,0,0,0|2,0,0]=4 75 B11R1.81 CCNc1ncc(cc1Cl)Cl AIFCHEM-94537421505 [0,2,0,0,0,0|2,0,0]=4 76 B11R1.81 CCNc1ncc(cc1F)C AIFCHEM-94537413310 [0,2,0,0,0,0|2,0,0]=4 77 B11R1.81 CCNc1ncc(cc1F)I AIFCHEM-94537414476 [0,2,0,0,0,0|2,0,0]=4 78 B11R1.81 CCNc1ncc(cc1I)Br AIFCHEM-94537420984 [0,2,0,0,0,0|2,0,0]=4 79 B11R1.81 CCNc1ncc(cc1O)Br AIFCHEM-94537421209 [0,2,0,0,0,0|2,0,0]=4 80 B11R1.81 CCNc1ncc(cc1O)Cl AIFCHEM-94537421390 [0,2,0,0,0,0|2,0,0]=4 81 B11R1.81 CCNc1ncc(nc1Cl)C AIFCHEM-94537426672 [0,2,0,0,0,0|1,0,0]=3 82 B11R1.83 CCNc1ccc(cn1)CC AIFCHEM-94537417754 [0,2,0,0,0,0|2,0,0]=4 83 B11R1.192 CC=Cc1cnc(c(n1)C)C AIFCHEM-6449128773 [0,2,0,0,0,0|0,0,2]=4 84 B11R1.192 CCNc1cc(c(cn1)Br)C AIFCHEM-94537427720 [0,2,0,0,0,0|2,0,0]=4 85 B11R1.192 CCNc1cc(c(cn1)Br)F AIFCHEM-94537427433 [0,2,0,0,0,0|2,0,0]=4 86 B11R1.192 CCNc1cc(c(cn1)C)Br AIFCHEM-94537411613 [0,2,0,0,0,0|2,0,0]=4 87 B11R1.192 CCNc1cc(c(cn1)Cl)F AIFCHEM-94537415113 [0,2,0,0,0,0|2,0,0]=4 88 B11R1.192 CCNc1cc(c(cn1)F)I AIFCHEM-94537416491 [0,2,0,0,0,0|2,0,0]=4 89 B11R1.192 CCNc1ccc(c(n1)Br)Cl AIFCHEM-94537411248 [0,2,0,0,0,0|2,0,0]=4 90 B11R1.192 CCNc1ccc(c(n1)Br)I AIFCHEM-94537417113 [0,2,0,0,0,0|2,0,0]=4 91 B11R1.192 CCNc1ccc(c(n1)C)F AIFCHEM-94537412192 [0,2,0,0,0,0|2,0,0]=4 92 B11R1.192 CCNc1cnc(c(c1)Br)Br AIFCHEM-94537422504 [0,2,0,0,0,0|2,0,0]=4 93 B11R1.192 CCNc1cnc(c(c1)Br)Cl AIFCHEM-94537414309 [0,2,0,0,0,0|2,0,0]=4 94 B11R1.192 CCNc1cnc(c(c1)C)Br AIFCHEM-94537420993 [0,2,0,0,0,0|2,0,0]=4 95 B11R1.192 CCNc1cnc(c(c1)I)Cl AIFCHEM-94537421727 [0,2,0,0,0,0|2,0,0]=4 96 B11R1.192 CCNc1cnc(c(n1)Br)Br AIFCHEM-94537414728 [0,2,0,0,0,0|1,0,0]=3 97 B11R1.192 CCNc1cnc(c(n1)Br)C AIFCHEM-94537425009 [0,2,0,0,0,0|1,0,0]=3 98 B11R1.192 CCNc1cnc(c(n1)C)Br AIFCHEM-94537425010 [0,2,0,0,0,0|1,0,0]=3 99 B11R1.192 CCNc1cnc(c(n1)Cl)Cl AIFCHEM-94537423313 [0,2,0,0,0,0|1,0,0]=3 100 B11R1.192 CCNc1cnc(c(n1)Cl)I AIFCHEM-94537427166 [0,2,0,0,0,0|1,0,0]=3 101 B11R1.13 CCNc1nccc(c1C)F AIFCHEM-94537413577 [0,2,0,0,0,0|2,0,0]=4 102 B11R1.13 CCNc1nccc(c1Cl)Br AIFCHEM-94537426101 [0,2,0,0,0,0|2,0,0]=4 103 B11R1.13 CCNc1nccc(c1Cl)C AIFCHEM-94537422994 [0,2,0,0,0,0|2,0,0]=4 104 B11R1.13 CCNc1nccc(c1F)I AIFCHEM-94537414133 [0,2,0,0,0,0|2,0,0]=4 105 B11R1.17 CCCNc1ccccc1F AIFCHEM-94569019341 [0,2,0,0,0,0|2,0,0]=4 106 B11R1.17 CCCNc1cccnc1C AIFCHEM-94569017542 [0,2,0,0,0,0|1,0,0]=3 107 B11R1.17 CCCNc1cccnc1O AIFCHEM-94569017482 [0,2,0,0,0,0|1,0,0]=3 108 B11R1.17 CCCNc1cnccc1C AIFCHEM-94569017546 [0,2,0,0,0,0|1,0,0]=3 109 B11R1.17 CCCNc1cncnc1Br AIFCHEM-94569022995 [0,2,0,0,0,0|2,0,0]=4 110 B11R1.17 CCCNc1ncccc1C AIFCHEM-94569013329 [0,2,0,0,0,0|1,0,0]=3 111 B11R1.17 CCCNc1ncccc1O AIFCHEM-94569013697 [0,2,0,0,0,0|1,0,0]=3 112 B11R1.17 CCCNc1nccnc1Br AIFCHEM-94569015608 [0,2,0,0,0,0|0,0,0]=2 113 B11R1.17 CCNCc1ccccc1F AIFCHEM-94520796946 [0,2,0,0,0,0|2,0,0]=4 114 B11R1.17 CCNCc1ccccc1O AIFCHEM-94537427248 [0,2,0,0,0,0|2,0,0]=4 115 B11R1.17 CCNCc1cccnc1Br AIFCHEM-94537418026 [0,2,0,0,0,0|1,0,0]=3 116 B11R1.17 CCNCc1ncccc1F AIFCHEM-94537420062 [0,2,0,0,0,0|1,0,0]=3 117 B11R1.41 CCNc1cccnc1CO AIFCHEM-94537422403 [0,2,0,0,0,0|2,0,0]=4 118 B11R1.41 CCNc1ncccc1CO AIFCHEM-94537418922 [0,2,0,0,0,0|2,0,0]=4 119 B11R1.41 CCNc1nccnc1OC AIFCHEM-94537421957 [0,2,0,0,0,0|1,0,0]=3 120 B11R1.182 CC=Cc1nc(cnc1N)C AIFCHEM-6013327835 [0,2,0,0,0,0|0,0,2]=4 121 B11R1.182 CCNc1cc(cnc1C)C AIFCHEM-94537426771 [0,2,0,0,0,0|2,0,0]=4 122 B11R1.182 CCNc1cc(cnc1Cl)I AIFCHEM-94537421564 [0,2,0,0,0,0|2,0,0]=4 123 B11R1.182 CCNc1nc(ccc1C)Br AIFCHEM-94537426712 [0,2,0,0,0,0|2,0,0]=4 124 B11R1.182 CCNc1nc(ccc1F)C AIFCHEM-94537413289 [0,2,0,0,0,0|2,0,0]=4 125 B11R1.182 CCNc1nc(cnc1C)C AIFCHEM-94537414405 [0,2,0,0,0,0|1,0,0]=3 126 B11R1.182 CCNc1nc(cnc1Cl)Cl AIFCHEM-94537415505 [0,2,0,0,0,0|1,0,0]=3 127 B11R1.222 C/C=C(\C)/c1nccnc1C AIFCHEM-94584210842 [0,2,0,0,0,0|0,0,2]=4 128 B11R1.222 C/C=C(\C)/c1nccnc1N AIFCHEM-94584215829 [0,2,0,0,0,0|0,0,2]=4 129 B11R1.222 C/C=C(\C)/c1nccnc1O AIFCHEM-94584211749 [0,2,0,0,0,0|0,0,2]=4 130 B11R1.222 CCN(C)c1cnccc1C AIFCHEM-94537425388 [0,2,0,0,0,0|2,0,0]=4 131 B11R1.23 C/C=C(\C)/c1cncc(n1)C AIFCHEM-94584223656 [0,2,0,0,0,0|0,0,2]=4 132 B11R1.23 CCN(C)c1cncc(c1)C AIFCHEM-94537416284 [0,2,0,0,0,0|2,0,0]=4 133 B11R1.24 CCCNc1cc(ccn1)C AIFCHEM-94569021601 [0,2,0,0,0,0|1,0,0]=3 134 B11R1.24 CCCNc1cc(ccn1)Cl AIFCHEM-94569014823 [0,2,0,0,0,0|1,0,0]=3 135 B11R1.24 CCCNc1cc(ncn1)C AIFCHEM-94569017560 [0,2,0,0,0,0|2,0,0]=4 136 B11R1.24 CCCNc1cc(ncn1)F AIFCHEM-94569019375 [0,2,0,0,0,0|2,0,0]=4 137 B11R1.24 CCCNc1cccc(c1)Br AIFCHEM-94552679825 [0,2,0,0,0,0|2,0,0]=4 138 B11R1.24 CCCNc1cccc(c1)F AIFCHEM-94579349397 [0,2,0,0,0,0|2,0,0]=4 139 B11R1.24 CCCNc1ccnc(n1)C AIFCHEM-94566489138 [0,2,0,0,0,0|2,0,0]=4 140 B11R1.24 CCNCc1cccc(c1)C AIFCHEM-94537252418 [0,2,0,0,0,0|2,0,0]=4 141 B11R1.24 CCNCc1cccc(n1)C AIFCHEM-94537414853 [0,2,0,0,0,0|1,0,0]=3 142 B11R1.24 CCNCc1cncc(c1)Br AIFCHEM-94537411205 [0,2,0,0,0,0|1,0,0]=3 143 B11R1.24 CCNCc1cncc(c1)C AIFCHEM-94537415593 [0,2,0,0,0,0|1,0,0]=3 144 B11R1.34 CCNc1cc(cc(n1)Br)C AIFCHEM-94537424969 [0,2,0,0,0,0|2,0,0]=4 145 B11R1.157 CC(=O)Nc1cncc(n1)C AIFCHEM-5599952056 [0,2,0,0,0,0|1,0,1]=4 146 B11R1.189 CC=Cc1cncc(n1)CO AIFCHEM-6475784522 [0,2,0,0,0,0|0,0,2]=4 147 B11R1.16 CCNC(C)c1cccnc1 AIFCHEM-94537412581 [0,2,0,0,0,0|1,0,0]=3 148 B11R1.16 CCN[C@@H](C)c1cccnc1 AIFCHEM-94593286246 [0,2,0,0,0,0|1,0,0]=3 149 B11R1.16 CCN[C@H](C)c1cccnc1 AIFCHEM-94529449831 [0,2,0,0,0,0|1,0,0]=3 150 B11R1.28 CCCC=Cc1ncccn1 AIFCHEM-6312655367 [0,2,0,0,0,0|2,0,0]=4 151 B11R1.28 FCCNCc1ccccn1 AIFCHEM-5801248605 [0,2,0,0,0,0|1,0,0]=3 152 B11R1.28 FCCNCc1cccnn1 AIFCHEM-5801265591 [0,2,0,0,0,0|2,0,0]=4 153 B11R1.28 N#CCNCc1ccccn1 AIFCHEM-94558702348 [0,2,0,0,0,0|1,0,1]=4 154 B11R1.28 OCCNCc1ccncn1 AIFCHEM-6389148719 [0,2,0,0,0,0|2,0,0]=4 155 B11R1.28 OCCNCc1ncccn1 AIFCHEM-6481313728 [0,2,0,0,0,0|2,0,0]=4 156 B11R1.40 CCC(=O)Nc1ccccn1 AIFCHEM-94526506315 [0,2,0,0,0,0|1,0,1]=4 157 B11R1.40 CCN(C)Cc1ccccc1 AIFCHEM-94537411577 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.40 CCN(C)Cc1cccnc1 AIFCHEM-94537417880 [0,2,0,0,0,0|1,0,0]=3 159 B11R1.91 CC(=O)NCc1ccccn1 AIFCHEM-5686879180 [0,2,0,0,0,0|1,0,1]=4 160 B11R1.91 CC(=O)NCc1cnccn1 AIFCHEM-94535589218 [0,2,0,0,0,0|0,0,1]=3 161 B11R1.91 CC(C)CNc1ccccn1 AIFCHEM-94572981495 [0,2,0,0,0,0|1,0,0]=3 162 B11R1.91 CC(C)CNc1cccnc1 AIFCHEM-94572981207 [0,2,0,0,0,0|1,0,0]=3 163 B11R1.91 CC(C)NCc1cccnc1 AIFCHEM-94520540451 [0,2,0,0,0,0|1,0,0]=3 164 B11R1.91 CC(C)NCc1cncnc1 AIFCHEM-94520536301 [0,2,0,0,0,0|2,0,0]=4