0 B11R1.28 CCCC=Cc1ncccn1 AIFCHEM-6312655367 [0,0,0,0,0,0|1,0,2]=3 1 B11R1.28 CCCNCc1ccncc1 AIFCHEM-5790435281 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.28 FCCNCc1ccccn1 AIFCHEM-5801248605 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.28 FCCNCc1cccnn1 AIFCHEM-5801265591 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.28 N#CCNCc1ccccn1 AIFCHEM-94558702348 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.28 OCCNCc1ccncn1 AIFCHEM-6389148719 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.28 OCCNCc1ncccn1 AIFCHEM-6481313728 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.17 CCCNc1ncccn1 AIFCHEM-94569009150 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [1,0,0,0,0,0|1,0,0]=2 10 B10R1.17 CCNCc1cnccn1 AIFCHEM-94537417821 [1,0,0,0,0,0|2,0,0]=3 11 B12R1.1 CCCC=Cc1ncc(cn1)F AIFCHEM-6298695998 [0,1,0,0,0,0|1,0,2]=4 12 B12R1.1 CCCCNc1ccc(cc1)C AIFCHEM-94523028188 [0,1,0,0,0,0|2,0,0]=3 13 B12R1.1 CCCCNc1ccc(cc1)F AIFCHEM-94523042368 [0,1,0,0,0,0|2,0,0]=3 14 B12R1.1 CCCCNc1ccc(cn1)C AIFCHEM-94523032560 [0,1,0,0,0,0|1,0,0]=2 15 B12R1.1 CCCCNc1ccc(cn1)O AIFCHEM-94523039171 [0,1,0,0,0,0|1,0,0]=2 16 B12R1.1 CCCCNc1ccc(nc1)Br AIFCHEM-94523031044 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.1 CCCCNc1ccc(nc1)Cl AIFCHEM-94523038884 [0,1,0,0,0,0|3,0,0]=4 18 B12R1.1 CCCCNc1ccc(nc1)F AIFCHEM-94523033545 [0,1,0,0,0,0|3,0,0]=4 19 B12R1.1 CCCCNc1ccc(nc1)O AIFCHEM-94523029087 [0,1,0,0,0,0|3,0,0]=4 20 B12R1.1 CCCCNc1ncc(cn1)Br AIFCHEM-94523041677 [0,1,0,0,0,0|2,0,0]=3 21 B12R1.1 CCCCNc1ncc(cn1)C AIFCHEM-94523038531 [0,1,0,0,0,0|2,0,0]=3 22 B12R1.1 CCCNCc1ccc(cn1)C AIFCHEM-94569018920 [0,1,0,0,0,0|1,0,0]=2 23 B12R1.1 CCCNCc1ccc(nc1)C AIFCHEM-5814844407 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.1 CCCNCc1ccc(nc1)Cl AIFCHEM-94569024760 [0,1,0,0,0,0|3,0,0]=4 25 B12R1.1 CCCNCc1ccc(nc1)F AIFCHEM-5875471513 [0,1,0,0,0,0|3,0,0]=4 26 B12R1.1 CCCNCc1ccc(nn1)Cl AIFCHEM-94569023378 [0,1,0,0,0,0|2,0,0]=3 27 B12R1.1 CCCNCc1cnc(cn1)C AIFCHEM-94521369892 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.1 Cc1ccc(cc1)CNCCF AIFCHEM-5861558895 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.1 Cc1ccc(nc1)CNCC#N AIFCHEM-94558706074 [0,1,0,0,0,0|2,0,1]=4 30 B12R1.1 FCCNCc1ccc(cc1)Cl AIFCHEM-5800462737 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.1 FCCNCc1ccc(cc1)I AIFCHEM-5853759708 [0,1,0,0,0,0|3,0,0]=4 32 B12R1.1 FCCNCc1ccc(cn1)Br AIFCHEM-5853553610 [0,1,0,0,0,0|2,0,0]=3 33 B12R1.1 OCCNCc1ccc(cc1)O AIFCHEM-6411472161 [0,1,0,0,0,0|3,0,0]=4 34 B12R1.1 OCCNCc1ccc(cn1)Cl AIFCHEM-94577778244 [0,1,0,0,0,0|2,0,0]=3 35 B12R1.8 CCCCCNc1cnccn1 AIFCHEM-94551433700 [0,1,0,0,0,0|1,0,0]=2 36 B12R1.8 CCCCNCc1ccncn1 AIFCHEM-5725536655 [0,1,0,0,0,0|1,0,0]=2 37 B12R1.8 CCCCNCc1cnccn1 AIFCHEM-5751587140 [0,1,0,0,0,0|1,0,0]=2 38 B12R1.8 CCNCCCc1cccnc1 AIFCHEM-94537421400 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.8 CCNCCOc1cccnc1 AIFCHEM-94537420048 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.8 CSCCCNc1ccncc1 AIFCHEM-94546183382 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.8 CSCCCNc1ncncn1 AIFCHEM-94540362733 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.8 CSCCNCc1cccnc1 AIFCHEM-94598922606 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.8 CSCCNCc1cccnn1 AIFCHEM-94598923257 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.8 CSCCNCc1ccncn1 AIFCHEM-5882410553 [0,1,0,0,0,0|2,0,0]=3 45 B12R1.8 N#CCCNCc1ccncn1 AIFCHEM-5753481843 [0,1,0,0,0,0|2,0,1]=4 46 B12R1.8 OCCCNCc1cccnc1 AIFCHEM-94523164274 [0,1,0,0,0,0|3,0,0]=4 47 B12R1.8 OCCCNCc1ncccn1 AIFCHEM-94523163101 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.27 CC(CF)NCc1cnccn1 AIFCHEM-6128659395 [0,1,0,0,0,0|3,0,0]=4 49 B12R1.27 CC(CO)NCc1cccnn1 AIFCHEM-6411322817 [0,1,0,0,0,0|3,0,0]=4 50 B12R1.27 CCC(C)CNc1ccccn1 AIFCHEM-5933383275 [0,1,0,0,0,0|1,0,0]=2 51 B12R1.27 CCC(C)CNc1ccncn1 AIFCHEM-6250188545 [0,1,0,0,0,0|2,0,0]=3 52 B12R1.27 CCC(C)CNc1ncccn1 AIFCHEM-5877656562 [0,1,0,0,0,0|2,0,0]=3 53 B12R1.27 C[C@@H](CF)NCc1cnccn1 AIFCHEM-6011665275 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.27 C[C@@H](CO)NCc1cccnn1 AIFCHEM-6436821149 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.27 C[C@H](CF)NCc1cnccn1 AIFCHEM-6089310118 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.27 C[C@H](CO)NCc1cccnn1 AIFCHEM-6461011387 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.28 CCCC=Cc1cccc(c1)F AIFCHEM-6382549502 [0,1,0,0,0,0|1,0,2]=4 58 B12R1.28 CCCCNc1cccc(c1)Br AIFCHEM-94552679827 [0,1,0,0,0,0|2,0,0]=3 59 B12R1.28 CCCCNc1cccc(c1)I AIFCHEM-94523040021 [0,1,0,0,0,0|2,0,0]=3 60 B12R1.28 CCCCNc1ccnc(c1)Br AIFCHEM-94523041478 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.28 CCCCNc1ccnc(c1)F AIFCHEM-94523033648 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.28 CCCCNc1cncc(c1)I AIFCHEM-94523035566 [0,1,0,0,0,0|3,0,0]=4 63 B12R1.28 CCCNCc1cccc(c1)O AIFCHEM-94569022018 [0,1,0,0,0,0|2,0,0]=3 64 B12R1.28 CCCNCc1cccc(n1)Br AIFCHEM-5853283410 [0,1,0,0,0,0|1,0,0]=2 65 B12R1.28 CCCNCc1cccc(n1)Cl AIFCHEM-94569013145 [0,1,0,0,0,0|1,0,0]=2 66 B12R1.28 CCCNCc1cccc(n1)F AIFCHEM-94521368095 [0,1,0,0,0,0|1,0,0]=2 67 B12R1.28 CCCNCc1ccnc(c1)C AIFCHEM-5790952841 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.28 CCCNCc1ccnc(c1)O AIFCHEM-5853495193 [0,1,0,0,0,0|3,0,0]=4 69 B12R1.28 CCOC=Cc1cc(ccn1)C AIFCHEM-6256482326 [0,1,0,0,0,0|1,0,2]=4 70 B12R1.28 Cc1ccnc(c1)CNCC#N AIFCHEM-94558706307 [0,1,0,0,0,0|2,0,1]=4 71 B12R1.28 Cc1ccnc(c1)CNCCF AIFCHEM-5871099234 [0,1,0,0,0,0|2,0,0]=3 72 B12R1.28 OCCNCc1cc(ccn1)Br AIFCHEM-94577776143 [0,1,0,0,0,0|2,0,0]=3 73 B12R1.30 CCCCN(C)c1ccncc1 AIFCHEM-94523028571 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.30 CCCNC(=O)c1ccccc1 AIFCHEM-94565582226 [0,1,0,0,0,0|2,0,1]=4 75 B12R1.30 CCCNC(C)c1cnccn1 AIFCHEM-94569014093 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.32 CCCN(C)Cc1ccccn1 AIFCHEM-5860218756 [0,1,0,0,0,0|1,0,0]=2 77 B12R1.32 CN(CCO)Cc1cnccn1 AIFCHEM-94548506077 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.252 CC(C)CNCc1ccccn1 AIFCHEM-94572980232 [0,1,0,0,0,0|1,0,0]=2 79 B12R1.252 CC(C)CNCc1ccncn1 AIFCHEM-6162129461 [0,1,0,0,0,0|2,0,0]=3 80 B12R1.252 CC(O)CNCc1ccncc1 AIFCHEM-6416585554 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.252 C[C@@H](O)CNCc1ccncc1 AIFCHEM-6490834951 [0,1,0,0,0,0|3,0,0]=4 82 B12R1.252 C[C@H](O)CNCc1ccncc1 AIFCHEM-6495203428 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.267 CCCCNc1cccnc1Cl AIFCHEM-94523040091 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.267 CCCCNc1cnccc1O AIFCHEM-94523040136 [0,1,0,0,0,0|3,0,0]=4 85 B12R1.267 CCCCNc1ncccc1C AIFCHEM-94523032559 [0,1,0,0,0,0|1,0,0]=2 86 B12R1.267 CCCCNc1ncccc1F AIFCHEM-94523034766 [0,1,0,0,0,0|1,0,0]=2 87 B12R1.267 CCCCNc1ncccc1O AIFCHEM-94523032927 [0,1,0,0,0,0|1,0,0]=2 88 B12R1.267 CCCNCc1ccccc1Cl AIFCHEM-94555005997 [0,1,0,0,0,0|2,0,0]=3 89 B12R1.267 CCCNCc1ccccc1O AIFCHEM-94592060285 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.267 CCCNCc1cccnc1Br AIFCHEM-5792684305 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.267 CCCNCc1ccncc1Br AIFCHEM-94521371032 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.267 CCCNCc1ncccc1Br AIFCHEM-5875357386 [0,1,0,0,0,0|1,0,0]=2 93 B12R1.267 CCCNCc1ncccc1C AIFCHEM-5791070021 [0,1,0,0,0,0|1,0,0]=2 94 B12R1.267 CCCNCc1ncccc1Cl AIFCHEM-94521368071 [0,1,0,0,0,0|1,0,0]=2 95 B12R1.267 CCOC=Cc1ncccc1O AIFCHEM-94580723888 [0,1,0,0,0,0|1,0,2]=4 96 B12R1.267 Cc1cccnc1CNCCO AIFCHEM-6463388064 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.267 FCCNCc1ncccc1Br AIFCHEM-5861675649 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.267 FCCNCc1ncccc1F AIFCHEM-5853648356 [0,1,0,0,0,0|2,0,0]=3 99 B12R1.267 OCCNCc1ccccc1O AIFCHEM-94532459344 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.267 OCCNCc1ncccc1Br AIFCHEM-6481413800 [0,1,0,0,0,0|2,0,0]=3 101 B12R1.267 Oc1ccccc1CNCCF AIFCHEM-94532465977 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.2 C1=C(CCC1)c2ccccc2 AIFCHEM-94590916958 [0,0,0,1,0,0|1,0,2]=4 103 B12R2.2 C1=C(COC1)c2ccccn2 AIFCHEM-6314040887 [0,0,0,1,0,0|1,0,2]=4 104 B12R2.2057 C(=CC1CC1)c2ccncn2 AIFCHEM-6306609397 [0,0,0,1,0,0|1,0,2]=4 105 B12R2.2057 C(=CC1CC1)c2ncccn2 AIFCHEM-94569113453 [0,0,0,1,0,0|1,0,2]=4 106 B12R2.2057 c1cc(ccn1)CNC2CC2 AIFCHEM-6108865476 [0,0,0,1,0,0|3,0,0]=4 107 B12R2.2057 c1cc(ncn1)NCC2CC2 AIFCHEM-6223436739 [0,0,0,1,0,0|2,0,0]=3 108 B12R2.2057 c1cnc(nc1)CNC2CC2 AIFCHEM-94573315291 [0,0,0,1,0,0|2,0,0]=3 109 B12R2.2057 c1cncc(c1)CNC2CC2 AIFCHEM-94573316464 [0,0,0,1,0,0|3,0,0]=4 110 B12R2.2057 c1cnnc(c1)CNC2CC2 AIFCHEM-6109237002 [0,0,0,1,0,0|2,0,0]=3 111 B12R2.2058 C(=C1CCC1)c2ccccc2 AIFCHEM-6322825111 [0,0,0,1,0,0|1,0,2]=4 112 B12R2.2058 C(=C1CCC1)c2ccccn2 AIFCHEM-6358671053 [0,0,0,1,0,0|0,0,2]=3 113 B12R2.2058 c1cc(ccn1)CN2CCC2 AIFCHEM-94604924562 [0,0,0,1,0,0|3,0,0]=4 114 B12R2.2058 c1cncc(c1)NC2CCC2 AIFCHEM-94531001888 [0,0,0,1,0,0|3,0,0]=4 115 B10R1.21 CCCC=Cc1cccs1 AIFCHEM-94564040480 [0,0,0,0,1,0|1,0,2]=4 116 B10R1.21 CCCC=Cc1ncco1 AIFCHEM-6486072646 [0,0,0,0,1,0|1,0,2]=4 117 B10R1.21 CCCCNc1ccon1 AIFCHEM-94523033139 [0,0,0,0,1,0|2,0,0]=3 118 B10R1.21 CCCCNc1ccsc1 AIFCHEM-94523038276 [0,0,0,0,1,0|2,0,0]=3 119 B10R1.21 CCCCNc1ncco1 AIFCHEM-94523038147 [0,0,0,0,1,0|2,0,0]=3 120 B10R1.21 CCCCNc1nccs1 AIFCHEM-94524283831 [0,0,0,0,1,0|2,0,0]=3 121 B10R1.21 CCCNCc1ccno1 AIFCHEM-94569018772 [0,0,0,0,1,0|3,0,0]=4 122 B10R1.21 CCCNCc1cnco1 AIFCHEM-94521366295 [0,0,0,0,1,0|3,0,0]=4 123 B10R1.21 CCCNCc1cscn1 AIFCHEM-94569011863 [0,0,0,0,1,0|2,0,0]=3 124 B10R1.21 CCNCCc1cc[nH]n1 AIFCHEM-94537414967 [0,0,0,0,1,0|2,0,0]=3 125 B10R1.21 CCNCCc1nccs1 AIFCHEM-94537417287 [0,0,0,0,1,0|2,0,0]=3 126 B10R1.21 CCNCCn1cccc1 AIFCHEM-94537419871 [0,0,0,0,1,0|2,0,0]=3 127 B10R1.21 FCCNCc1cc[nH]n1 AIFCHEM-94524665033 [0,0,0,0,1,0|3,0,0]=4 128 B10R1.21 FCCNCc1cccs1 AIFCHEM-5853698665 [0,0,0,0,1,0|3,0,0]=4 129 B10R1.21 OCCNCc1cocn1 AIFCHEM-94577775647 [0,0,0,0,1,0|3,0,0]=4 130 B10R1.21 OCCNCc1ncc[nH]1 AIFCHEM-94577775061 [0,0,0,0,1,0|3,0,0]=4 131 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.8 CCNc1cnccn1 AIFCHEM-94537422176 [2,0,0,0,0,0|2,0,0]=4 133 B11R1.1 CCCNc1ccc(cc1)F AIFCHEM-94569015457 [1,1,0,0,0,0|2,0,0]=4 134 B11R1.1 CCCNc1ccc(cn1)I AIFCHEM-94569015081 [1,1,0,0,0,0|1,0,0]=3 135 B11R1.1 CCNCc1ccc(cc1)Cl AIFCHEM-94537411696 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.1 CCNCc1ccc(cc1)F AIFCHEM-94530368408 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.1 CCNCc1ccc(cn1)F AIFCHEM-94537422895 [1,1,0,0,0,0|1,0,0]=3 138 B11R1.1 CCNCc1cnc(cn1)C AIFCHEM-94537414501 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.1 CCNCc1ncc(cn1)Cl AIFCHEM-94537416276 [1,1,0,0,0,0|2,0,0]=4 140 B11R1.17 CCCNc1ccccc1F AIFCHEM-94569019341 [1,1,0,0,0,0|2,0,0]=4 141 B11R1.17 CCCNc1ncccc1C AIFCHEM-94569013329 [1,1,0,0,0,0|1,0,0]=3 142 B11R1.17 CCCNc1ncccc1O AIFCHEM-94569013697 [1,1,0,0,0,0|1,0,0]=3 143 B11R1.17 CCCNc1nccnc1Br AIFCHEM-94569015608 [1,1,0,0,0,0|2,0,0]=4 144 B11R1.17 CCNCc1ccccc1F AIFCHEM-94520796946 [1,1,0,0,0,0|2,0,0]=4 145 B11R1.17 CCNCc1ccccc1O AIFCHEM-94537427248 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.17 CCNCc1ncccc1F AIFCHEM-94537420062 [1,1,0,0,0,0|1,0,0]=3 147 B11R1.24 CCCNc1cc(ccn1)C AIFCHEM-94569021601 [1,1,0,0,0,0|1,0,0]=3 148 B11R1.24 CCCNc1cc(ccn1)Cl AIFCHEM-94569014823 [1,1,0,0,0,0|1,0,0]=3 149 B11R1.24 CCCNc1cc(ncn1)C AIFCHEM-94569017560 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.24 CCCNc1cc(ncn1)F AIFCHEM-94569019375 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.24 CCCNc1cccc(c1)Br AIFCHEM-94552679825 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.24 CCCNc1cccc(c1)F AIFCHEM-94579349397 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.24 CCCNc1ccnc(n1)C AIFCHEM-94566489138 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.24 CCNCc1cccc(c1)C AIFCHEM-94537252418 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.24 CCNCc1cccc(n1)C AIFCHEM-94537414853 [1,1,0,0,0,0|1,0,0]=3 156 B11R1.40 CCC(=O)Nc1ccccn1 AIFCHEM-94526506315 [1,1,0,0,0,0|1,0,1]=4 157 B11R1.40 CCN(C)Cc1ccccc1 AIFCHEM-94537411577 [1,1,0,0,0,0|2,0,0]=4 158 B11R1.91 CC(=O)NCc1ccccn1 AIFCHEM-5686879180 [1,1,0,0,0,0|1,0,1]=4 159 B11R1.91 CC(C)CNc1ccccn1 AIFCHEM-94572981495 [1,1,0,0,0,0|1,0,0]=3 160 B11R1.4 CCCCC=Cc1ccoc1 AIFCHEM-6202894001 [0,1,0,0,1,0|1,0,1]=4 161 B11R1.4 CCCCC=Cc1ccon1 AIFCHEM-6444523912 [0,1,0,0,1,0|1,0,1]=4 162 B11R1.4 CCCCCNc1ccon1 AIFCHEM-94551428350 [0,1,0,0,1,0|1,0,0]=3 163 B11R1.4 CCCCNCc1cccs1 AIFCHEM-94523039677 [0,1,0,0,1,0|1,0,0]=3 164 B11R1.4 CCCCNCc1ccoc1 AIFCHEM-5725341086 [0,1,0,0,1,0|1,0,0]=3 165 B11R1.4 CCCCNCc1ncco1 AIFCHEM-94523028020 [0,1,0,0,1,0|1,0,0]=3 166 B11R1.4 CCCCNCc1nccs1 AIFCHEM-94523038846 [0,1,0,0,1,0|1,0,0]=3 167 B11R1.4 CCCNCCc1cncs1 AIFCHEM-94569022413 [0,1,0,0,1,0|2,0,0]=4 168 B11R1.4 CCNCCCn1cccc1 AIFCHEM-94537423465 [0,1,0,0,1,0|1,0,0]=3 169 B11R1.4 CCNCCCn1ccnc1 AIFCHEM-94537422148 [0,1,0,0,1,0|2,0,0]=4 170 B11R1.4 CSCCNCc1cccs1 AIFCHEM-5830819053 [0,1,0,0,1,0|2,0,0]=4 171 B11R1.4 CSCCNCc1ncco1 AIFCHEM-94598923569 [0,1,0,0,1,0|2,0,0]=4 172 B11R1.4 OCCCNCc1cc[nH]n1 AIFCHEM-94523163818 [0,1,0,0,1,0|2,0,0]=4 173 B11R1.4 OCCCNCc1ncc[nH]1 AIFCHEM-94523160146 [0,1,0,0,1,0|2,0,0]=4 174 B11R1.4 OCCCNCc1ncco1 AIFCHEM-94523165237 [0,1,0,0,1,0|2,0,0]=4 175 B11R1.27 CCCCNc1ncc(s1)C AIFCHEM-94523041192 [0,1,0,0,1,0|2,0,0]=4 176 B11R1.27 CCCNCc1cc(cs1)Cl AIFCHEM-94521370322 [0,1,0,0,1,0|2,0,0]=4 177 B11R1.27 CCCNCc1cc(cs1)O AIFCHEM-94571799756 [0,1,0,0,1,0|2,0,0]=4 178 B11R1.27 CCCNCc1ccc(o1)I AIFCHEM-94521368629 [0,1,0,0,1,0|2,0,0]=4 179 B11R1.27 CCCNCc1ccc(s1)Br AIFCHEM-94569020601 [0,1,0,0,1,0|2,0,0]=4 180 B11R1.27 CCCNCc1ccc(s1)C AIFCHEM-5875387824 [0,1,0,0,1,0|2,0,0]=4 181 B11R1.27 CCCNCc1ccc(s1)Cl AIFCHEM-5853190788 [0,1,0,0,1,0|2,0,0]=4 182 B11R1.27 CCCNCc1csc(n1)C AIFCHEM-5790524244 [0,1,0,0,1,0|2,0,0]=4 183 B11R1.27 CCCNCc1ncc(s1)Br AIFCHEM-5792596326 [0,1,0,0,1,0|2,0,0]=4 184 B11R1.29 CCCNC(C)c1ncco1 AIFCHEM-94521371312 [0,1,0,0,1,0|2,0,0]=4 185 B11R1.30 CCCC(C)Nc1ccsc1 AIFCHEM-94572615130 [0,1,0,0,1,0|2,0,0]=4 186 B11R1.30 CCCN(C)Cc1ccsc1 AIFCHEM-5860062278 [0,1,0,0,1,0|2,0,0]=4 187 B11R1.30 CCCN(C)Cc1ncco1 AIFCHEM-5878772510 [0,1,0,0,1,0|2,0,0]=4 188 B11R1.172 CC(C)CNCc1cocn1 AIFCHEM-94572971302 [0,1,0,0,1,0|2,0,0]=4 189 B11R1.172 CC(C)CNCc1cscn1 AIFCHEM-94547319480 [0,1,0,0,1,0|2,0,0]=4 190 B11R1.172 CC(C)CNCc1nccs1 AIFCHEM-94572982190 [0,1,0,0,1,0|2,0,0]=4 191 B11R1.172 CC(O)CNCc1cc[nH]c1 AIFCHEM-94558285511 [0,1,0,0,1,0|2,0,0]=4 192 B11R1.172 CC(O)CNCc1cc[nH]n1 AIFCHEM-94524668580 [0,1,0,0,1,0|2,0,0]=4 193 B11R1.172 CC(O)CNCc1ccsc1 AIFCHEM-6466172880 [0,1,0,0,1,0|2,0,0]=4 194 B11R1.172 CC(O)CNCc1cscn1 AIFCHEM-6466243480 [0,1,0,0,1,0|2,0,0]=4 195 B11R1.172 C[C@@H](O)CNCc1cc[nH]n1 AIFCHEM-94524662824 [0,1,0,0,1,0|2,0,0]=4 196 B11R1.172 C[C@@H](O)CNCc1ccsc1 AIFCHEM-6492925846 [0,1,0,0,1,0|2,0,0]=4 197 B11R1.172 C[C@@H](O)CNCc1cscn1 AIFCHEM-6491221659 [0,1,0,0,1,0|2,0,0]=4 198 B11R1.172 C[C@H](O)CNCc1cc[nH]n1 AIFCHEM-94524662825 [0,1,0,0,1,0|2,0,0]=4 199 B11R1.172 C[C@H](O)CNCc1ccsc1 AIFCHEM-6492705573 [0,1,0,0,1,0|2,0,0]=4 200 B11R1.172 C[C@H](O)CNCc1cscn1 AIFCHEM-6500482011 [0,1,0,0,1,0|2,0,0]=4 201 B11R1.180 CCCNCc1nc[nH]c1C AIFCHEM-94521370942 [0,1,0,0,1,0|2,0,0]=4 202 B13R1.9 CCCCC=Cc1ccc(=O)[nH]n1 AIFCHEM-6432701273 [0,2,0,0,0,0|1,0,1]=4 203 B13R1.9 CCCCC=Cc1ccc(cc1)C AIFCHEM-94528941892 [0,2,0,0,0,0|1,0,1]=4 204 B13R1.9 CCCCC=Cc1ncc(cn1)F AIFCHEM-6376450090 [0,2,0,0,0,0|1,0,1]=4 205 B13R1.9 CCCCCNc1ccc(cc1)Cl AIFCHEM-94551429445 [0,2,0,0,0,0|1,0,0]=3 206 B13R1.9 CCCCCNc1ccc(cn1)Br AIFCHEM-94551423482 [0,2,0,0,0,0|0,0,0]=2 207 B13R1.9 CCCCCNc1ccc(nc1)C AIFCHEM-94551431984 [0,2,0,0,0,0|2,0,0]=4 208 B13R1.9 CCCCCNc1ccc(nc1)I AIFCHEM-94551431439 [0,2,0,0,0,0|2,0,0]=4 209 B13R1.9 CCCCCNc1ccc(nn1)C AIFCHEM-94551428846 [0,2,0,0,0,0|1,0,0]=3 210 B13R1.9 CCCCCNc1ccc(nn1)Cl AIFCHEM-94551434265 [0,2,0,0,0,0|1,0,0]=3 211 B13R1.9 CCCCCNc1cnc(cn1)Br AIFCHEM-94551434839 [0,2,0,0,0,0|1,0,0]=3 212 B13R1.9 CCCCCNc1cnc(cn1)Cl AIFCHEM-94551431869 [0,2,0,0,0,0|1,0,0]=3 213 B13R1.9 CCCCCNc1cnc(cn1)I AIFCHEM-94551438117 [0,2,0,0,0,0|1,0,0]=3 214 B13R1.9 CCCCNCc1ccc(cn1)Cl AIFCHEM-94593156396 [0,2,0,0,0,0|0,0,0]=2 215 B13R1.9 CCCCNCc1ccc(nc1)Br AIFCHEM-5751581878 [0,2,0,0,0,0|2,0,0]=4 216 B13R1.9 CCCCNCc1ccc(nc1)F AIFCHEM-5695336978 [0,2,0,0,0,0|2,0,0]=4 217 B13R1.9 CCCNCCc1ccc(cc1)C AIFCHEM-5792900870 [0,2,0,0,0,0|1,0,0]=3 218 B13R1.9 COCCNCc1ccc(cn1)Br AIFCHEM-5990087047 [0,2,0,0,0,0|1,0,0]=3 219 B13R1.9 COCCNCc1ccc(cn1)Cl AIFCHEM-6058070864 [0,2,0,0,0,0|1,0,0]=3 220 B13R1.9 COCCNCc1ccc(nn1)Cl AIFCHEM-6038685071 [0,2,0,0,0,0|2,0,0]=4 221 B13R1.9 CSCCCNc1ccc(cc1)Br AIFCHEM-94546173098 [0,2,0,0,0,0|2,0,0]=4 222 B13R1.9 CSCCCNc1ccc(cn1)Cl AIFCHEM-94546173184 [0,2,0,0,0,0|1,0,0]=3 223 B13R1.9 CSCCCNc1cnc(cn1)C AIFCHEM-94546184030 [0,2,0,0,0,0|2,0,0]=4 224 B13R1.9 CSCCNCc1ccc(=O)[nH]n1 AIFCHEM-94598924899 [0,2,0,0,0,0|2,0,0]=4 225 B13R1.9 CSCCNCc1ccc(cn1)F AIFCHEM-5865417597 [0,2,0,0,0,0|1,0,0]=3 226 B13R1.9 CSCCNCc1ccc(nn1)Cl AIFCHEM-94598921605 [0,2,0,0,0,0|2,0,0]=4 227 B13R1.9 CSCCNCc1cnc(cn1)C AIFCHEM-94598922662 [0,2,0,0,0,0|2,0,0]=4 228 B13R1.9 FCCNCCc1ccc(cc1)Br AIFCHEM-5871087556 [0,2,0,0,0,0|2,0,0]=4 229 B13R1.9 N#CCCNCc1ccc(cn1)F AIFCHEM-5717162930 [0,2,0,0,0,0|1,0,1]=4 230 B13R1.14 CC(CF)NCc1ccc(cn1)O AIFCHEM-6175984188 [0,2,0,0,0,0|2,0,0]=4 231 B13R1.14 CC(CO)NCc1ccc(cn1)Cl AIFCHEM-6058896123 [0,2,0,0,0,0|2,0,0]=4 232 B13R1.14 CC(CO)NCc1ccc(cn1)F AIFCHEM-6130029858 [0,2,0,0,0,0|2,0,0]=4 233 B13R1.14 CCC(=O)NCc1ccc(cn1)Br AIFCHEM-94526501149 [0,2,0,0,0,0|1,0,1]=4 234 B13R1.14 CCC(=O)NCc1ccc(cn1)F AIFCHEM-94526508447 [0,2,0,0,0,0|1,0,1]=4 235 B13R1.14 CCC(C)CNc1ccc(cn1)F AIFCHEM-5699445542 [0,2,0,0,0,0|1,0,0]=3 236 B13R1.14 CCC(C)CNc1ccc(nn1)Br AIFCHEM-5994178573 [0,2,0,0,0,0|2,0,0]=4 237 B13R1.14 CCC(C)CNc1ncc(cn1)C AIFCHEM-6010702588 [0,2,0,0,0,0|2,0,0]=4 238 B13R1.14 C[C@@H](CF)NCc1ccc(cn1)O AIFCHEM-6055038818 [0,2,0,0,0,0|2,0,0]=4 239 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)Cl AIFCHEM-6433316388 [0,2,0,0,0,0|2,0,0]=4 240 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)F AIFCHEM-6419388425 [0,2,0,0,0,0|2,0,0]=4 241 B13R1.14 C[C@H](CF)NCc1ccc(cn1)O AIFCHEM-6110067192 [0,2,0,0,0,0|2,0,0]=4 242 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Cl AIFCHEM-6395142683 [0,2,0,0,0,0|2,0,0]=4 243 B13R1.14 C[C@H](CO)NCc1ccc(cn1)F AIFCHEM-6461245930 [0,2,0,0,0,0|2,0,0]=4 244 B13R1.14 OCC(O)CNc1ccc(cn1)Br AIFCHEM-5695716039 [0,2,0,0,0,0|2,0,0]=4 245 B13R1.14 OCC(O)CNc1ccc(cn1)F AIFCHEM-5698887175 [0,2,0,0,0,0|2,0,0]=4 246 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)Br AIFCHEM-94590554890 [0,2,0,0,0,0|2,0,0]=4 247 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)F AIFCHEM-94590561386 [0,2,0,0,0,0|2,0,0]=4 248 B13R1.17 CCCCN(C)c1ccc(cc1)C AIFCHEM-94523039972 [0,2,0,0,0,0|2,0,0]=4 249 B13R1.17 CCCNC(=O)c1ccc(cn1)Br AIFCHEM-94521377355 [0,2,0,0,0,0|1,0,1]=4 250 B13R1.17 CCCNC(C)c1ccc(cn1)Br AIFCHEM-5814810328 [0,2,0,0,0,0|1,0,0]=3 251 B13R1.17 CCCNC(C)c1ccc(cn1)C AIFCHEM-94521370023 [0,2,0,0,0,0|1,0,0]=3 252 B13R1.17 CCCNC(C)c1ccc(cn1)Cl AIFCHEM-94543395234 [0,2,0,0,0,0|1,0,0]=3 253 B13R1.17 CCCN[C@@H](C)c1ccc(cn1)Br AIFCHEM-94537375553 [0,2,0,0,0,0|1,0,0]=3 254 B13R1.17 CCCN[C@H](C)c1ccc(cn1)Br AIFCHEM-94569024646 [0,2,0,0,0,0|1,0,0]=3 255 B13R1.19 CCCC(C)Nc1ccc(cc1)F AIFCHEM-94606122787 [0,2,0,0,0,0|2,0,0]=4 256 B13R1.19 CCCN(C)Cc1ccc(cc1)Br AIFCHEM-94538720467 [0,2,0,0,0,0|2,0,0]=4 257 B13R1.19 CCCN(C)Cc1ccc(cc1)C AIFCHEM-94569021655 [0,2,0,0,0,0|2,0,0]=4 258 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl AIFCHEM-5860345714 [0,2,0,0,0,0|2,0,0]=4 259 B13R1.369 CCCC=Cc1ncc(cc1F)N AIFCHEM-6423107770 [0,2,0,0,0,0|0,0,2]=4 260 B13R1.369 CCCC=Cc1ncc(cc1N)F AIFCHEM-6307014088 [0,2,0,0,0,0|0,0,2]=4 261 B13R1.369 CCCCNc1ccc(cc1Cl)Br AIFCHEM-94523037360 [0,2,0,0,0,0|2,0,0]=4 262 B13R1.369 CCCCNc1ccc(cc1F)Br AIFCHEM-94523037122 [0,2,0,0,0,0|2,0,0]=4 263 B13R1.369 CCCCNc1ccc(cc1I)Cl AIFCHEM-94523040107 [0,2,0,0,0,0|2,0,0]=4 264 B13R1.369 CCCCNc1ncc(cc1Cl)Cl AIFCHEM-94523037818 [0,2,0,0,0,0|1,0,0]=3 265 B13R1.369 CCCNCc1ccc(cc1Br)C AIFCHEM-5790875184 [0,2,0,0,0,0|2,0,0]=4 266 B13R1.369 CCCNCc1ccc(cc1Br)I AIFCHEM-94521368590 [0,2,0,0,0,0|2,0,0]=4 267 B13R1.369 CCCNCc1ccc(cc1Br)O AIFCHEM-5853448393 [0,2,0,0,0,0|2,0,0]=4 268 B13R1.369 CCCNCc1ccc(cc1Cl)F AIFCHEM-94521371518 [0,2,0,0,0,0|2,0,0]=4 269 B13R1.369 CCCNCc1ccc(cc1Cl)O AIFCHEM-5793006481 [0,2,0,0,0,0|2,0,0]=4 270 B13R1.369 CCCNCc1ccc(cc1F)I AIFCHEM-94521371017 [0,2,0,0,0,0|2,0,0]=4 271 B13R1.369 CCCNCc1ccc(cc1O)Br AIFCHEM-5790377249 [0,2,0,0,0,0|2,0,0]=4 272 B13R1.369 CCCNCc1ccc(cc1O)C AIFCHEM-5792548564 [0,2,0,0,0,0|2,0,0]=4 273 B13R1.369 CCCNCc1ccc(cc1O)Cl AIFCHEM-5814653685 [0,2,0,0,0,0|2,0,0]=4 274 B13R1.369 CCCNCc1ccc(cc1O)F AIFCHEM-94569023338 [0,2,0,0,0,0|2,0,0]=4 275 B13R1.369 CCCNCc1ccc(cc1O)I AIFCHEM-5853380062 [0,2,0,0,0,0|2,0,0]=4 276 B13R1.369 CCCNCc1ccc(cc1O)O AIFCHEM-5853246370 [0,2,0,0,0,0|2,0,0]=4 277 B13R1.369 CCCNCc1ncc(cc1C)Br AIFCHEM-94521369292 [0,2,0,0,0,0|1,0,0]=3 278 B13R1.369 CCCNCc1ncc(cc1F)C AIFCHEM-5790765523 [0,2,0,0,0,0|1,0,0]=3 279 B13R1.369 Cc1cc(cnc1CNCCO)Br AIFCHEM-6389309588 [0,2,0,0,0,0|2,0,0]=4 280 B13R1.369 FCCNCc1ncc(cc1Cl)Br AIFCHEM-5871040645 [0,2,0,0,0,0|2,0,0]=4 281 B13R1.369 FCCNCc1ncc(cc1F)Br AIFCHEM-5801297060 [0,2,0,0,0,0|2,0,0]=4 282 B13R1.369 OCCNCc1ncc(cc1Cl)Cl AIFCHEM-6481465688 [0,2,0,0,0,0|2,0,0]=4 283 B13R1.369 OCCNCc1ncc(cc1F)Br AIFCHEM-94577780230 [0,2,0,0,0,0|2,0,0]=4 284 B13R1.371 CCCCNc1ccc(cc1)OC AIFCHEM-94523034235 [0,2,0,0,0,0|2,0,0]=4 285 B13R1.371 CCCCNc1ccc(cc1)SC AIFCHEM-94523028011 [0,2,0,0,0,0|2,0,0]=4 286 B13R1.371 CCCCNc1ccc(cn1)SC AIFCHEM-94523041686 [0,2,0,0,0,0|1,0,0]=3 287 B13R1.371 CCCCNc1ncc(cn1)CC AIFCHEM-94523037426 [0,2,0,0,0,0|2,0,0]=4 288 B13R1.371 CCCCNc1ncc(cn1)CO AIFCHEM-94523029534 [0,2,0,0,0,0|2,0,0]=4 289 B13R1.371 CCCCNc1ncc(cn1)OC AIFCHEM-94523030936 [0,2,0,0,0,0|2,0,0]=4 290 B13R1.513 CC(C)CNCc1ccc(=O)[nH]n1 AIFCHEM-94563725121 [0,2,0,0,0,0|2,0,0]=4 291 B13R1.513 CC(C)CNCc1ccc(cc1)I AIFCHEM-94572980563 [0,2,0,0,0,0|2,0,0]=4 292 B13R1.513 CC(O)CNCc1ccc(cn1)Br AIFCHEM-6466172883 [0,2,0,0,0,0|1,0,0]=3 293 B13R1.513 CC(O)CNCc1ccc(cn1)Cl AIFCHEM-6472695990 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.513 CC(O)CNCc1ccc(cn1)F AIFCHEM-94558283307 [0,2,0,0,0,0|1,0,0]=3 295 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Br AIFCHEM-6509413064 [0,2,0,0,0,0|1,0,0]=3 296 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Cl AIFCHEM-6491362118 [0,2,0,0,0,0|1,0,0]=3 297 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)F AIFCHEM-6491840637 [0,2,0,0,0,0|1,0,0]=3 298 B13R1.513 C[C@H](O)CNCc1ccc(cn1)Br AIFCHEM-6509815196 [0,2,0,0,0,0|1,0,0]=3 299 B13R1.513 C[C@H](O)CNCc1ccc(cn1)Cl AIFCHEM-6493645360 [0,2,0,0,0,0|1,0,0]=3 300 B13R1.513 C[C@H](O)CNCc1ccc(cn1)F AIFCHEM-6500636166 [0,2,0,0,0,0|1,0,0]=3 301 B13R1.513 Cc1ccc(cc1)CCNC(C)C AIFCHEM-94520536451 [0,2,0,0,0,0|2,0,0]=4 302 B13R1.513 Cc1ccc(cc1)CNCC(C)C AIFCHEM-6162336895 [0,2,0,0,0,0|2,0,0]=4 303 B13R1.669 CCCC=Cc1cc(c(cn1)F)N AIFCHEM-6306606501 [0,2,0,0,0,0|0,0,2]=4 304 B13R1.669 CCCC=Cc1cc(c(cn1)N)C AIFCHEM-6354334679 [0,2,0,0,0,0|0,0,2]=4 305 B13R1.669 CCCC=Cc1ccc(c(n1)N)O AIFCHEM-6351725638 [0,2,0,0,0,0|0,0,2]=4 306 B13R1.669 CCCCNc1cc(c(cn1)Br)C AIFCHEM-94523044033 [0,2,0,0,0,0|1,0,0]=3 307 B13R1.669 CCCCNc1cc(c(cn1)F)F AIFCHEM-94523029610 [0,2,0,0,0,0|1,0,0]=3 308 B13R1.669 CCCCNc1cc(c(cn1)I)C AIFCHEM-94523036994 [0,2,0,0,0,0|1,0,0]=3 309 B13R1.669 CCCCNc1cc(c(cn1)I)Cl AIFCHEM-94523040569 [0,2,0,0,0,0|1,0,0]=3 310 B13R1.669 CCCCNc1cc(c(nn1)Cl)C AIFCHEM-94523040501 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.669 CCCCNc1ccc(c(c1)Br)C AIFCHEM-94523041664 [0,2,0,0,0,0|2,0,0]=4 312 B13R1.669 CCCCNc1ccc(c(c1)C)Cl AIFCHEM-94583424537 [0,2,0,0,0,0|2,0,0]=4 313 B13R1.669 CCCCNc1ccc(c(c1)Cl)Br AIFCHEM-94523034671 [0,2,0,0,0,0|2,0,0]=4 314 B13R1.669 CCCCNc1ccc(c(c1)Cl)F AIFCHEM-94523037120 [0,2,0,0,0,0|2,0,0]=4 315 B13R1.669 CCCCNc1ccc(c(c1)Cl)O AIFCHEM-94523037464 [0,2,0,0,0,0|2,0,0]=4 316 B13R1.669 CCCCNc1ccc(c(c1)F)O AIFCHEM-94559733224 [0,2,0,0,0,0|2,0,0]=4 317 B13R1.669 CCCCNc1ccc(c(c1)I)Cl AIFCHEM-94523039375 [0,2,0,0,0,0|2,0,0]=4 318 B13R1.669 CCCCNc1ccc(c(c1)O)F AIFCHEM-94523027552 [0,2,0,0,0,0|2,0,0]=4 319 B13R1.669 CCCCNc1cnc(c(n1)Br)Cl AIFCHEM-94523031012 [0,2,0,0,0,0|2,0,0]=4 320 B13R1.669 CCCNCc1ccc(c(c1)C)F AIFCHEM-94569016459 [0,2,0,0,0,0|2,0,0]=4 321 B13R1.669 CCCNCc1ccc(c(c1)F)F AIFCHEM-5790616451 [0,2,0,0,0,0|2,0,0]=4 322 B13R1.669 CCCNCc1ccc(c(c1)F)I AIFCHEM-94521365669 [0,2,0,0,0,0|2,0,0]=4 323 B13R1.669 CCCNCc1ccc(c(c1)O)Br AIFCHEM-5792696110 [0,2,0,0,0,0|2,0,0]=4 324 B13R1.669 CCCNCc1ccc(c(c1)O)O AIFCHEM-94569013456 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.669 Cc1cc(ncc1Br)CNCCF AIFCHEM-5861625283 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.6 CCCCC=Cc1cc(ncn1)N AIFCHEM-6074191118 [0,2,0,0,0,0|1,0,1]=4 327 B13R1.6 CCCCC=Cc1cccc(n1)C AIFCHEM-6345736913 [0,2,0,0,0,0|0,0,1]=3 328 B13R1.6 CCCCC=Cc1cncc(n1)N AIFCHEM-5983299426 [0,2,0,0,0,0|1,0,1]=4 329 B13R1.6 CCCCCNc1cccc(c1)Cl AIFCHEM-94523487542 [0,2,0,0,0,0|1,0,0]=3 330 B13R1.6 CCCCCNc1cccc(c1)F AIFCHEM-94551429309 [0,2,0,0,0,0|1,0,0]=3 331 B13R1.6 CCCCCNc1cccc(c1)I AIFCHEM-94551435232 [0,2,0,0,0,0|1,0,0]=3 332 B13R1.6 CCCCCNc1ccnc(c1)C AIFCHEM-94551428805 [0,2,0,0,0,0|2,0,0]=4 333 B13R1.6 CCCCNCc1cc(ccn1)C AIFCHEM-5745183470 [0,2,0,0,0,0|0,0,0]=2 334 B13R1.6 CCCCNCc1cccc(c1)F AIFCHEM-5694770333 [0,2,0,0,0,0|1,0,0]=3 335 B13R1.6 CCCCNCc1cccc(n1)Br AIFCHEM-5725825403 [0,2,0,0,0,0|0,0,0]=2 336 B13R1.6 CCCCNCc1cccc(n1)C AIFCHEM-5736454136 [0,2,0,0,0,0|0,0,0]=2 337 B13R1.6 CCCCNCc1cccc(n1)Cl AIFCHEM-94523033726 [0,2,0,0,0,0|0,0,0]=2 338 B13R1.6 CCCCNCc1ccnc(c1)F AIFCHEM-5725532561 [0,2,0,0,0,0|2,0,0]=4 339 B13R1.6 CCCCNCc1ccnc(n1)C AIFCHEM-94570969368 [0,2,0,0,0,0|1,0,0]=3 340 B13R1.6 CCNCCCc1cccc(c1)Cl AIFCHEM-94537417360 [0,2,0,0,0,0|1,0,0]=3 341 B13R1.6 CCNCCOc1cccc(c1)Cl AIFCHEM-94537424039 [0,2,0,0,0,0|2,0,0]=4 342 B13R1.6 COCCNCc1cccc(c1)I AIFCHEM-6058009349 [0,2,0,0,0,0|2,0,0]=4 343 B13R1.6 COCCNCc1cccc(c1)O AIFCHEM-6048027115 [0,2,0,0,0,0|2,0,0]=4 344 B13R1.6 COCCNCc1cccc(n1)Cl AIFCHEM-6038714550 [0,2,0,0,0,0|1,0,0]=3 345 B13R1.6 CSCCCNc1cc(ccn1)C AIFCHEM-94546185743 [0,2,0,0,0,0|1,0,0]=3 346 B13R1.6 CSCCCNc1cc(ccn1)Cl AIFCHEM-94546178965 [0,2,0,0,0,0|1,0,0]=3 347 B13R1.6 CSCCCNc1cc(ccn1)I AIFCHEM-94546184032 [0,2,0,0,0,0|1,0,0]=3 348 B13R1.6 CSCCCNc1cc(ncn1)Br AIFCHEM-94546173800 [0,2,0,0,0,0|2,0,0]=4 349 B13R1.6 CSCCCNc1cccc(c1)Br AIFCHEM-94552684912 [0,2,0,0,0,0|2,0,0]=4 350 B13R1.6 CSCCCNc1cccc(c1)O AIFCHEM-94552449503 [0,2,0,0,0,0|2,0,0]=4 351 B13R1.6 CSCCCNc1cccc(n1)C AIFCHEM-94546178444 [0,2,0,0,0,0|1,0,0]=3 352 B13R1.6 CSCCCNc1ccnc(n1)Br AIFCHEM-94546173840 [0,2,0,0,0,0|2,0,0]=4 353 B13R1.6 CSCCCNc1nccc(n1)C AIFCHEM-94546173238 [0,2,0,0,0,0|2,0,0]=4 354 B13R1.6 CSCCNCc1cc(ccn1)Cl AIFCHEM-94598923445 [0,2,0,0,0,0|1,0,0]=3 355 B13R1.6 CSCCNCc1cccc(c1)F AIFCHEM-94598922458 [0,2,0,0,0,0|2,0,0]=4 356 B13R1.6 CSCCNCc1cccc(c1)O AIFCHEM-5848592153 [0,2,0,0,0,0|2,0,0]=4 357 B13R1.6 CSCCNCc1ccnc(n1)C AIFCHEM-94598918443 [0,2,0,0,0,0|2,0,0]=4 358 B13R1.6 Cc1cccc(c1)CCNCCO AIFCHEM-94590809668 [0,2,0,0,0,0|2,0,0]=4 359 B13R1.6 Cc1cccc(n1)CNCCC#N AIFCHEM-5717340685 [0,2,0,0,0,0|1,0,1]=4 360 B13R1.6 N#CCCNCc1cc(ccn1)Cl AIFCHEM-5717100485 [0,2,0,0,0,0|1,0,1]=4 361 B13R1.6 N#CCCNCc1cccc(n1)Cl AIFCHEM-5693975521 [0,2,0,0,0,0|1,0,1]=4 362 B13R1.6 N#CCCNCc1cccc(n1)F AIFCHEM-5720077620 [0,2,0,0,0,0|1,0,1]=4 363 B13R1.6 OCCCNCc1cccc(n1)Br AIFCHEM-94523163510 [0,2,0,0,0,0|1,0,0]=3 364 B13R1.24 CCCCCN(C)c1ccccc1 AIFCHEM-94551422681 [0,2,0,0,0,0|1,0,0]=3 365 B13R1.24 CCCCNC(C)c1ccncc1 AIFCHEM-94523033099 [0,2,0,0,0,0|2,0,0]=4 366 B13R1.24 CCCCNC(C)c1ncccn1 AIFCHEM-94570973748 [0,2,0,0,0,0|1,0,0]=3 367 B13R1.24 CCCCN[C@@H](C)c1ccncc1 AIFCHEM-94523035942 [0,2,0,0,0,0|2,0,0]=4 368 B13R1.24 CCCCN[C@H](C)c1ccncc1 AIFCHEM-94523027663 [0,2,0,0,0,0|2,0,0]=4 369 B13R1.24 CCNCCC(O)c1ccccc1 AIFCHEM-94537422180 [0,2,0,0,0,0|1,0,0]=3 370 B13R1.24 COCCNC(=O)c1ccccn1 AIFCHEM-94578913846 [0,2,0,0,0,0|1,0,1]=4 371 B13R1.28 CCCCCC=Cc1ccncn1 AIFCHEM-6306678936 [0,2,0,0,0,0|1,0,0]=3 372 B13R1.28 CCCCCNCc1ccccn1 AIFCHEM-94552817785 [0,2,0,0,0,0|0,0,0]=2 373 B13R1.28 CCCNCCCc1ccccc1 AIFCHEM-5790560469 [0,2,0,0,0,0|1,0,0]=3 374 B13R1.28 CCCNCCOc1ccccn1 AIFCHEM-94569016929 [0,2,0,0,0,0|0,0,0]=2 375 B13R1.28 CCNCCCCc1ccccc1 AIFCHEM-94537420007 [0,2,0,0,0,0|1,0,0]=3 376 B13R1.28 CCOCCNCc1cccnc1 AIFCHEM-94548606577 [0,2,0,0,0,0|2,0,0]=4 377 B13R1.28 CCOCCNCc1ccncc1 AIFCHEM-94548608443 [0,2,0,0,0,0|2,0,0]=4 378 B13R1.28 COCCCNCc1cccnn1 AIFCHEM-5624702599 [0,2,0,0,0,0|1,0,0]=3 379 B13R1.28 COCCCNCc1ccncc1 AIFCHEM-5644055785 [0,2,0,0,0,0|2,0,0]=4 380 B13R1.28 CSCCCNCc1ccccn1 AIFCHEM-94529050792 [0,2,0,0,0,0|0,0,0]=2 381 B13R1.28 N#CCNCCCc1ccccc1 AIFCHEM-94558702083 [0,2,0,0,0,0|1,0,1]=4 382 B13R1.28 OCCCCCNc1ccncc1 AIFCHEM-94533892282 [0,2,0,0,0,0|2,0,0]=4 383 B13R1.28 OCCCCNCc1cccnn1 AIFCHEM-6505393936 [0,2,0,0,0,0|1,0,0]=3 384 B13R1.28 OCCCCNCc1cnccn1 AIFCHEM-6502345192 [0,2,0,0,0,0|1,0,0]=3 385 B13R1.42 CC(CCO)NCc1ccccc1 AIFCHEM-94539149454 [0,2,0,0,0,0|2,0,0]=4 386 B13R1.42 CCCC(C)NCc1cccnc1 AIFCHEM-94606117628 [0,2,0,0,0,0|2,0,0]=4 387 B13R1.42 CCC[C@@H](C)NCc1cccnc1 AIFCHEM-6010943982 [0,2,0,0,0,0|2,0,0]=4 388 B13R1.42 CCC[C@H](C)NCc1cccnc1 AIFCHEM-5628664617 [0,2,0,0,0,0|2,0,0]=4 389 B13R1.42 COCC(C)NCc1ccccc1 AIFCHEM-5867416017 [0,2,0,0,0,0|2,0,0]=4 390 B13R1.42 CSCC(=O)NCc1ccccn1 AIFCHEM-5770002698 [0,2,0,0,0,0|1,0,1]=4 391 B13R1.42 C[C@@H](CC#N)NCc1ccccn1 AIFCHEM-6025974082 [0,2,0,0,0,0|1,0,1]=4 392 B13R1.42 C[C@H](CC#N)NCc1ccccn1 AIFCHEM-6207900325 [0,2,0,0,0,0|1,0,1]=4 393 B13R1.44 CCCCC(=O)Nc1ccccn1 AIFCHEM-94586363259 [0,2,0,0,0,0|0,0,1]=3 394 B13R1.44 CCCCC(=O)Nc1ccncn1 AIFCHEM-94534109393 [0,2,0,0,0,0|1,0,1]=4 395 B13R1.44 CCCCN(C)Cc1ccccc1 AIFCHEM-94536079434 [0,2,0,0,0,0|1,0,0]=3 396 B13R1.44 CCCNC(=O)Cc1ncccn1 AIFCHEM-94521379928 [0,2,0,0,0,0|1,0,1]=4 397 B13R1.44 CN(CCCO)Cc1cccnn1 AIFCHEM-6400627019 [0,2,0,0,0,0|2,0,0]=4 398 B13R1.44 CN(CCCO)Cc1ccncn1 AIFCHEM-6419266154 [0,2,0,0,0,0|2,0,0]=4 399 B13R1.44 CSCCN(C)Cc1ccncn1 AIFCHEM-94607181049 [0,2,0,0,0,0|2,0,0]=4 400 B13R1.337 CC(C)NCCCc1ccccc1 AIFCHEM-94520536453 [0,2,0,0,0,0|1,0,0]=3 401 B13R1.337 CN(C)CCNCc1ccccn1 AIFCHEM-5745745517 [0,2,0,0,0,0|1,0,0]=3 402 B13R1.337 CN(C)CCNCc1ccncn1 AIFCHEM-94598725707 [0,2,0,0,0,0|2,0,0]=4 403 B13R1.337 CN(C)CCNCc1cnccn1 AIFCHEM-5915076036 [0,2,0,0,0,0|2,0,0]=4 404 B13R1.337 CN(C)CCNCc1ncccn1 AIFCHEM-94601435671 [0,2,0,0,0,0|2,0,0]=4 405 B13R1.555 CCCCC=Cc1ccccc1N AIFCHEM-5636935011 [0,2,0,0,0,0|1,0,1]=4 406 B13R1.555 CCCCC=Cc1ncccc1O AIFCHEM-6216979320 [0,2,0,0,0,0|0,0,1]=3 407 B13R1.555 CCCCC=Cc1nccnc1C AIFCHEM-6330498270 [0,2,0,0,0,0|1,0,1]=4 408 B13R1.555 CCCCC=Cc1nccnc1N AIFCHEM-6082399169 [0,2,0,0,0,0|1,0,1]=4 409 B13R1.555 CCCCCNc1cccnc1I AIFCHEM-94551429695 [0,2,0,0,0,0|2,0,0]=4 410 B13R1.555 CCCCCNc1cnccc1C AIFCHEM-94551431987 [0,2,0,0,0,0|2,0,0]=4 411 B13R1.555 CCCCNCc1ccccc1I AIFCHEM-94570972288 [0,2,0,0,0,0|1,0,0]=3 412 B13R1.555 CCCCNCc1ccccc1O AIFCHEM-94532456194 [0,2,0,0,0,0|1,0,0]=3 413 B13R1.555 CCCCNCc1cccnc1Cl AIFCHEM-5695417963 [0,2,0,0,0,0|2,0,0]=4 414 B13R1.555 CCCCNCc1ccncc1C AIFCHEM-5736633399 [0,2,0,0,0,0|2,0,0]=4 415 B13R1.555 CCCCNCc1ccncc1O AIFCHEM-94570971490 [0,2,0,0,0,0|2,0,0]=4 416 B13R1.555 CCCCNCc1cnccc1O AIFCHEM-94570975591 [0,2,0,0,0,0|2,0,0]=4 417 B13R1.555 CCCCNCc1ncccc1Cl AIFCHEM-94523038407 [0,2,0,0,0,0|0,0,0]=2 418 B13R1.555 CCNCCOc1ccccc1Br AIFCHEM-94537419451 [0,2,0,0,0,0|2,0,0]=4 419 B13R1.555 CCNCCOc1ccccc1Cl AIFCHEM-94537419417 [0,2,0,0,0,0|2,0,0]=4 420 B13R1.555 COCCNCc1ccccc1O AIFCHEM-94532456196 [0,2,0,0,0,0|2,0,0]=4 421 B13R1.555 COCCNCc1ncccc1Br AIFCHEM-6047934329 [0,2,0,0,0,0|1,0,0]=3 422 B13R1.555 COCCNCc1ncccc1C AIFCHEM-6016221731 [0,2,0,0,0,0|1,0,0]=3 423 B13R1.555 CSCCCNc1ccccc1Cl AIFCHEM-94546063257 [0,2,0,0,0,0|2,0,0]=4 424 B13R1.555 CSCCCNc1ccccc1I AIFCHEM-94546184786 [0,2,0,0,0,0|2,0,0]=4 425 B13R1.555 CSCCCNc1nccnc1Br AIFCHEM-94546179750 [0,2,0,0,0,0|2,0,0]=4 426 B13R1.555 CSCCCNc1nccnc1C AIFCHEM-94546178977 [0,2,0,0,0,0|2,0,0]=4 427 B13R1.555 CSCCCNc1ncncc1C AIFCHEM-94546179932 [0,2,0,0,0,0|2,0,0]=4 428 B13R1.555 CSCCNCc1ccccc1O AIFCHEM-94532468643 [0,2,0,0,0,0|2,0,0]=4 429 B13R1.555 CSCCNCc1ncccc1F AIFCHEM-94598921664 [0,2,0,0,0,0|1,0,0]=3 430 B13R1.555 CSCCNCc1ncccc1O AIFCHEM-94598920566 [0,2,0,0,0,0|1,0,0]=3 431 B13R1.555 OCCCNCc1ccccc1O AIFCHEM-94532459561 [0,2,0,0,0,0|2,0,0]=4 432 B13R1.555 OCCNCCc1ccccc1Cl AIFCHEM-6432143602 [0,2,0,0,0,0|2,0,0]=4 433 B13R1.718 CC(CO)CNCc1ncccn1 AIFCHEM-94540293239 [0,2,0,0,0,0|2,0,0]=4 434 B13R1.718 CCC(C)CNCc1ccncn1 AIFCHEM-94534472416 [0,2,0,0,0,0|1,0,0]=3 435 B13R1.718 CCC(F)CNCc1ccccn1 AIFCHEM-5870041407 [0,2,0,0,0,0|0,0,0]=2 436 B13R1.718 CCC(F)CNCc1ccncn1 AIFCHEM-5800878555 [0,2,0,0,0,0|1,0,0]=3 437 B13R1.718 CCC(F)CNCc1ncccn1 AIFCHEM-5859155734 [0,2,0,0,0,0|1,0,0]=3 438 B13R1.718 CCC(O)CNCc1ccncn1 AIFCHEM-6464422917 [0,2,0,0,0,0|1,0,0]=3 439 B13R1.718 CC[C@@H](O)CNCc1ccncn1 AIFCHEM-6431723505 [0,2,0,0,0,0|1,0,0]=3 440 B13R1.718 COC(C)CNCc1ccncn1 AIFCHEM-5874065681 [0,2,0,0,0,0|2,0,0]=4 441 B13R1.718 CO[C@@H](C)CNCc1ccncn1 AIFCHEM-5952069086 [0,2,0,0,0,0|2,0,0]=4 442 B13R1.718 CO[C@H](C)CNCc1ccncn1 AIFCHEM-94608838332 [0,2,0,0,0,0|2,0,0]=4 443 B13R1.718 CSC(C)CCNc1ccccn1 AIFCHEM-94586357960 [0,2,0,0,0,0|1,0,0]=3 444 B13R1.718 CSC(C)CCNc1cccnn1 AIFCHEM-5808340375 [0,2,0,0,0,0|2,0,0]=4 445 B13R1.718 OCC(O)CNCc1ccccc1 AIFCHEM-5834193117 [0,2,0,0,0,0|2,0,0]=4 446 B13R1.718 OC[C@@H](F)CNCc1ccccn1 AIFCHEM-94577436167 [0,2,0,0,0,0|1,0,0]=3 447 B13R1.718 OC[C@@H](F)CNCc1ncccn1 AIFCHEM-94577438727 [0,2,0,0,0,0|2,0,0]=4 448 B13R1.718 OC[C@@H](O)CNCc1ccccc1 AIFCHEM-94590563845 [0,2,0,0,0,0|2,0,0]=4 449 B13R1.718 OC[C@H](F)CNCc1ccccn1 AIFCHEM-6483445855 [0,2,0,0,0,0|1,0,0]=3 450 B13R1.718 OC[C@H](F)CNCc1ncccn1 AIFCHEM-6483397728 [0,2,0,0,0,0|2,0,0]=4 451 B13R1.15 CCC(C)CNc1cc(ccn1)C AIFCHEM-5879381355 [0,2,0,0,0,0|1,0,0]=3 452 B13R1.15 CCC(C)CNc1cc(ccn1)O AIFCHEM-94535010962 [0,2,0,0,0,0|1,0,0]=3 453 B13R1.15 CCC(C)CNc1cc(ncn1)C AIFCHEM-5745352516 [0,2,0,0,0,0|2,0,0]=4 454 B13R1.15 CCC(C)CNc1cc(ncn1)Cl AIFCHEM-5691952203 [0,2,0,0,0,0|2,0,0]=4 455 B13R1.15 CCC(C)CNc1cc(ncn1)F AIFCHEM-5592699149 [0,2,0,0,0,0|2,0,0]=4 456 B13R1.15 CCC(C)CNc1cccc(c1)O AIFCHEM-5657361707 [0,2,0,0,0,0|2,0,0]=4 457 B13R1.15 CCC(C)CNc1cccc(n1)F AIFCHEM-6461286383 [0,2,0,0,0,0|1,0,0]=3 458 B13R1.15 C[C@@H](CF)NCc1cc(ccn1)Cl AIFCHEM-6055275533 [0,2,0,0,0,0|2,0,0]=4 459 B13R1.15 C[C@H](CF)NCc1cc(ccn1)Cl AIFCHEM-6116158449 [0,2,0,0,0,0|2,0,0]=4 460 B13R1.15 Cc1cccc(n1)NCC(O)CO AIFCHEM-6200686990 [0,2,0,0,0,0|2,0,0]=4 461 B13R1.15 Cc1cccc(n1)NC[C@H](O)CO AIFCHEM-94590560151 [0,2,0,0,0,0|2,0,0]=4 462 B13R1.15 Cc1ccnc(c1)CNC(C)CO AIFCHEM-94538740367 [0,2,0,0,0,0|2,0,0]=4 463 B13R1.15 Cc1ccnc(c1)CN[C@@H](C)CO AIFCHEM-6438045047 [0,2,0,0,0,0|2,0,0]=4 464 B13R1.15 Cc1ccnc(c1)CN[C@H](C)CO AIFCHEM-6394966908 [0,2,0,0,0,0|2,0,0]=4 465 B13R1.15 OCC(O)CNc1cc(ccn1)Br AIFCHEM-5895488050 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.15 OCC(O)CNc1cccc(n1)O AIFCHEM-5610811693 [0,2,0,0,0,0|2,0,0]=4 467 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)Br AIFCHEM-94590568753 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.135 CCC(C)N(C)Cc1ccccn1 AIFCHEM-6202707966 [0,2,0,0,0,0|1,0,0]=3 469 B13R1.135 CCC(C)N(C)Cc1cccnn1 AIFCHEM-6272088622 [0,2,0,0,0,0|2,0,0]=4 470 B13R1.135 CCC(C)N(C)Cc1ccncn1 AIFCHEM-6257899552 [0,2,0,0,0,0|2,0,0]=4 471 B13R1.254 CC(C)(CO)CNc1ccccn1 AIFCHEM-94586360927 [0,2,0,0,0,0|2,0,0]=4 472 B13R1.351 CC(O)C(C)NCc1ncccn1 AIFCHEM-94601438541 [0,2,0,0,0,0|2,0,0]=4 473 B13R1.417 CCC(CO)NCc1cccnn1 AIFCHEM-6444681721 [0,2,0,0,0,0|2,0,0]=4 474 B13R1.417 CCC(CO)NCc1ncccn1 AIFCHEM-94601438515 [0,2,0,0,0,0|2,0,0]=4 475 B13R1.417 CC[C@@H](CO)NCc1cccnn1 AIFCHEM-6488892262 [0,2,0,0,0,0|2,0,0]=4 476 B13R1.417 CC[C@@H](CO)NCc1ncccn1 AIFCHEM-6505468288 [0,2,0,0,0,0|2,0,0]=4 477 B13R1.417 CC[C@H](CO)NCc1cccnn1 AIFCHEM-6468336706 [0,2,0,0,0,0|2,0,0]=4 478 B13R1.417 CC[C@H](CO)NCc1ncccn1 AIFCHEM-6439170335 [0,2,0,0,0,0|2,0,0]=4 479 B13R1.528 CC(CF)NCc1ncccc1Cl AIFCHEM-6128450570 [0,2,0,0,0,0|2,0,0]=4 480 B13R1.528 CC(CF)NCc1ncccc1F AIFCHEM-6135062052 [0,2,0,0,0,0|2,0,0]=4 481 B13R1.528 CC(CO)NCc1ncccc1Cl AIFCHEM-6431830024 [0,2,0,0,0,0|2,0,0]=4 482 B13R1.528 CC(CO)NCc1ncccc1O AIFCHEM-6431977252 [0,2,0,0,0,0|2,0,0]=4 483 B13R1.528 CCC(=O)NCc1ncccc1Br AIFCHEM-94526499382 [0,2,0,0,0,0|1,0,1]=4 484 B13R1.528 CCC(=O)NCc1ncccc1C AIFCHEM-94526506664 [0,2,0,0,0,0|1,0,1]=4 485 B13R1.528 CCC(=O)NCc1ncccc1F AIFCHEM-94526506171 [0,2,0,0,0,0|1,0,1]=4 486 B13R1.528 CCC(C)CNc1ccccc1C AIFCHEM-94578148230 [0,2,0,0,0,0|2,0,0]=4 487 B13R1.528 CCC(C)CNc1ncccc1F AIFCHEM-5999308726 [0,2,0,0,0,0|1,0,0]=3 488 B13R1.528 CCC(C)CNc1ncccc1O AIFCHEM-6143751253 [0,2,0,0,0,0|1,0,0]=3 489 B13R1.528 CCC(C)CNc1nccnc1C AIFCHEM-5722693589 [0,2,0,0,0,0|2,0,0]=4 490 B13R1.528 C[C@@H](CF)NCc1ncccc1Cl AIFCHEM-6033015571 [0,2,0,0,0,0|2,0,0]=4 491 B13R1.528 C[C@@H](CF)NCc1ncccc1F AIFCHEM-6011752972 [0,2,0,0,0,0|2,0,0]=4 492 B13R1.528 C[C@@H](CO)NCc1ncccc1Cl AIFCHEM-6418478837 [0,2,0,0,0,0|2,0,0]=4 493 B13R1.528 C[C@@H](CO)NCc1ncccc1O AIFCHEM-6419411498 [0,2,0,0,0,0|2,0,0]=4 494 B13R1.528 C[C@H](CF)NCc1ncccc1Cl AIFCHEM-6115979293 [0,2,0,0,0,0|2,0,0]=4 495 B13R1.528 C[C@H](CO)NCc1ncccc1Cl AIFCHEM-6452677975 [0,2,0,0,0,0|2,0,0]=4 496 B13R1.528 C[C@H](CO)NCc1ncccc1O AIFCHEM-6477275534 [0,2,0,0,0,0|2,0,0]=4 497 B13R1.528 Cc1cccnc1CN[C@@H](C)CF AIFCHEM-6011796126 [0,2,0,0,0,0|2,0,0]=4 498 B13R1.528 Cc1cccnc1CN[C@H](C)CF AIFCHEM-6109961039 [0,2,0,0,0,0|2,0,0]=4 499 B13R1.16 CCCC=Cc1nccc(c1C)N AIFCHEM-6362177300 [0,2,0,0,0,0|0,0,2]=4 500 B13R1.16 CCCC=Cc1nccc(c1N)N AIFCHEM-6311917539 [0,2,0,0,0,0|0,0,2]=4 501 B13R1.16 CCCCNc1cccc(c1C)C AIFCHEM-94523042557 [0,2,0,0,0,0|2,0,0]=4 502 B13R1.16 CCCCNc1cccc(c1O)Br AIFCHEM-94523035989 [0,2,0,0,0,0|2,0,0]=4 503 B13R1.16 CCCNCc1cccc(c1Br)F AIFCHEM-5790791185 [0,2,0,0,0,0|2,0,0]=4 504 B13R1.16 CCCNCc1cccc(c1C)Cl AIFCHEM-5875358541 [0,2,0,0,0,0|2,0,0]=4 505 B13R1.16 CCCNCc1cccc(c1Cl)Cl AIFCHEM-94521370703 [0,2,0,0,0,0|2,0,0]=4 506 B13R1.16 CCCNCc1cccc(c1F)Br AIFCHEM-5790382392 [0,2,0,0,0,0|2,0,0]=4 507 B13R1.16 CCCNCc1cccc(c1O)Br AIFCHEM-94569014101 [0,2,0,0,0,0|2,0,0]=4 508 B13R1.16 CCCNCc1cccc(c1O)C AIFCHEM-94569014745 [0,2,0,0,0,0|2,0,0]=4 509 B13R1.16 CCCNCc1cccc(c1O)Cl AIFCHEM-94521367896 [0,2,0,0,0,0|2,0,0]=4 510 B13R1.16 CCCNCc1cccc(c1O)F AIFCHEM-5853175912 [0,2,0,0,0,0|2,0,0]=4 511 B13R1.16 CCCNCc1cccc(c1O)I AIFCHEM-5814655033 [0,2,0,0,0,0|2,0,0]=4 512 B13R1.16 CCCNCc1cccc(c1O)O AIFCHEM-5875428302 [0,2,0,0,0,0|2,0,0]=4 513 B13R1.18 CC(NCCF)c1cc(ccn1)Cl AIFCHEM-5853575332 [0,2,0,0,0,0|2,0,0]=4 514 B13R1.18 CCCCN(C)c1cccc(c1)Cl AIFCHEM-94523040904 [0,2,0,0,0,0|2,0,0]=4 515 B13R1.18 CCCNC(C)c1cc(ncn1)C AIFCHEM-94521370885 [0,2,0,0,0,0|2,0,0]=4 516 B13R1.18 CCCNC(C)c1cccc(c1)Cl AIFCHEM-94569018313 [0,2,0,0,0,0|2,0,0]=4 517 B13R1.18 CCCN[C@@H](C)c1cccc(c1)Cl AIFCHEM-94569021460 [0,2,0,0,0,0|2,0,0]=4 518 B13R1.18 CCCN[C@@H](C)c1cccc(c1)O AIFCHEM-94569016771 [0,2,0,0,0,0|2,0,0]=4 519 B13R1.18 CCCN[C@H](C)c1cccc(c1)Cl AIFCHEM-94569013764 [0,2,0,0,0,0|2,0,0]=4 520 B13R1.18 CCCN[C@H](C)c1cccc(c1)O AIFCHEM-94569023112 [0,2,0,0,0,0|2,0,0]=4 521 B13R1.18 Cc1ccnc(c1)C(C)NCCF AIFCHEM-5800414251 [0,2,0,0,0,0|2,0,0]=4 522 B13R1.20 CCCC(C)Nc1cccc(c1)Br AIFCHEM-94552678942 [0,2,0,0,0,0|2,0,0]=4 523 B13R1.20 CCCN(C)Cc1cc(ccn1)Cl AIFCHEM-5808634289 [0,2,0,0,0,0|1,0,0]=3 524 B13R1.20 CN(CCO)Cc1cccc(n1)Br AIFCHEM-94548504802 [0,2,0,0,0,0|2,0,0]=4 525 B13R1.55 CCCCNc1cc(cc(c1)Br)C AIFCHEM-94523041350 [0,2,0,0,0,0|2,0,0]=4 526 B13R1.55 CCCCNc1cc(cc(c1)Cl)Cl AIFCHEM-94589168132 [0,2,0,0,0,0|2,0,0]=4 527 B13R1.55 CCCCNc1cc(cc(c1)I)I AIFCHEM-94523036912 [0,2,0,0,0,0|2,0,0]=4 528 B13R1.55 CCCCNc1cc(cc(n1)Cl)I AIFCHEM-94523028212 [0,2,0,0,0,0|1,0,0]=3 529 B13R1.55 CCCNCc1cc(cc(c1)Br)Br AIFCHEM-94558117728 [0,2,0,0,0,0|2,0,0]=4 530 B13R1.55 CCCNCc1cc(cc(c1)Br)F AIFCHEM-5791172309 [0,2,0,0,0,0|2,0,0]=4 531 B13R1.55 CCCNCc1cc(cc(c1)C)C AIFCHEM-94569022543 [0,2,0,0,0,0|2,0,0]=4 532 B13R1.55 CCCNCc1cc(cc(c1)F)O AIFCHEM-94569015120 [0,2,0,0,0,0|2,0,0]=4 533 B13R1.55 CCCNCc1cc(cc(n1)C)Br AIFCHEM-94521369664 [0,2,0,0,0,0|1,0,0]=3 534 B13R1.55 Cc1cc(cc(n1)CNCCF)Br AIFCHEM-5827578401 [0,2,0,0,0,0|2,0,0]=4 535 B13R1.149 CC(C)CNCc1cccc(n1)F AIFCHEM-6144922743 [0,2,0,0,0,0|1,0,0]=3 536 B13R1.149 CC(O)CNCc1cc(ccn1)Br AIFCHEM-6395096461 [0,2,0,0,0,0|1,0,0]=3 537 B13R1.149 CC(O)CNCc1cccc(c1)I AIFCHEM-6472397370 [0,2,0,0,0,0|2,0,0]=4 538 B13R1.149 CN(C)CCNc1cc(ccn1)I AIFCHEM-94564767551 [0,2,0,0,0,0|2,0,0]=4 539 B13R1.149 CN(C)CCNc1cccc(n1)Br AIFCHEM-6310235476 [0,2,0,0,0,0|2,0,0]=4 540 B13R1.149 C[C@@H](O)CNCc1cc(ccn1)Br AIFCHEM-6491024367 [0,2,0,0,0,0|1,0,0]=3 541 B13R1.149 C[C@@H](O)CNCc1cccc(c1)I AIFCHEM-6491308892 [0,2,0,0,0,0|2,0,0]=4 542 B13R1.149 C[C@H](O)CNCc1cc(ccn1)Br AIFCHEM-6492801409 [0,2,0,0,0,0|1,0,0]=3 543 B13R1.149 C[C@H](O)CNCc1cccc(c1)I AIFCHEM-6492983779 [0,2,0,0,0,0|2,0,0]=4 544 B13R1.149 Cc1cccc(c1)CNCC(C)C AIFCHEM-94563723600 [0,2,0,0,0,0|2,0,0]=4 545 B13R1.149 Cc1ccnc(c1)CNCC(C)C AIFCHEM-94599511258 [0,2,0,0,0,0|1,0,0]=3 546 B13R1.149 Cc1ccnc(c1)NCCN(C)C AIFCHEM-94564769262 [0,2,0,0,0,0|2,0,0]=4 547 B13R1.149 FC(F)CNCc1cccc(n1)Cl AIFCHEM-5987343555 [0,2,0,0,0,0|2,0,0]=4 548 B13R1.656 CCCC=Cc1nc(ccc1N)N AIFCHEM-6362921453 [0,2,0,0,0,0|0,0,2]=4 549 B13R1.656 CCCCNc1cc(ccc1Br)Cl AIFCHEM-94523042013 [0,2,0,0,0,0|2,0,0]=4 550 B13R1.656 CCCCNc1cc(ccc1Cl)Br AIFCHEM-94523039782 [0,2,0,0,0,0|2,0,0]=4 551 B13R1.656 CCCCNc1cc(ccc1F)F AIFCHEM-94523037125 [0,2,0,0,0,0|2,0,0]=4 552 B13R1.656 CCCNCc1cc(ccc1C)Br AIFCHEM-5790508067 [0,2,0,0,0,0|2,0,0]=4 553 B13R1.656 CCCNCc1cc(ccc1C)Cl AIFCHEM-94569016721 [0,2,0,0,0,0|2,0,0]=4 554 B13R1.656 CCCNCc1cc(ccc1Cl)C AIFCHEM-94521367239 [0,2,0,0,0,0|2,0,0]=4 555 B13R1.656 CCCNCc1cc(ccc1Cl)Cl AIFCHEM-5875440022 [0,2,0,0,0,0|2,0,0]=4 556 B13R1.656 CCCNCc1cc(ccc1Cl)O AIFCHEM-94521371166 [0,2,0,0,0,0|2,0,0]=4 557 B13R1.656 CCCNCc1cc(ccc1F)F AIFCHEM-94533430189 [0,2,0,0,0,0|2,0,0]=4 558 B13R1.656 CCCNCc1cc(ccc1O)Br AIFCHEM-5790611825 [0,2,0,0,0,0|2,0,0]=4 559 B13R1.656 CCCNCc1cc(ccc1O)C AIFCHEM-94569015066 [0,2,0,0,0,0|2,0,0]=4 560 B13R1.656 CCCNCc1cc(ccc1O)Cl AIFCHEM-94521370715 [0,2,0,0,0,0|2,0,0]=4 561 B13R1.656 CCCNCc1cc(ccc1O)F AIFCHEM-94569009636 [0,2,0,0,0,0|2,0,0]=4 562 B13R1.656 CCCNCc1cc(ccc1O)I AIFCHEM-5853381453 [0,2,0,0,0,0|2,0,0]=4 563 B13R1.656 CCCNCc1cc(ccc1O)O AIFCHEM-5790937787 [0,2,0,0,0,0|2,0,0]=4 564 B13R1.656 CCCNCc1nc(ccc1Br)Cl AIFCHEM-94521365928 [0,2,0,0,0,0|1,0,0]=3 565 B13R1.656 CCCNCc1nc(ccc1F)Br AIFCHEM-94521371810 [0,2,0,0,0,0|1,0,0]=3 566 B13R1.656 FCCNCc1nc(ccc1F)Br AIFCHEM-5801010365 [0,2,0,0,0,0|2,0,0]=4 567 B13R1.656 OCCNCc1nc(ccc1F)Cl AIFCHEM-94577781142 [0,2,0,0,0,0|2,0,0]=4 568 B13R1.666 CCCC=Cc1cc(ccn1)C=O AIFCHEM-6474018753 [0,2,0,0,0,0|0,0,2]=4 569 B13R1.666 CCCC=Cc1cc(ccn1)CN AIFCHEM-6319483516 [0,2,0,0,0,0|0,0,2]=4 570 B13R1.666 CCCC=Cc1cccc(n1)CO AIFCHEM-6349569198 [0,2,0,0,0,0|0,0,2]=4 571 B13R1.666 CCCCNc1cc(ccn1)C#N AIFCHEM-94523037829 [0,2,0,0,0,0|1,0,0]=3 572 B13R1.666 CCCCNc1cccc(n1)CC AIFCHEM-94523034765 [0,2,0,0,0,0|1,0,0]=3 573 B13R1.666 CCCCNc1ccnc(n1)OC AIFCHEM-94523036588 [0,2,0,0,0,0|2,0,0]=4 574 B13R1.666 CCCNCc1cc(ccn1)OC AIFCHEM-94569014750 [0,2,0,0,0,0|1,0,0]=3 575 B13R1.666 CCCNCc1cccc(c1)CC AIFCHEM-94521369079 [0,2,0,0,0,0|2,0,0]=4 576 B13R1.26 CCCCN(CC)c1ccccc1 AIFCHEM-94537412306 [0,2,0,0,0,0|2,0,0]=4 577 B13R1.26 CCCNC(CC)c1ccccn1 AIFCHEM-94521368961 [0,2,0,0,0,0|1,0,0]=3 578 B13R1.45 CC(C)CNC(C)c1ncccn1 AIFCHEM-6122682740 [0,2,0,0,0,0|2,0,0]=4 579 B13R1.45 CC(NC[C@@H](C)O)c1cnccn1 AIFCHEM-6498783052 [0,2,0,0,0,0|2,0,0]=4 580 B13R1.45 CC(NC[C@H](C)O)c1cnccn1 AIFCHEM-6492614813 [0,2,0,0,0,0|2,0,0]=4 581 B13R1.45 CC(O)CNC(C)c1cnccn1 AIFCHEM-94558282666 [0,2,0,0,0,0|2,0,0]=4 582 B13R1.122 CCCNC(C)(C)c1ccccc1 AIFCHEM-94569020291 [0,2,0,0,0,0|2,0,0]=4 583 B13R1.122 CCCNC(C)(C)c1ccccn1 AIFCHEM-94569011008 [0,2,0,0,0,0|1,0,0]=3 584 B13R1.674 CCCNC(=O)c1ncccc1C AIFCHEM-94596772774 [0,2,0,0,0,0|1,0,1]=4 585 B13R1.674 CCCNC(=O)c1ncccc1I AIFCHEM-5790824832 [0,2,0,0,0,0|1,0,1]=4 586 B13R1.674 CCCNC(C)c1ccccc1Br AIFCHEM-94569009466 [0,2,0,0,0,0|2,0,0]=4 587 B13R1.674 CCCNC(C)c1ccccc1F AIFCHEM-94569022140 [0,2,0,0,0,0|2,0,0]=4 588 B13R1.674 CCCNC(C)c1ccccc1O AIFCHEM-94569023871 [0,2,0,0,0,0|2,0,0]=4 589 B13R1.674 CCCNC(C)c1ncccc1Cl AIFCHEM-94521366776 [0,2,0,0,0,0|1,0,0]=3 590 B13R1.674 CCCN[C@@H](C)c1ccccc1Br AIFCHEM-94569010019 [0,2,0,0,0,0|2,0,0]=4 591 B13R1.674 CCCN[C@@H](C)c1ccccc1F AIFCHEM-94569011627 [0,2,0,0,0,0|2,0,0]=4 592 B13R1.674 CCCN[C@@H](C)c1ccccc1O AIFCHEM-94543548893 [0,2,0,0,0,0|2,0,0]=4 593 B13R1.674 CCCN[C@H](C)c1ccccc1Br AIFCHEM-94569009469 [0,2,0,0,0,0|2,0,0]=4 594 B13R1.674 CCCN[C@H](C)c1ccccc1F AIFCHEM-94606296364 [0,2,0,0,0,0|2,0,0]=4 595 B13R1.674 CCCN[C@H](C)c1ccccc1O AIFCHEM-94569010819 [0,2,0,0,0,0|2,0,0]=4 596 B13R1.348 CC(C)CC(=O)Nc1ccccn1 AIFCHEM-5962320555 [0,2,0,0,0,0|1,0,1]=4 597 B13R1.348 CC(C)CN(C)Cc1cnccn1 AIFCHEM-5782327662 [0,2,0,0,0,0|2,0,0]=4 598 B13R1.470 CCCN(C)Cc1ccccc1Cl AIFCHEM-94569024444 [0,2,0,0,0,0|2,0,0]=4 599 B13R1.470 CCCN(C)Cc1ccccc1F AIFCHEM-5878765147 [0,2,0,0,0,0|2,0,0]=4 600 B13R1.470 CCCN(C)Cc1ccccc1O AIFCHEM-94532467853 [0,2,0,0,0,0|2,0,0]=4 601 B13R1.470 CCCN(C)Cc1nccnc1Cl AIFCHEM-5808956654 [0,2,0,0,0,0|2,0,0]=4 602 B13R1.470 Cc1cccnc1CN(C)CCO AIFCHEM-6458209144 [0,2,0,0,0,0|2,0,0]=4 603 B13R1.158 CC(C)CNCc1ccccc1Cl AIFCHEM-94555010845 [0,2,0,0,0,0|2,0,0]=4 604 B13R1.158 CC(C)CNCc1ccccc1O AIFCHEM-94572986585 [0,2,0,0,0,0|2,0,0]=4 605 B13R1.158 CC(C)CNCc1ncccc1F AIFCHEM-94563721886 [0,2,0,0,0,0|1,0,0]=3 606 B13R1.158 CC(O)CNCc1ccccc1Br AIFCHEM-6466407006 [0,2,0,0,0,0|2,0,0]=4 607 B13R1.158 CC(O)CNCc1ccccc1O AIFCHEM-94558286349 [0,2,0,0,0,0|2,0,0]=4 608 B13R1.158 CC(O)CNCc1ncccc1Cl AIFCHEM-94558282488 [0,2,0,0,0,0|1,0,0]=3 609 B13R1.158 CC(O)CNCc1ncccc1F AIFCHEM-6395264213 [0,2,0,0,0,0|1,0,0]=3 610 B13R1.158 CC(O)CNCc1ncccc1O AIFCHEM-94558282213 [0,2,0,0,0,0|1,0,0]=3 611 B13R1.158 CC(O)CNCc1nccnc1Cl AIFCHEM-94558280837 [0,2,0,0,0,0|2,0,0]=4 612 B13R1.158 C[C@@H](O)CNCc1ccccc1Br AIFCHEM-6499628157 [0,2,0,0,0,0|2,0,0]=4 613 B13R1.158 C[C@@H](O)CNCc1ccccc1O AIFCHEM-94532463768 [0,2,0,0,0,0|2,0,0]=4 614 B13R1.158 C[C@@H](O)CNCc1ncccc1Cl AIFCHEM-6490857897 [0,2,0,0,0,0|1,0,0]=3 615 B13R1.158 C[C@@H](O)CNCc1ncccc1F AIFCHEM-6490866076 [0,2,0,0,0,0|1,0,0]=3 616 B13R1.158 C[C@@H](O)CNCc1ncccc1O AIFCHEM-6493141058 [0,2,0,0,0,0|1,0,0]=3 617 B13R1.158 C[C@@H](O)CNCc1nccnc1Cl AIFCHEM-6491551022 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.158 C[C@H](O)CNCc1ccccc1Br AIFCHEM-6493229318 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.158 C[C@H](O)CNCc1ccccc1O AIFCHEM-94532463769 [0,2,0,0,0,0|2,0,0]=4 620 B13R1.158 C[C@H](O)CNCc1ncccc1Cl AIFCHEM-6495194095 [0,2,0,0,0,0|1,0,0]=3 621 B13R1.158 C[C@H](O)CNCc1ncccc1F AIFCHEM-6492866123 [0,2,0,0,0,0|1,0,0]=3 622 B13R1.158 C[C@H](O)CNCc1ncccc1O AIFCHEM-6492687415 [0,2,0,0,0,0|1,0,0]=3 623 B13R1.158 C[C@H](O)CNCc1nccnc1Cl AIFCHEM-6493617867 [0,2,0,0,0,0|2,0,0]=4 624 B13R1.158 Cc1cccnc1CNCC(C)O AIFCHEM-6436281521 [0,2,0,0,0,0|1,0,0]=3 625 B13R1.158 Cc1cccnc1CNC[C@@H](C)O AIFCHEM-6493883469 [0,2,0,0,0,0|1,0,0]=3 626 B13R1.158 Cc1cccnc1CNC[C@H](C)O AIFCHEM-6500544734 [0,2,0,0,0,0|1,0,0]=3 627 B13R1.3523 CC(C)(C)CCNc1ccncn1 AIFCHEM-6223035770 [0,2,0,0,0,0|2,0,0]=4 628 B13R1.3523 CC(C)(C)CNCc1cnccn1 AIFCHEM-5927117474 [0,2,0,0,0,0|2,0,0]=4 629 B13R1.3523 CC(C)(O)CNCc1ccncn1 AIFCHEM-6440218346 [0,2,0,0,0,0|2,0,0]=4 630 B13R1.3523 CC(F)(F)CNCc1ncccn1 AIFCHEM-5902825617 [0,2,0,0,0,0|2,0,0]=4 631 B13R1.84 CCCC=Cc1ncccc1C=O AIFCHEM-6376632678 [0,2,0,0,0,0|0,0,2]=4 632 B13R1.84 CCCCNc1ncccc1CO AIFCHEM-94523035235 [0,2,0,0,0,0|1,0,0]=3 633 B13R1.84 CCCCNc1nccnc1OC AIFCHEM-94523038270 [0,2,0,0,0,0|2,0,0]=4 634 B13R1.84 CCCNCc1ccccc1C#N AIFCHEM-5790795864 [0,2,0,0,0,0|2,0,0]=4 635 B13R1.84 CCCNCc1ccccc1SC AIFCHEM-5814717498 [0,2,0,0,0,0|2,0,0]=4 636 B13R1.84 COc1cccnc1CNCCO AIFCHEM-94577777147 [0,2,0,0,0,0|2,0,0]=4 637 B13R1.8919 CCCNCc1c(cccc1Br)F AIFCHEM-94521369215 [0,2,0,0,0,0|2,0,0]=4 638 B13R1.8919 CCCNCc1c(cccc1Br)O AIFCHEM-94569015739 [0,2,0,0,0,0|2,0,0]=4 639 B13R1.8919 CCCNCc1c(cccc1Cl)O AIFCHEM-94521367778 [0,2,0,0,0,0|2,0,0]=4 640 B13R1.8919 CCCNCc1c(cccc1F)O AIFCHEM-5792564542 [0,2,0,0,0,0|2,0,0]=4 641 B13R1.8919 CCCNCc1c(cccc1I)F AIFCHEM-94521367175 [0,2,0,0,0,0|2,0,0]=4 642 B13R1.8919 CCCNCc1c(cccc1I)O AIFCHEM-94521369328 [0,2,0,0,0,0|2,0,0]=4 643 B13R1.8919 CCCNCc1c(cccc1O)C AIFCHEM-5875318218 [0,2,0,0,0,0|2,0,0]=4 644 B13R1.8919 CCCNCc1c(cccc1O)O AIFCHEM-5814756841 [0,2,0,0,0,0|2,0,0]=4 645 B11R2.237 c1cc(co1)CN2CCC2 AIFCHEM-5996117944 [0,0,0,1,1,0|2,0,0]=4 646 B11R2.237 c1csc(c1)CN2CCC2 AIFCHEM-6042461841 [0,0,0,1,1,0|2,0,0]=4 647 B11R2.237 c1nc(co1)CN2CCC2 AIFCHEM-94604919154 [0,0,0,1,1,0|2,0,0]=4 648 B11R2.237 c1nc(cs1)CN2CCC2 AIFCHEM-5996131278 [0,0,0,1,1,0|2,0,0]=4 649 B11R2.385 c1cc(cs1)NCC2CC2 AIFCHEM-5670400180 [0,0,0,1,1,0|2,0,0]=4 650 B11R2.385 c1csc(c1)CNC2CC2 AIFCHEM-94573318906 [0,0,0,1,1,0|2,0,0]=4 651 B11R2.385 c1csc(n1)CNC2CC2 AIFCHEM-94573312387 [0,0,0,1,1,0|2,0,0]=4 652 B11R2.385 c1nc(c[nH]1)CNC2CC2 AIFCHEM-94573315468 [0,0,0,1,1,0|2,0,0]=4 653 B11R2.385 c1nc(co1)CNC2CC2 AIFCHEM-94573312922 [0,0,0,1,1,0|2,0,0]=4 654 B13R2.12 Nc1ccc(nc1)C2=CCCC2 AIFCHEM-6358619238 [0,1,0,1,0,0|0,0,2]=4 655 B13R2.527 Brc1ccc(cc1)NCC2CC2 AIFCHEM-94608711422 [0,1,0,1,0,0|2,0,0]=4 656 B13R2.527 Brc1ccc(nc1)CNC2CC2 AIFCHEM-94573315520 [0,1,0,1,0,0|1,0,0]=3 657 B13R2.527 Brc1cnc(nc1)NCC2CC2 AIFCHEM-5630656346 [0,1,0,1,0,0|2,0,0]=4 658 B13R2.527 Cc1ccc(nn1)NCC2CC2 AIFCHEM-6204716035 [0,1,0,1,0,0|2,0,0]=4 659 B13R2.527 Clc1cnc(nc1)NCC2CC2 AIFCHEM-6256466971 [0,1,0,1,0,0|2,0,0]=4 660 B13R2.1069 Cc1ccc(cc1)NC2CCC2 AIFCHEM-94547752397 [0,1,0,1,0,0|2,0,0]=4 661 B13R2.1069 Cc1ccc(nc1)CN2CCC2 AIFCHEM-94604922689 [0,1,0,1,0,0|1,0,0]=3 662 B13R2.1069 Cc1ccc(nc1)NC2CCC2 AIFCHEM-94576048504 [0,1,0,1,0,0|1,0,0]=3 663 B13R2.1069 Clc1ccc(cc1)NC2CCC2 AIFCHEM-94576050178 [0,1,0,1,0,0|2,0,0]=4 664 B13R2.1069 Clc1ccc(nc1)CN2CCC2 AIFCHEM-94604921751 [0,1,0,1,0,0|1,0,0]=3 665 B13R2.1069 Ic1ccc(cc1)CN2CCC2 AIFCHEM-94604920136 [0,1,0,1,0,0|2,0,0]=4 666 B13R2.1069 Ic1ccc(cc1)NC2CCC2 AIFCHEM-94576054902 [0,1,0,1,0,0|2,0,0]=4 667 B13R2.1069 Ic1ccc(nc1)NC2CCC2 AIFCHEM-94576050255 [0,1,0,1,0,0|1,0,0]=3 668 B13R2.1069 Oc1ccc(nc1)CN2CCC2 AIFCHEM-94604921753 [0,1,0,1,0,0|1,0,0]=3 669 B13R2.3 C1=C(CCCC1)c2cnccn2 AIFCHEM-6358188144 [0,1,0,1,0,0|1,0,1]=4 670 B13R2.17 C[C@@H]1C[C@H]1NCc2ccncn2 AIFCHEM-94559008082 [0,1,0,1,0,0|1,0,0]=3 671 B13R2.17 FC1CC1NCc2ccccn2 AIFCHEM-94597357665 [0,1,0,1,0,0|1,0,0]=3 672 B13R2.17 FC1CC1NCc2cccnn2 AIFCHEM-5864837457 [0,1,0,1,0,0|2,0,0]=4 673 B13R2.17 FC1CC1NCc2ccncn2 AIFCHEM-5872426972 [0,1,0,1,0,0|2,0,0]=4 674 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccn2 AIFCHEM-5808796545 [0,1,0,1,0,0|1,0,0]=3 675 B13R2.17 F[C@@H]1C[C@H]1NCc2cccnn2 AIFCHEM-5863289249 [0,1,0,1,0,0|2,0,0]=4 676 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccn2 AIFCHEM-6045509686 [0,1,0,1,0,0|1,0,0]=3 677 B13R2.17 F[C@H]1C[C@@H]1NCc2cccnn2 AIFCHEM-6062344756 [0,1,0,1,0,0|2,0,0]=4 678 B13R2.17 F[C@H]1C[C@@H]1NCc2ccncn2 AIFCHEM-6062339904 [0,1,0,1,0,0|2,0,0]=4 679 B13R2.17 F[C@H]1C[C@H]1NCc2ccccn2 AIFCHEM-6010733717 [0,1,0,1,0,0|1,0,0]=3 680 B13R2.17 F[C@H]1C[C@H]1NCc2cccnn2 AIFCHEM-6010826696 [0,1,0,1,0,0|2,0,0]=4 681 B13R2.17 F[C@H]1C[C@H]1NCc2ccncn2 AIFCHEM-6010584647 [0,1,0,1,0,0|2,0,0]=4 682 B13R2.64 C(=C1CCCC1)c2ccccn2 AIFCHEM-6314169176 [0,1,0,1,0,0|0,0,1]=3 683 B13R2.64 C(=C1CCCC1)c2ncccn2 AIFCHEM-6311060427 [0,1,0,1,0,0|1,0,1]=4 684 B13R2.1613 CCN1CCOc2c1cccn2 AIFCHEM-94537412219 [0,1,0,1,0,0|1,0,0]=3 685 B13R2.2383 c1cc(ncn1)CNC2COC2 AIFCHEM-5694942702 [0,1,0,1,0,0|2,0,0]=4 686 B13R2.2383 c1ccc(cc1)CNC2COC2 AIFCHEM-94539149906 [0,1,0,1,0,0|2,0,0]=4 687 B13R2.2383 c1cnc(nn1)NCC2CCC2 AIFCHEM-6225881991 [0,1,0,1,0,0|2,0,0]=4 688 B13R2.2383 c1cnnc(c1)CNC2COC2 AIFCHEM-5714473232 [0,1,0,1,0,0|2,0,0]=4 689 B13R2.57 CCN1CCc2ncncc2C1 AIFCHEM-94537417538 [0,1,0,1,0,0|2,0,0]=4 690 B13R2.3203 CC1(CC1)NCc2cccnn2 AIFCHEM-6134289935 [0,1,0,1,0,0|2,0,0]=4 691 B13R2.13 Cc1cccc(n1)C2=CCCC2 AIFCHEM-6299065148 [0,1,0,1,0,0|0,0,2]=4 692 B13R2.13 Cc1ccnc(c1)C2=CCCC2 AIFCHEM-6203745226 [0,1,0,1,0,0|0,0,2]=4 693 B13R2.13 Nc1cccc(n1)C2=CCCC2 AIFCHEM-6447698436 [0,1,0,1,0,0|0,0,2]=4 694 B13R2.662 CCN1CCc2c1ccc(c2)Br AIFCHEM-94537418612 [0,1,0,1,0,0|2,0,0]=4 695 B13R2.662 CCN1CCc2c1ccc(c2)F AIFCHEM-94537418893 [0,1,0,1,0,0|2,0,0]=4 696 B13R2.662 CCN1CCc2c1ccc(c2)O AIFCHEM-94537427205 [0,1,0,1,0,0|2,0,0]=4 697 B13R2.662 CCN1CCc2c1ccc(n2)Br AIFCHEM-94537414004 [0,1,0,1,0,0|1,0,0]=3 698 B13R2.2091 CCN1CCc2c1c(ccc2)Br AIFCHEM-94537423754 [0,1,0,1,0,0|2,0,0]=4 699 B13R2.2091 CCN1CCc2c1c(ccc2)C AIFCHEM-94537424119 [0,1,0,1,0,0|2,0,0]=4 700 B13R2.3021 Brc1ccnc(c1)CN2CCC2 AIFCHEM-6016078333 [0,1,0,1,0,0|1,0,0]=3 701 B13R2.5331 Brc1cccc(c1)CNC2CC2 AIFCHEM-94573315531 [0,1,0,1,0,0|2,0,0]=4 702 B13R2.5331 Brc1ccnc(c1)CNC2CC2 AIFCHEM-94573313418 [0,1,0,1,0,0|1,0,0]=3 703 B13R2.5331 Brc1nccc(n1)NCC2CC2 AIFCHEM-5603984617 [0,1,0,1,0,0|2,0,0]=4 704 B13R2.5331 Cc1ccnc(c1)C=CC2CC2 AIFCHEM-6203736140 [0,1,0,1,0,0|0,0,2]=4 705 B13R2.5331 Cc1ccnc(n1)NCC2CC2 AIFCHEM-6263696959 [0,1,0,1,0,0|2,0,0]=4 706 B13R2.5331 Cc1cnnc(c1)NCC2CC2 AIFCHEM-6233511650 [0,1,0,1,0,0|2,0,0]=4 707 B13R2.5331 Clc1ccnc(c1)NCC2CC2 AIFCHEM-5902775340 [0,1,0,1,0,0|1,0,0]=3 708 B13R2.5331 Oc1cccc(n1)NCC2CC2 AIFCHEM-5617736588 [0,1,0,1,0,0|1,0,0]=3 709 B13R2.690 CC(NC1CC1)c2ccccn2 AIFCHEM-6108289590 [0,1,0,1,0,0|1,0,0]=3 710 B13R2.690 CN(CC1CC1)c2ccccc2 AIFCHEM-94545176794 [0,1,0,1,0,0|2,0,0]=4 711 B13R2.8137 CC(c1ccccn1)N2CCC2 AIFCHEM-94604918966 [0,1,0,1,0,0|1,0,0]=3 712 B13R2.26 CCCN1Cc2cncnc2C1 AIFCHEM-94568733596 [0,1,0,1,0,0|2,0,0]=4 713 B13R2.31 FC1CN(C1)Cc2ccccn2 AIFCHEM-5647432697 [0,1,0,1,0,0|1,0,0]=3 714 B13R2.31 FC1CN(C1)Cc2cnccn2 AIFCHEM-5599980217 [0,1,0,1,0,0|2,0,0]=4 715 B13R2.444 CN(Cc1cnccn1)C2CC2 AIFCHEM-94542481855 [0,1,0,1,0,0|2,0,0]=4 716 B13R2.9 CCN1CCc2c1cccc2Br AIFCHEM-94537412918 [0,1,0,1,0,0|2,0,0]=4 717 B13R2.3587 Cc1cncnc1NCC2CC2 AIFCHEM-6232843373 [0,1,0,1,0,0|2,0,0]=4 718 B13R2.3587 Clc1cccnc1CNC2CC2 AIFCHEM-6109073370 [0,1,0,1,0,0|1,0,0]=3 719 B13R2.3587 Clc1nccnc1CNC2CC2 AIFCHEM-94573313048 [0,1,0,1,0,0|2,0,0]=4 720 B13R2.3587 Fc1ccccc1NCC2CC2 AIFCHEM-6022461600 [0,1,0,1,0,0|2,0,0]=4 721 B13R2.3587 Ic1ccccc1CNC2CC2 AIFCHEM-6108479009 [0,1,0,1,0,0|2,0,0]=4 722 B13R2.3587 Oc1ccccc1CNC2CC2 AIFCHEM-94532461455 [0,1,0,1,0,0|2,0,0]=4 723 B13R2.5225 Fc1ccccc1CN2CCC2 AIFCHEM-5996467343 [0,1,0,1,0,0|2,0,0]=4 724 B13R2.5225 Oc1ccccc1CN2CCC2 AIFCHEM-94604924792 [0,1,0,1,0,0|2,0,0]=4 725 B13R2.5225 Oc1ccccc1NC2CCC2 AIFCHEM-94591817362 [0,1,0,1,0,0|2,0,0]=4 726 B13R2.5225 Oc1cccnc1C=C2CCC2 AIFCHEM-6260910956 [0,1,0,1,0,0|0,0,2]=4 727 B13R2.5225 Oc1cccnc1CN2CCC2 AIFCHEM-5996166266 [0,1,0,1,0,0|1,0,0]=3 728 B9R1.12 CCCNc1cscn1 AIFCHEM-94557114815 [1,0,0,0,1,0|2,0,0]=4 729 B9R1.12 CCNCc1ccco1 AIFCHEM-94594829503 [1,0,0,0,1,0|2,0,0]=4 730 B9R1.12 CCNCc1cocn1 AIFCHEM-94553456429 [1,0,0,0,1,0|2,0,0]=4