0 B12R1.30 CCCCN(C)c1ccncc1 AIFCHEM-94523028571 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.30 CCCNC(=O)c1ccccc1 AIFCHEM-94565582226 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.30 CCCNC(=O)c1cncnc1 AIFCHEM-5793656241 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.28 CCCC=Cc1ncccn1 AIFCHEM-6312655367 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.28 CCCNCc1ccncc1 AIFCHEM-5790435281 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.28 CCOC=Cc1ccncc1 AIFCHEM-6380433924 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.11 C#CC(C)NC(=O)c1ccccc1 AIFCHEM-94565581145 [0,1,0,0,0,0|1,0,2]=4 7 B13R1.11 C#C[C@H](C)NC(=O)c1ccccc1 AIFCHEM-94565576077 [0,1,0,0,0,0|1,0,2]=4 8 B13R1.17 C#CCNC(=O)c1ccc(cc1)I AIFCHEM-94588320211 [0,1,0,0,0,0|1,0,2]=4 9 B13R1.17 C#CCNC(=O)c1ccc(cc1)O AIFCHEM-6195946417 [0,1,0,0,0,0|1,0,2]=4 10 B13R1.17 CCCCN(C)c1ccc(cc1)C AIFCHEM-94523039972 [0,1,0,0,0,0|3,0,0]=4 11 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl AIFCHEM-94519630974 [0,1,0,0,0,0|1,0,0]=2 12 B13R1.17 CCCNC(=O)c1ccc(cc1)O AIFCHEM-94521381894 [0,1,0,0,0,0|1,0,0]=2 13 B13R1.17 CCCNC(=O)c1ccc(cn1)Br AIFCHEM-94521377355 [0,1,0,0,0,0|2,0,0]=3 14 B13R1.17 CCCNC(=O)c1ccc(nn1)C AIFCHEM-94521379793 [0,1,0,0,0,0|3,0,0]=4 15 B13R1.17 CCCNC(=O)c1ccc(nn1)O AIFCHEM-94521377951 [0,1,0,0,0,0|3,0,0]=4 16 B13R1.17 CCCNC(=O)c1cnc(cn1)C AIFCHEM-5815574386 [0,1,0,0,0,0|3,0,0]=4 17 B13R1.17 O=C(NCCF)c1ccc(cn1)O AIFCHEM-94538169817 [0,1,0,0,0,0|3,0,0]=4 18 B13R1.18 CCCCN(C)c1cccc(c1)Cl AIFCHEM-94523040904 [0,1,0,0,0,0|3,0,0]=4 19 B13R1.18 CCCNC(=O)c1cc(=O)cco1 AIFCHEM-5815138351 [0,1,0,0,0,0|2,0,0]=3 20 B13R1.18 CCCNC(=O)c1cccc(=O)[nH]1 AIFCHEM-5791081821 [0,1,0,0,0,0|2,0,0]=3 21 B13R1.18 CCCNC(=O)c1cccc(c1)Br AIFCHEM-5793005127 [0,1,0,0,0,0|1,0,0]=2 22 B13R1.18 CCCNC(=O)c1cccc(c1)Cl AIFCHEM-94521379007 [0,1,0,0,0,0|1,0,0]=2 23 B13R1.18 CCCNC(=O)c1cccc(c1)O AIFCHEM-94521381883 [0,1,0,0,0,0|1,0,0]=2 24 B13R1.18 CCCNC(=O)c1ccnc(n1)C AIFCHEM-5853908792 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.18 CCCNC(=O)c1cncc(n1)Br AIFCHEM-94521373258 [0,1,0,0,0,0|3,0,0]=4 26 B13R1.18 CCCNC(C)c1cccc(c1)Cl AIFCHEM-94569018313 [0,1,0,0,0,0|2,0,1]=4 27 B13R1.18 CCCN[C@@H](C)c1cccc(c1)Cl AIFCHEM-94569021460 [0,1,0,0,0,0|2,0,1]=4 28 B13R1.18 CCCN[C@@H](C)c1cccc(c1)O AIFCHEM-94569016771 [0,1,0,0,0,0|2,0,1]=4 29 B13R1.18 CCCN[C@H](C)c1cccc(c1)Cl AIFCHEM-94569013764 [0,1,0,0,0,0|2,0,1]=4 30 B13R1.18 CCCN[C@H](C)c1cccc(c1)O AIFCHEM-94569023112 [0,1,0,0,0,0|2,0,1]=4 31 B13R1.18 O=C(NCCF)c1cc(=O)cco1 AIFCHEM-5800886035 [0,1,0,0,0,0|3,0,0]=4 32 B13R1.18 O=C(NCCF)c1cncc(c1)O AIFCHEM-5854221499 [0,1,0,0,0,0|3,0,0]=4 33 B13R1.24 C#CCCNC(=O)c1ccccc1 AIFCHEM-94541770295 [0,1,0,0,0,0|1,0,1]=3 34 B13R1.24 CC#CCNC(=O)c1ccccc1 AIFCHEM-94565581648 [0,1,0,0,0,0|1,0,1]=3 35 B13R1.24 CC#CCNC(=O)c1ccncc1 AIFCHEM-5694551369 [0,1,0,0,0,0|2,0,1]=4 36 B13R1.24 CCCCCN(C)c1ccccc1 AIFCHEM-94551422681 [0,1,0,0,0,0|3,0,0]=4 37 B13R1.24 CCCCNC(=O)c1ccnnc1 AIFCHEM-5695722382 [0,1,0,0,0,0|3,0,0]=4 38 B13R1.24 CCNCCC(O)c1ccccc1 AIFCHEM-94537422180 [0,1,0,0,0,0|1,0,2]=4 39 B13R1.24 COCCNC(=O)c1ccccn1 AIFCHEM-94578913846 [0,1,0,0,0,0|2,0,0]=3 40 B13R1.24 N#CCCNC(=O)c1cccnc1 AIFCHEM-5753900683 [0,1,0,0,0,0|2,0,1]=4 41 B13R1.26 CCCCN(CC)c1ccccc1 AIFCHEM-94537412306 [0,1,0,0,0,0|3,0,0]=4 42 B13R1.45 CC(C)CNC(=O)c1cccnc1 AIFCHEM-6179646778 [0,1,0,0,0,0|2,0,0]=3 43 B13R1.45 CC(C)CNC(=O)c1ccncn1 AIFCHEM-6146598324 [0,1,0,0,0,0|3,0,0]=4 44 B13R1.45 CC(C)CNC(=O)c1ccnnc1 AIFCHEM-6144617235 [0,1,0,0,0,0|3,0,0]=4 45 B13R1.45 CC(C)CNC(=O)c1cnccn1 AIFCHEM-94563734852 [0,1,0,0,0,0|3,0,0]=4 46 B13R1.45 NC(=O)CNC(=O)c1ccccc1 AIFCHEM-94550128274 [0,1,0,0,0,0|2,0,1]=4 47 B13R1.45 O=C(NCC(F)F)c1ccccn1 AIFCHEM-94578924796 [0,1,0,0,0,0|3,0,0]=4 48 B13R1.47 CCCN(C)C(=O)c1ccccc1 AIFCHEM-94565582921 [0,1,0,0,0,0|1,0,0]=2 49 B13R1.47 CCCN(C)C(=O)c1cccnc1 AIFCHEM-5809080333 [0,1,0,0,0,0|2,0,0]=3 50 B13R1.47 CCCN(C)C(=O)c1cccnn1 AIFCHEM-5825573475 [0,1,0,0,0,0|3,0,0]=4 51 B13R1.47 CCCN(C)C(=O)c1ccncc1 AIFCHEM-5802856802 [0,1,0,0,0,0|2,0,0]=3 52 B13R1.47 CCCN(C)C(=O)c1ccnnc1 AIFCHEM-5802370955 [0,1,0,0,0,0|3,0,0]=4 53 B13R1.47 CCCN(C)C(=O)c1cnccn1 AIFCHEM-5802423192 [0,1,0,0,0,0|3,0,0]=4 54 B13R1.47 CCCN(C)C(=O)c1ncccn1 AIFCHEM-5802322682 [0,1,0,0,0,0|3,0,0]=4 55 B13R1.122 CCCNC(C)(C)c1ccccc1 AIFCHEM-94569020291 [0,1,0,0,0,0|2,0,1]=4 56 B13R1.674 C#CCNC(=O)c1ccccc1Cl AIFCHEM-94562153466 [0,1,0,0,0,0|1,0,2]=4 57 B13R1.674 CCCNC(=O)c1ccncc1Br AIFCHEM-94521374318 [0,1,0,0,0,0|2,0,0]=3 58 B13R1.674 CCCNC(=O)c1ccncc1C AIFCHEM-94521378134 [0,1,0,0,0,0|2,0,0]=3 59 B13R1.674 CCCNC(=O)c1ncccc1C AIFCHEM-94596772774 [0,1,0,0,0,0|2,0,0]=3 60 B13R1.674 CCCNC(=O)c1ncccc1I AIFCHEM-5790824832 [0,1,0,0,0,0|2,0,0]=3 61 B13R1.674 CCCNC(=O)c1nccnc1C AIFCHEM-5853871017 [0,1,0,0,0,0|3,0,0]=4 62 B13R1.674 CCCNC(C)c1ccccc1Br AIFCHEM-94569009466 [0,1,0,0,0,0|2,0,1]=4 63 B13R1.674 CCCNC(C)c1ccccc1F AIFCHEM-94569022140 [0,1,0,0,0,0|2,0,1]=4 64 B13R1.674 CCCNC(C)c1ccccc1O AIFCHEM-94569023871 [0,1,0,0,0,0|2,0,1]=4 65 B13R1.674 CCCN[C@@H](C)c1ccccc1Br AIFCHEM-94569010019 [0,1,0,0,0,0|2,0,1]=4 66 B13R1.674 CCCN[C@@H](C)c1ccccc1F AIFCHEM-94569011627 [0,1,0,0,0,0|2,0,1]=4 67 B13R1.674 CCCN[C@@H](C)c1ccccc1O AIFCHEM-94543548893 [0,1,0,0,0,0|2,0,1]=4 68 B13R1.674 CCCN[C@H](C)c1ccccc1Br AIFCHEM-94569009469 [0,1,0,0,0,0|2,0,1]=4 69 B13R1.674 CCCN[C@H](C)c1ccccc1F AIFCHEM-94606296364 [0,1,0,0,0,0|2,0,1]=4 70 B13R1.674 CCCN[C@H](C)c1ccccc1O AIFCHEM-94569010819 [0,1,0,0,0,0|2,0,1]=4 71 B13R1.674 O=C(NCCF)c1ccncc1O AIFCHEM-5802153882 [0,1,0,0,0,0|3,0,0]=4 72 B13R2.3 C1=C(OCCC1)c2cccnn2 AIFCHEM-6367839091 [0,0,0,1,0,0|3,0,0]=4 73 B13R2.690 CN(CC1CC1)c2ccccc2 AIFCHEM-94545176794 [0,0,0,1,0,0|3,0,0]=4 74 B13R2.690 O=C(NC1CC1)c2cccnn2 AIFCHEM-94573322946 [0,0,0,1,0,0|3,0,0]=4 75 B11R1.29 CCCNC(=O)c1cc[nH]n1 AIFCHEM-94576494631 [0,0,0,0,1,0|3,0,0]=4 76 B11R1.29 CCCNC(=O)c1ccco1 AIFCHEM-94521381097 [0,0,0,0,1,0|2,0,0]=3 77 B11R1.29 CCCNC(=O)c1ccno1 AIFCHEM-5791444319 [0,0,0,0,1,0|3,0,0]=4 78 B11R1.29 CCCNC(=O)c1cncs1 AIFCHEM-5791023939 [0,0,0,0,1,0|3,0,0]=4 79 B11R1.29 CCCNC(=O)c1cnsc1 AIFCHEM-5793127516 [0,0,0,0,1,0|3,0,0]=4 80 B11R1.29 CCCNC(=O)c1nccs1 AIFCHEM-94521374375 [0,0,0,0,1,0|3,0,0]=4 81 B11R1.29 O=C(NCCF)c1cc[nH]c1 AIFCHEM-5801854197 [0,0,0,0,1,0|3,0,0]=4 82 B11R1.29 O=C(NCCF)c1ccc[nH]1 AIFCHEM-5802205843 [0,0,0,0,1,0|3,0,0]=4 83 B13R1.44 C/C=C/CC(=O)Nc1ccccc1 AIFCHEM-94577031294 [0,0,0,0,0,1|1,0,2]=4 84 B13R1.44 CCCCC(=O)Nc1ccccn1 AIFCHEM-94586363259 [0,0,0,0,0,1|2,0,0]=3 85 B13R1.44 CCCCC(=O)Nc1ccncc1 AIFCHEM-94534099520 [0,0,0,0,0,1|2,0,0]=3 86 B13R1.44 CCCCC(=O)Nc1ccncn1 AIFCHEM-94534109393 [0,0,0,0,0,1|3,0,0]=4 87 B13R1.44 CCCCN(C)Cc1ccccc1 AIFCHEM-94536079434 [0,0,0,0,0,1|3,0,0]=4 88 B13R1.44 CCCNC(=O)Cc1ncccn1 AIFCHEM-94521379928 [0,0,0,0,0,1|3,0,0]=4 89 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [2,0,0,0,0,0|1,0,0]=3 90 B12R1.16 CCCN(C)c1ccc(cc1)C AIFCHEM-94569020742 [1,1,0,0,0,0|2,0,0]=4 91 B12R1.16 CCCN(C)c1ccc(cc1)I AIFCHEM-94569022906 [1,1,0,0,0,0|2,0,0]=4 92 B12R1.308 CCCN(C)c1ccccc1Br AIFCHEM-94569021465 [1,1,0,0,0,0|2,0,0]=4 93 B12R1.1 CCCCNc1ccc(cc1)C AIFCHEM-94523028188 [1,1,0,0,0,0|2,0,0]=4 94 B12R1.1 CCCCNc1ccc(cc1)F AIFCHEM-94523042368 [1,1,0,0,0,0|2,0,0]=4 95 B12R1.1 COCC=Cc1ccc(cc1)F AIFCHEM-6359501464 [1,1,0,0,0,0|2,0,0]=4 96 B12R1.28 CCCC=Cc1cccc(c1)F AIFCHEM-6382549502 [1,1,0,0,0,0|1,0,0]=3 97 B12R1.28 CCCCNc1cccc(c1)Br AIFCHEM-94552679827 [1,1,0,0,0,0|2,0,0]=4 98 B12R1.28 CCCCNc1cccc(c1)I AIFCHEM-94523040021 [1,1,0,0,0,0|2,0,0]=4 99 B12R1.28 CCCNCc1cccc(c1)O AIFCHEM-94569022018 [1,1,0,0,0,0|1,0,1]=4 100 B12R1.28 CCOC=Cc1cccc(c1)C AIFCHEM-6334722464 [1,1,0,0,0,0|2,0,0]=4 101 B12R1.28 COCC=Cc1cccc(c1)N AIFCHEM-94552694627 [1,1,0,0,0,0|2,0,0]=4 102 B12R1.267 CCCC=Cc1ccncc1O AIFCHEM-6375963658 [1,1,0,0,0,0|2,0,0]=4 103 B12R1.267 CCCNCc1ccccc1Cl AIFCHEM-94555005997 [1,1,0,0,0,0|1,0,1]=4 104 B12R1.267 CCCNCc1ccccc1O AIFCHEM-94592060285 [1,1,0,0,0,0|1,0,1]=4 105 B12R1.267 CCOC=Cc1ccccc1C AIFCHEM-94536265848 [1,1,0,0,0,0|2,0,0]=4 106 B12R1.267 COCC=Cc1ccccc1F AIFCHEM-6203896649 [1,1,0,0,0,0|2,0,0]=4 107 B12R1.267 COCC=Cc1ccccc1O AIFCHEM-6341471182 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.29 CCCNC(=O)c1cc(c[nH]1)F AIFCHEM-5793711670 [0,1,0,0,1,0|2,0,0]=4 109 B12R1.29 CCCNC(=O)c1cc(cs1)Br AIFCHEM-94521375097 [0,1,0,0,1,0|2,0,0]=4 110 B12R1.29 CCCNC(=O)c1cc(cs1)Cl AIFCHEM-5791053990 [0,1,0,0,1,0|2,0,0]=4 111 B12R1.35 CCCCNC(=O)c1cc[nH]c1 AIFCHEM-94570985296 [0,1,0,0,1,0|2,0,0]=4 112 B12R1.35 COCCNC(=O)c1ccoc1 AIFCHEM-6016830800 [0,1,0,0,1,0|2,0,0]=4 113 B12R1.35 CSCCNC(=O)c1cc[nH]c1 AIFCHEM-94598934371 [0,1,0,0,1,0|2,0,0]=4 114 B12R1.54 CC(C)CNC(=O)c1cc[nH]c1 AIFCHEM-94563734593 [0,1,0,0,1,0|2,0,0]=4 115 B12R1.54 CC(C)CNC(=O)c1ccco1 AIFCHEM-6162410015 [0,1,0,0,1,0|2,0,0]=4 116 B12R1.55 CCCN(C)C(=O)c1ccc[nH]1 AIFCHEM-5809442663 [0,1,0,0,1,0|2,0,0]=4 117 B12R1.460 CCCNC(=O)c1ccoc1C AIFCHEM-94521380072 [0,1,0,0,1,0|2,0,0]=4 118 B12R1.460 CCCNC(=O)c1ccsc1Br AIFCHEM-94521376701 [0,1,0,0,1,0|2,0,0]=4 119 B12R1.460 CCCNC(=O)c1cscc1Br AIFCHEM-5791819966 [0,1,0,0,1,0|2,0,0]=4 120 B14R1.33 CCC#CC(=O)Nc1ccc(cc1)Cl AIFCHEM-5990437984 [0,1,0,0,0,1|1,0,1]=4 121 B14R1.33 CCCCC(=O)Nc1ccc(=O)[nH]c1 AIFCHEM-94595377602 [0,1,0,0,0,1|2,0,0]=4 122 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608720893 [0,1,0,0,0,1|1,0,0]=3 123 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I AIFCHEM-94534108884 [0,1,0,0,0,1|1,0,0]=3 124 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br AIFCHEM-94521375627 [0,1,0,0,0,1|1,0,0]=3 125 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C AIFCHEM-94521379642 [0,1,0,0,0,1|1,0,0]=3 126 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O AIFCHEM-94521374824 [0,1,0,0,0,1|1,0,0]=3 127 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl AIFCHEM-94521378090 [0,1,0,0,0,1|2,0,0]=4 128 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br AIFCHEM-94580209754 [0,1,0,0,0,1|2,0,0]=4 129 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F AIFCHEM-94580217129 [0,1,0,0,0,1|2,0,0]=4 130 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608724963 [0,1,0,0,0,1|2,0,0]=4 131 B14R1.33 COCCC(=O)Nc1ccc(cc1)C AIFCHEM-94584235681 [0,1,0,0,0,1|2,0,0]=4 132 B14R1.33 COCCC(=O)Nc1ccc(cc1)F AIFCHEM-94552026651 [0,1,0,0,0,1|2,0,0]=4 133 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F AIFCHEM-94552029593 [0,1,0,0,0,1|2,0,0]=4 134 B14R1.34 CCCCC(=O)Nc1cc(ccn1)I AIFCHEM-94534109017 [0,1,0,0,0,1|2,0,0]=4 135 B14R1.34 CCCCC(=O)Nc1cncc(c1)C AIFCHEM-94524190187 [0,1,0,0,0,1|2,0,0]=4 136 B14R1.34 CCCCC(=O)Nc1cncc(c1)I AIFCHEM-94534106169 [0,1,0,0,0,1|2,0,0]=4 137 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl AIFCHEM-94521381156 [0,1,0,0,0,1|2,0,0]=4 138 B14R1.34 CCOCC(=O)Nc1cccc(c1)O AIFCHEM-94552460189 [0,1,0,0,0,1|2,0,0]=4 139 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br AIFCHEM-94580219059 [0,1,0,0,0,1|2,0,0]=4 140 B14R1.34 COCCC(=O)Nc1cccc(c1)F AIFCHEM-94579359770 [0,1,0,0,0,1|2,0,0]=4 141 B14R1.34 COCCC(=O)Nc1cccc(c1)O AIFCHEM-94552457389 [0,1,0,0,0,1|2,0,0]=4 142 B14R1.34 CSCCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523501307 [0,1,0,0,0,1|2,0,0]=4 143 B14R1.34 CSCCC(=O)Nc1cccc(c1)I AIFCHEM-5650934977 [0,1,0,0,0,1|2,0,0]=4 144 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 AIFCHEM-94577035284 [0,1,0,0,0,1|2,0,0]=4 145 B14R1.158 CCCOCC(=O)Nc1cncnc1 AIFCHEM-6120504460 [0,1,0,0,0,1|2,0,0]=4 146 B14R1.158 COCCNC(=O)Cc1ccncc1 AIFCHEM-94603098759 [0,1,0,0,0,1|2,0,0]=4 147 B14R1.158 CSCCNC(=O)Cc1cccnc1 AIFCHEM-94598931452 [0,1,0,0,0,1|2,0,0]=4 148 B14R1.158 N#CCCCC(=O)Nc1ccccc1 AIFCHEM-94552044110 [0,1,0,0,0,1|1,0,1]=4 149 B14R1.166 CCCCC(=O)N(C)c1ccccc1 AIFCHEM-94534075227 [0,1,0,0,0,1|1,0,0]=3 150 B14R1.166 CCCCC(=O)N(C)c1ccncc1 AIFCHEM-94534100391 [0,1,0,0,0,1|2,0,0]=4 151 B14R1.166 CCCNC(=O)C(O)c1ccccc1 AIFCHEM-5875709630 [0,1,0,0,0,1|1,0,0]=3 152 B14R1.166 CCCNC(=O)[C@@H](O)c1ccccc1 AIFCHEM-94521375229 [0,1,0,0,0,1|1,0,0]=3 153 B14R1.166 CCCNC(=O)[C@H](O)c1ccccc1 AIFCHEM-94521379556 [0,1,0,0,0,1|1,0,0]=3 154 B14R1.166 COCCC(=O)N(C)c1ccccc1 AIFCHEM-94545186435 [0,1,0,0,0,1|2,0,0]=4 155 B14R1.166 CSCCC(=O)N(C)c1ccccc1 AIFCHEM-94545189377 [0,1,0,0,0,1|2,0,0]=4 156 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 AIFCHEM-94552045876 [0,1,0,0,0,1|1,0,0]=3 157 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 AIFCHEM-94576235871 [0,1,0,0,0,1|2,0,0]=4 158 B14R1.946 CCC#CC(=O)Nc1ccccc1Br AIFCHEM-94569947622 [0,1,0,0,0,1|1,0,1]=4 159 B14R1.946 CCCCC(=O)Nc1ccccc1O AIFCHEM-94534110253 [0,1,0,0,0,1|1,0,0]=3 160 B14R1.946 CCCCC(=O)Nc1ccncc1C AIFCHEM-94534104968 [0,1,0,0,0,1|2,0,0]=4 161 B14R1.946 CCCCC(=O)Nc1ccncc1I AIFCHEM-94534111987 [0,1,0,0,0,1|2,0,0]=4 162 B14R1.946 CCCCC(=O)Nc1cnccc1C AIFCHEM-94534107122 [0,1,0,0,0,1|2,0,0]=4 163 B14R1.946 CCCCC(=O)Nc1cnccc1I AIFCHEM-94534100072 [0,1,0,0,0,1|2,0,0]=4 164 B14R1.946 CCCNC(=O)Cc1ccccc1Br AIFCHEM-94521375596 [0,1,0,0,0,1|1,0,0]=3 165 B14R1.946 CCCNC(=O)Cc1ccccc1I AIFCHEM-94521375595 [0,1,0,0,0,1|1,0,0]=3 166 B14R1.946 CCCNC(=O)Cn1ccccc1=O AIFCHEM-5815202370 [0,1,0,0,0,1|2,0,0]=4 167 B14R1.946 CCSCC(=O)Nc1ccccc1O AIFCHEM-94525234348 [0,1,0,0,0,1|2,0,0]=4 168 B14R1.946 COCCC(=O)Nc1ccccc1C AIFCHEM-94578152843 [0,1,0,0,0,1|2,0,0]=4 169 B14R1.946 CSCCC(=O)Nc1ccccc1C AIFCHEM-5920745122 [0,1,0,0,0,1|2,0,0]=4 170 B14R1.946 O=C(Cc1ccccc1O)NCCF AIFCHEM-5802585226 [0,1,0,0,0,1|2,0,0]=4 171 B14R1.11 C[C@H](CF)NC(=O)c1cccc(c1)F AIFCHEM-6169254488 [0,2,0,0,0,0|2,0,0]=4 172 B14R1.29 CCCC(C)NC(=O)c1cccnc1 AIFCHEM-94560483380 [0,2,0,0,0,0|2,0,0]=4 173 B14R1.29 CCC[C@H](C)NC(=O)c1cccnc1 AIFCHEM-5613853602 [0,2,0,0,0,0|2,0,0]=4 174 B14R1.29 COCC(C)NC(=O)c1ccccc1 AIFCHEM-94565580637 [0,2,0,0,0,0|1,0,0]=3 175 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 AIFCHEM-94565582913 [0,2,0,0,0,0|1,0,0]=3 176 B14R1.29 COC[C@H](C)NC(=O)c1ccccc1 AIFCHEM-94572809482 [0,2,0,0,0,0|1,0,0]=3 177 B14R1.29 C[C@@H](CC#N)NC(=O)c1ccccc1 AIFCHEM-94565573335 [0,2,0,0,0,0|1,0,1]=4 178 B14R1.29 C[C@H](CC#N)NC(=O)c1ccccc1 AIFCHEM-94565573336 [0,2,0,0,0,0|1,0,1]=4 179 B14R1.58 CCC(CC)NC(=O)c1ccncc1 AIFCHEM-5744926580 [0,2,0,0,0,0|2,0,0]=4 180 B14R1.85 CCC(C)N(C)C(=O)c1ccccc1 AIFCHEM-94565584187 [0,2,0,0,0,0|1,0,0]=3 181 B14R1.290 CCC(C)(C)NC(=O)c1ccccn1 AIFCHEM-5670842212 [0,2,0,0,0,0|2,0,0]=4 182 B14R1.290 CCC(C)(C)NC(=O)c1ccncc1 AIFCHEM-5658225119 [0,2,0,0,0,0|2,0,0]=4 183 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Cl AIFCHEM-94519624766 [0,2,0,0,0,0|1,0,1]=4 184 B14R1.19 COCCNC(=O)c1ccc(cn1)C AIFCHEM-6017302579 [0,2,0,0,0,0|2,0,0]=4 185 B14R1.19 CSCCNC(=O)c1ccc(cn1)Br AIFCHEM-5865443990 [0,2,0,0,0,0|2,0,0]=4 186 B14R1.19 CSCCNC(=O)c1ccc(cn1)Cl AIFCHEM-94598933759 [0,2,0,0,0,0|2,0,0]=4 187 B14R1.19 CSCCNC(=O)c1ccc(cn1)F AIFCHEM-5849242518 [0,2,0,0,0,0|2,0,0]=4 188 B14R1.19 CSCCNC(=O)c1ccc(cn1)I AIFCHEM-5874926831 [0,2,0,0,0,0|2,0,0]=4 189 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Cl AIFCHEM-94519625315 [0,2,0,0,0,0|1,0,1]=4 190 B14R1.19 N#CCCNC(=O)c1ccc(cc1)O AIFCHEM-5693871207 [0,2,0,0,0,0|1,0,1]=4 191 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)C AIFCHEM-5860406419 [0,2,0,0,0,0|1,0,0]=3 192 B14R1.35 CCCN(C)C(=O)c1ccc(cn1)Cl AIFCHEM-5801858438 [0,2,0,0,0,0|2,0,0]=4 193 B14R1.678 CC(C)CNC(=O)c1ccc(cn1)Br AIFCHEM-94563730347 [0,2,0,0,0,0|2,0,0]=4 194 B14R1.678 CC(C)CNC(=O)c1ccc(cn1)Cl AIFCHEM-94563733981 [0,2,0,0,0,0|2,0,0]=4 195 B14R1.678 CC(C)CNC(=O)c1ccc(cn1)I AIFCHEM-6179479297 [0,2,0,0,0,0|2,0,0]=4 196 B14R1.678 Cc1ccc(nc1)C(=O)NCC(C)C AIFCHEM-94527139816 [0,2,0,0,0,0|2,0,0]=4 197 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F AIFCHEM-5988249969 [0,2,0,0,0,0|2,0,0]=4 198 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCC AIFCHEM-94521372688 [0,2,0,0,0,0|1,0,0]=3 199 B14R1.926 C#Cc1ccc(nc1)C(=O)NCCC AIFCHEM-94521375392 [0,2,0,0,0,0|2,0,0]=4 200 B14R1.926 CCCNC(=O)c1ccc(cc1)CO AIFCHEM-94521377298 [0,2,0,0,0,0|1,0,0]=3 201 B14R1.926 CCCNC(=O)c1ccc(cc1)OC AIFCHEM-5853736664 [0,2,0,0,0,0|1,0,0]=3 202 B14R1.926 CCCNC(=O)c1ccc(cn1)OC AIFCHEM-94521377240 [0,2,0,0,0,0|2,0,0]=4 203 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C AIFCHEM-5793265419 [0,2,0,0,0,0|1,0,0]=3 204 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F AIFCHEM-5815297881 [0,2,0,0,0,0|1,0,0]=3 205 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl AIFCHEM-94521380483 [0,2,0,0,0,0|1,0,0]=3 206 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I AIFCHEM-94521378889 [0,2,0,0,0,0|1,0,0]=3 207 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I AIFCHEM-5853715157 [0,2,0,0,0,0|1,0,0]=3 208 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br AIFCHEM-5853885288 [0,2,0,0,0,0|1,0,0]=3 209 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I AIFCHEM-94521377787 [0,2,0,0,0,0|1,0,0]=3 210 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F AIFCHEM-94521378828 [0,2,0,0,0,0|1,0,0]=3 211 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)O AIFCHEM-5791986216 [0,2,0,0,0,0|1,0,0]=3 212 B14R1.941 CCCNC(=O)c1ccc(c(n1)C)O AIFCHEM-94521373397 [0,2,0,0,0,0|2,0,0]=4 213 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Br AIFCHEM-5827842699 [0,2,0,0,0,0|2,0,0]=4 214 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)O AIFCHEM-5871486381 [0,2,0,0,0,0|2,0,0]=4 215 B14R1.2523 CCCNC(=O)c1c[nH]c(=O)cc1O AIFCHEM-5875633323 [0,2,0,0,0,0|2,0,0]=4 216 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O AIFCHEM-94521379323 [0,2,0,0,0,0|1,0,0]=3 217 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C AIFCHEM-94521375511 [0,2,0,0,0,0|1,0,0]=3 218 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br AIFCHEM-94521375090 [0,2,0,0,0,0|1,0,0]=3 219 B14R1.2523 CCCNC(=O)c1ccc(nc1C)C AIFCHEM-94521379386 [0,2,0,0,0,0|2,0,0]=4 220 B14R1.2523 CCCNC(=O)c1ncc(cc1C)Cl AIFCHEM-94521381197 [0,2,0,0,0,0|2,0,0]=4 221 B14R1.2523 CCCNC(=O)c1ncc(cc1C)F AIFCHEM-5815260013 [0,2,0,0,0,0|2,0,0]=4 222 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF AIFCHEM-5801266986 [0,2,0,0,0,0|2,0,0]=4 223 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br AIFCHEM-5854048700 [0,2,0,0,0,0|2,0,0]=4 224 B14R1.2523 O=C(NCCF)c1ccc(cc1O)O AIFCHEM-5828122582 [0,2,0,0,0,0|2,0,0]=4 225 B14R1.16 CCCNC(=O)c1cccc(c1Br)C AIFCHEM-94521379017 [0,2,0,0,0,0|1,0,0]=3 226 B14R1.16 CCCNC(=O)c1cccc(c1Br)F AIFCHEM-94521373988 [0,2,0,0,0,0|1,0,0]=3 227 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C AIFCHEM-94521374705 [0,2,0,0,0,0|1,0,0]=3 228 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl AIFCHEM-5853520309 [0,2,0,0,0,0|1,0,0]=3 229 B14R1.16 CCCNC(=O)c1cccc(c1I)O AIFCHEM-94528820316 [0,2,0,0,0,0|1,0,0]=3 230 B14R1.16 CCCNC(=O)c1cccc(c1O)C AIFCHEM-5853629428 [0,2,0,0,0,0|1,0,0]=3 231 B14R1.16 CCCNC(=O)c1cccc(c1O)O AIFCHEM-5793192088 [0,2,0,0,0,0|1,0,0]=3 232 B14R1.16 Cc1cccc(c1O)C(=O)NCCF AIFCHEM-5871368243 [0,2,0,0,0,0|2,0,0]=4 233 B14R1.16 O=C(NCCF)c1cccc(c1Br)I AIFCHEM-5862238030 [0,2,0,0,0,0|2,0,0]=4 234 B14R1.16 O=C(NCCF)c1cccc(c1O)Br AIFCHEM-5854399575 [0,2,0,0,0,0|2,0,0]=4 235 B14R1.16 O=C(NCCF)c1cccc(c1O)Cl AIFCHEM-5827598497 [0,2,0,0,0,0|2,0,0]=4 236 B14R1.16 O=C(NCCF)c1cccc(c1O)O AIFCHEM-5827852635 [0,2,0,0,0,0|2,0,0]=4 237 B14R1.20 C#CCCNC(=O)c1cccc(c1)F AIFCHEM-6069807606 [0,2,0,0,0,0|1,0,1]=4 238 B14R1.20 CCCCNC(=O)c1cc(=O)cco1 AIFCHEM-5736708211 [0,2,0,0,0,0|2,0,0]=4 239 B14R1.20 COCCNC(=O)c1cc(ccn1)C AIFCHEM-6017093595 [0,2,0,0,0,0|2,0,0]=4 240 B14R1.20 COCCNC(=O)c1cccc(c1)F AIFCHEM-6016841419 [0,2,0,0,0,0|1,0,0]=3 241 B14R1.20 CSCCNC(=O)c1cccc(c1)I AIFCHEM-5882461375 [0,2,0,0,0,0|1,0,0]=3 242 B14R1.20 CSCCNC(=O)c1cccc(c1)O AIFCHEM-94598934653 [0,2,0,0,0,0|1,0,0]=3 243 B14R1.20 CSCCNC(=O)c1ccnc(c1)C AIFCHEM-94598930903 [0,2,0,0,0,0|2,0,0]=4 244 B14R1.20 CSCCNC(=O)c1cncc(c1)C AIFCHEM-5875107086 [0,2,0,0,0,0|2,0,0]=4 245 B14R1.20 CSCCNC(=O)c1cncc(c1)I AIFCHEM-5874958933 [0,2,0,0,0,0|2,0,0]=4 246 B14R1.36 CCCN(C)C(=O)c1cc(ccn1)C AIFCHEM-5879130571 [0,2,0,0,0,0|2,0,0]=4 247 B14R1.36 CCCN(C)C(=O)c1ccnc(c1)C AIFCHEM-5825301396 [0,2,0,0,0,0|2,0,0]=4 248 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Br AIFCHEM-6018690092 [0,2,0,0,0,0|1,0,1]=4 249 B14R1.149 O=C(NCC(F)F)c1cccc(c1)F AIFCHEM-6068405908 [0,2,0,0,0,0|2,0,0]=4 250 B14R1.149 O=C(NCC(F)F)c1cccc(c1)O AIFCHEM-6014130054 [0,2,0,0,0,0|2,0,0]=4 251 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C AIFCHEM-94521380088 [0,2,0,0,0,0|1,0,0]=3 252 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br AIFCHEM-5791456397 [0,2,0,0,0,0|1,0,0]=3 253 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F AIFCHEM-94521376496 [0,2,0,0,0,0|1,0,0]=3 254 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br AIFCHEM-94521374572 [0,2,0,0,0,0|1,0,0]=3 255 B14R1.918 CCCNC(=O)c1cc(ccc1I)F AIFCHEM-5815001664 [0,2,0,0,0,0|1,0,0]=3 256 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br AIFCHEM-94521381279 [0,2,0,0,0,0|1,0,0]=3 257 B14R1.918 CCCNC(=O)c1cc(ccc1O)F AIFCHEM-5853698195 [0,2,0,0,0,0|1,0,0]=3 258 B14R1.918 CCCNC(=O)c1cc(ccc1O)I AIFCHEM-94590837858 [0,2,0,0,0,0|1,0,0]=3 259 B14R1.918 CCCNC(=O)c1nc(ccc1Cl)O AIFCHEM-94521373756 [0,2,0,0,0,0|2,0,0]=4 260 B14R1.918 O=C(NCCF)c1cc(ccc1Br)Cl AIFCHEM-5828020702 [0,2,0,0,0,0|2,0,0]=4 261 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br AIFCHEM-5871222455 [0,2,0,0,0,0|2,0,0]=4 262 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)C AIFCHEM-94521379374 [0,2,0,0,0,0|1,0,0]=3 263 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)F AIFCHEM-94521375334 [0,2,0,0,0,0|1,0,0]=3 264 B14R1.923 CCCNC(=O)c1cc(cc(c1)C)C AIFCHEM-5815394215 [0,2,0,0,0,0|1,0,0]=3 265 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)F AIFCHEM-94521376791 [0,2,0,0,0,0|1,0,0]=3 266 B14R1.923 CCCNC(=O)c1cc(cc(c1)O)O AIFCHEM-5815331035 [0,2,0,0,0,0|1,0,0]=3 267 B14R1.923 O=C(NCCF)c1cc(cc(c1)Br)O AIFCHEM-5800549066 [0,2,0,0,0,0|2,0,0]=4 268 B14R1.923 O=C(NCCF)c1cc(cc(c1)F)O AIFCHEM-5828008361 [0,2,0,0,0,0|2,0,0]=4 269 B14R1.934 CCCNC(=O)c1cccc(n1)OC AIFCHEM-5791549606 [0,2,0,0,0,0|2,0,0]=4 270 B14R1.934 CCCNC(=O)c1ccnc(c1)OC AIFCHEM-5875557770 [0,2,0,0,0,0|2,0,0]=4 271 B14R1.934 O=C(NCCF)c1cccc(c1)CO AIFCHEM-5827644382 [0,2,0,0,0,0|2,0,0]=4 272 B14R1.38 C#CCCCNC(=O)c1cccnc1 AIFCHEM-5687883554 [0,2,0,0,0,0|2,0,0]=4 273 B14R1.38 C#CCCCNC(=O)c1ccncc1 AIFCHEM-94570160954 [0,2,0,0,0,0|2,0,0]=4 274 B14R1.38 CCCCCNC(=O)c1ccccn1 AIFCHEM-94578913901 [0,2,0,0,0,0|2,0,0]=4 275 B14R1.38 CCSCCNC(=O)c1ccncc1 AIFCHEM-94566127503 [0,2,0,0,0,0|2,0,0]=4 276 B14R1.38 COCCCNC(=O)c1ccccc1 AIFCHEM-94565577789 [0,2,0,0,0,0|1,0,0]=3 277 B14R1.163 CC(C#N)CNC(=O)c1ccccc1 AIFCHEM-94565586155 [0,2,0,0,0,0|1,0,0]=3 278 B14R1.163 CCC(=O)CNC(=O)c1ccncc1 AIFCHEM-6179984363 [0,2,0,0,0,0|2,0,0]=4 279 B14R1.163 CCC(F)CNC(=O)c1cccnc1 AIFCHEM-5859474210 [0,2,0,0,0,0|2,0,0]=4 280 B14R1.163 CCC(F)CNC(=O)c1ccncc1 AIFCHEM-5879444328 [0,2,0,0,0,0|2,0,0]=4 281 B14R1.163 COC(C)CNC(=O)c1ccccc1 AIFCHEM-94565583674 [0,2,0,0,0,0|1,0,0]=3 282 B14R1.163 CO[C@@H](C)CNC(=O)c1ccccc1 AIFCHEM-94565585501 [0,2,0,0,0,0|1,0,0]=3 283 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 AIFCHEM-94608849716 [0,2,0,0,0,0|1,0,0]=3 284 B14R1.420 CC(C)CCNC(=O)c1ccncc1 AIFCHEM-6135956601 [0,2,0,0,0,0|2,0,0]=4 285 B14R1.420 CN(C)CCNC(=O)c1cccnc1 AIFCHEM-94537685640 [0,2,0,0,0,0|2,0,0]=4 286 B14R1.420 O=C(NCCC(F)F)c1ccccc1 AIFCHEM-94565572792 [0,2,0,0,0,0|1,0,0]=3 287 B14R1.1035 C#CCCNC(=O)c1ccccc1F AIFCHEM-94541768836 [0,2,0,0,0,0|1,0,1]=4 288 B14R1.1035 C#CCCNC(=O)c1ccccc1O AIFCHEM-94541770512 [0,2,0,0,0,0|1,0,1]=4 289 B14R1.1035 CCCCNC(=O)c1c[nH]ccc1=O AIFCHEM-5751890371 [0,2,0,0,0,0|2,0,0]=4 290 B14R1.1035 CCCCNC(=O)c1ccncc1I AIFCHEM-5745628126 [0,2,0,0,0,0|2,0,0]=4 291 B14R1.1035 COCCNC(=O)c1ccccc1F AIFCHEM-6058547246 [0,2,0,0,0,0|1,0,0]=3 292 B14R1.1035 COCCNC(=O)c1ccncc1F AIFCHEM-6058283706 [0,2,0,0,0,0|2,0,0]=4 293 B14R1.1035 COCCNC(=O)c1ncccc1I AIFCHEM-5990722011 [0,2,0,0,0,0|2,0,0]=4 294 B14R1.1035 CSCCNC(=O)c1ccccc1Cl AIFCHEM-94562157817 [0,2,0,0,0,0|1,0,0]=3 295 B14R1.1035 CSCCNC(=O)c1ccccc1O AIFCHEM-5874815850 [0,2,0,0,0,0|1,0,0]=3 296 B14R1.1035 CSCCNC(=O)c1ccncc1C AIFCHEM-5875101686 [0,2,0,0,0,0|2,0,0]=4 297 B14R1.1035 CSCCNC(=O)c1ccncc1Cl AIFCHEM-94598934038 [0,2,0,0,0,0|2,0,0]=4 298 B14R1.1035 CSCCNC(=O)c1ccncc1F AIFCHEM-5848969008 [0,2,0,0,0,0|2,0,0]=4 299 B14R1.1035 CSCCNC(=O)c1ccncc1I AIFCHEM-5814252376 [0,2,0,0,0,0|2,0,0]=4 300 B14R1.160 CC(C)CNC(=O)c1c[nH]ccc1=O AIFCHEM-94563732532 [0,2,0,0,0,0|2,0,0]=4 301 B14R1.160 CC(C)CNC(=O)c1ccc[nH]c1=O AIFCHEM-6162856171 [0,2,0,0,0,0|2,0,0]=4 302 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl AIFCHEM-94562158514 [0,2,0,0,0,0|1,0,0]=3 303 B14R1.160 CC(C)CNC(=O)c1ccccc1I AIFCHEM-94563734091 [0,2,0,0,0,0|1,0,0]=3 304 B14R1.160 CC(C)CNC(=O)c1ccncc1I AIFCHEM-94563732317 [0,2,0,0,0,0|2,0,0]=4 305 B14R1.160 Cc1cccnc1C(=O)NCC(C)C AIFCHEM-94563726548 [0,2,0,0,0,0|2,0,0]=4 306 B14R1.160 Cc1ncccc1C(=O)NCC(C)C AIFCHEM-94563730459 [0,2,0,0,0,0|2,0,0]=4 307 B14R1.160 O=C(NCC(F)F)c1ccccc1Br AIFCHEM-6015584554 [0,2,0,0,0,0|2,0,0]=4 308 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl AIFCHEM-94562158609 [0,2,0,0,0,0|2,0,0]=4 309 B14R1.160 O=C(NCC(F)F)c1ccccc1O AIFCHEM-6068006167 [0,2,0,0,0,0|2,0,0]=4 310 B14R1.417 CC(C)CN(C)C(=O)c1ccccn1 AIFCHEM-94578923325 [0,2,0,0,0,0|2,0,0]=4 311 B14R1.3098 CC(C)(C)CNC(=O)c1cccnc1 AIFCHEM-5909607595 [0,2,0,0,0,0|2,0,0]=4 312 B14R1.478 CCCN(CC)C(=O)c1ccccc1 AIFCHEM-96568113109 [0,2,0,0,0,0|1,0,0]=3 313 B14R1.478 CCCN(CC)C(=O)c1ccccn1 AIFCHEM-100053701098 [0,2,0,0,0,0|2,0,0]=4 314 B14R1.478 CCCN(CC)C(=O)c1cccnc1 AIFCHEM-96136159651 [0,2,0,0,0,0|2,0,0]=4 315 B14R1.478 CCCN(CC)C(=O)c1ccncc1 AIFCHEM-99478051127 [0,2,0,0,0,0|2,0,0]=4 316 B14R1.478 CCN(CCF)C(=O)c1ccccc1 AIFCHEM-96568147065 [0,2,0,0,0,0|2,0,0]=4 317 B14R1.3348 CCCN(C)C(=O)c1ccccc1F AIFCHEM-5879101511 [0,2,0,0,0,0|1,0,0]=3 318 B14R1.939 CCCNC(=O)c1ccccc1CC AIFCHEM-94521379560 [0,2,0,0,0,0|1,0,0]=3 319 B14R1.939 CCCNC(=O)c1ccccc1OC AIFCHEM-94521379330 [0,2,0,0,0,0|1,0,0]=3 320 B14R1.939 CCCNC(=O)c1cccnc1OC AIFCHEM-94521375063 [0,2,0,0,0,0|2,0,0]=4 321 B14R1.939 CCCNC(=O)c1cnccc1OC AIFCHEM-5791290557 [0,2,0,0,0,0|2,0,0]=4 322 B14R1.939 CCCNC(=O)c1ncccc1OC AIFCHEM-94521375061 [0,2,0,0,0,0|2,0,0]=4 323 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F AIFCHEM-5791424052 [0,2,0,0,0,0|1,0,0]=3 324 B14R1.8282 CCCNC(=O)c1c(cccc1F)O AIFCHEM-5793156433 [0,2,0,0,0,0|1,0,0]=3 325 B14R1.8282 CCCNC(=O)c1c(cccc1I)C AIFCHEM-5791463470 [0,2,0,0,0,0|1,0,0]=3 326 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl AIFCHEM-5853589194 [0,2,0,0,0,0|1,0,0]=3 327 B14R1.8282 CCCNC(=O)c1c(cccc1I)F AIFCHEM-5793334330 [0,2,0,0,0,0|1,0,0]=3 328 B14R1.8282 O=C(NCCF)c1c(cccc1Br)F AIFCHEM-5871306067 [0,2,0,0,0,0|2,0,0]=4 329 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)O AIFCHEM-5871278204 [0,2,0,0,0,0|2,0,0]=4 330 B12R2.2 C1=C(CCC1)c2ccccc2 AIFCHEM-94590916958 [1,0,0,1,0,0|1,0,0]=3 331 B12R2.2 C1=C(COC1)c2ccccc2 AIFCHEM-6345845864 [1,0,0,1,0,0|2,0,0]=4 332 B12R2.2058 C(=C1CCC1)c2ccccc2 AIFCHEM-6322825111 [1,0,0,1,0,0|1,0,0]=3 333 B12R2.2058 C(=C1CCC1)c2ccccn2 AIFCHEM-6358671053 [1,0,0,1,0,0|2,0,0]=4 334 B12R2.2058 C(=C1CCC1)c2cccnc2 AIFCHEM-6427719025 [1,0,0,1,0,0|2,0,0]=4 335 B12R2.2074 O=C(NC1CC1)c2cccs2 AIFCHEM-94573325558 [0,0,0,1,1,0|2,0,0]=4 336 B12R2.2074 O=C(NC1CC1)c2ccsc2 AIFCHEM-94573327724 [0,0,0,1,1,0|2,0,0]=4 337 B12R2.3797 O=C(c1ccco1)N2CCC2 AIFCHEM-6079219701 [0,0,0,1,1,0|2,0,0]=4 338 B14R2.343 CC1CC1C(=O)Nc2ccccc2 AIFCHEM-94577033582 [0,0,0,1,0,1|1,0,0]=3 339 B14R2.343 C[C@@H]1C[C@H]1C(=O)Nc2ccccc2 AIFCHEM-94552045696 [0,0,0,1,0,1|1,0,0]=3 340 B14R2.343 C[C@H]1C[C@@H]1C(=O)Nc2ccccc2 AIFCHEM-94577030883 [0,0,0,1,0,1|1,0,0]=3 341 B14R2.9589 O=C(Cc1cccnc1)N2CCC2 AIFCHEM-6079217797 [0,0,0,1,0,1|2,0,0]=4 342 B14R2.9589 O=C(Nc1ccccn1)C2CCC2 AIFCHEM-94572521741 [0,0,0,1,0,1|2,0,0]=4 343 B14R2.21 Nc1ccnc(c1)C2=CCCCO2 AIFCHEM-6417471307 [0,1,0,1,0,0|2,0,0]=4 344 B14R2.21 O=c1cc(cc[nH]1)C2=CCCCO2 AIFCHEM-6429569755 [0,1,0,1,0,0|2,0,0]=4 345 B14R2.335 CC1CCN1C(=O)c2ccncc2 AIFCHEM-6088086629 [0,1,0,1,0,0|2,0,0]=4 346 B14R2.335 C[C@@H]1CCN1C(=O)c2ccncc2 AIFCHEM-6235381704 [0,1,0,1,0,0|2,0,0]=4 347 B14R2.335 C[C@H]1CCN1C(=O)c2ccncc2 AIFCHEM-5742281938 [0,1,0,1,0,0|2,0,0]=4 348 B14R2.352 C[C@@H]1C[C@H]1NC(=O)c2ccccn2 AIFCHEM-94578926625 [0,1,0,1,0,0|2,0,0]=4 349 B14R2.352 C[C@@H]1C[C@H]1NC(=O)c2cccnc2 AIFCHEM-94559019052 [0,1,0,1,0,0|2,0,0]=4 350 B14R2.352 O=C(NC1CC1F)c2ccccc2 AIFCHEM-94597371394 [0,1,0,1,0,0|1,0,0]=3 351 B14R2.352 O=C(NC1CC1F)c2cccnc2 AIFCHEM-5857118456 [0,1,0,1,0,0|2,0,0]=4 352 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 AIFCHEM-94565576051 [0,1,0,1,0,0|1,0,0]=3 353 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2cccnc2 AIFCHEM-6081743258 [0,1,0,1,0,0|2,0,0]=4 354 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 AIFCHEM-94565573687 [0,1,0,1,0,0|1,0,0]=3 355 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2cccnc2 AIFCHEM-5831256291 [0,1,0,1,0,0|2,0,0]=4 356 B14R2.352 O=C(N[C@H]1C[C@@H]1F)c2ccccc2 AIFCHEM-94565577041 [0,1,0,1,0,0|1,0,0]=3 357 B14R2.352 O=C(N[C@H]1C[C@@H]1F)c2cccnc2 AIFCHEM-94589293088 [0,1,0,1,0,0|2,0,0]=4 358 B14R2.352 O=C(N[C@H]1C[C@H]1F)c2ccccc2 AIFCHEM-94565576050 [0,1,0,1,0,0|1,0,0]=3 359 B14R2.794 O=C(NC1CCC1)c2ccccn2 AIFCHEM-5771362576 [0,1,0,1,0,0|2,0,0]=4 360 B14R2.794 O=C(NC1CSC1)c2cccnc2 AIFCHEM-5898121410 [0,1,0,1,0,0|2,0,0]=4 361 B14R2.9595 CC1(CC1)NC(=O)c2cccnc2 AIFCHEM-6154507485 [0,1,0,1,0,0|2,0,0]=4 362 B14R2.9595 CC1(CC1)NC(=O)c2ccncc2 AIFCHEM-6136714922 [0,1,0,1,0,0|2,0,0]=4 363 B14R2.68 Cc1ccc(cn1)C2=CCCCO2 AIFCHEM-6317721920 [0,1,0,1,0,0|2,0,0]=4 364 B14R2.68 NC1CC=C(CC1)c2ccccc2 AIFCHEM-94590916880 [0,1,0,1,0,0|2,0,0]=4 365 B14R2.68 Nc1ccc(cc1)C2=CCCCC2 AIFCHEM-94608717822 [0,1,0,1,0,0|2,0,0]=4 366 B14R2.68 Oc1ccc(nc1)C2=CCCCO2 AIFCHEM-6395019235 [0,1,0,1,0,0|2,0,0]=4 367 B14R2.933 Cc1ccc(cc1)C(=O)NC2CC2 AIFCHEM-94573328521 [0,1,0,1,0,0|1,0,0]=3 368 B14R2.933 Cc1ccc(nc1)C(=O)NC2CC2 AIFCHEM-6109400545 [0,1,0,1,0,0|2,0,0]=4 369 B14R2.933 O=C(NC1CC1)c2ccc(cn2)F AIFCHEM-6109130939 [0,1,0,1,0,0|2,0,0]=4 370 B14R2.933 O=C(NC1CC1)c2ccc(cn2)O AIFCHEM-94573319881 [0,1,0,1,0,0|2,0,0]=4 371 B14R2.10606 O=C(c1ccc(cc1)Br)N2CCC2 AIFCHEM-94604932244 [0,1,0,1,0,0|1,0,0]=3 372 B14R2.10606 O=C(c1ccc(cc1)O)N2CCC2 AIFCHEM-6042584229 [0,1,0,1,0,0|1,0,0]=3 373 B14R2.10606 O=C(c1ccc(cn1)Cl)N2CCC2 AIFCHEM-5997342969 [0,1,0,1,0,0|2,0,0]=4 374 B14R2.9036 O=C(NC1CC1)c2cc(=O)cco2 AIFCHEM-94573325253 [0,1,0,1,0,0|2,0,0]=4 375 B14R2.9036 O=C(NC1CC1)c2cccc(c2)I AIFCHEM-94573326232 [0,1,0,1,0,0|1,0,0]=3 376 B14R2.29767 O=C(c1cc(ccn1)O)N2CCC2 AIFCHEM-6043326876 [0,1,0,1,0,0|2,0,0]=4 377 B14R2.114 O=C(c1ccncc1)N2CCSC2 AIFCHEM-5625844248 [0,1,0,1,0,0|2,0,0]=4 378 B14R2.422 CC1CN(C1)C(=O)c2ccncc2 AIFCHEM-5908308278 [0,1,0,1,0,0|2,0,0]=4 379 B14R2.4633 O=C(NC1CC1)c2ccncc2I AIFCHEM-6109450763 [0,1,0,1,0,0|2,0,0]=4 380 B14R2.4633 O=C(NC1CC1)c2ccncc2O AIFCHEM-94573319046 [0,1,0,1,0,0|2,0,0]=4 381 B14R2.4633 O=C(NC1CC1)c2ncccc2F AIFCHEM-94573321372 [0,1,0,1,0,0|2,0,0]=4 382 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 AIFCHEM-94604926020 [0,1,0,1,0,0|1,0,0]=3 383 B14R2.21545 O=C(c1ccc[nH]c1=O)N2CCC2 AIFCHEM-94604932401 [0,1,0,1,0,0|2,0,0]=4 384 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 AIFCHEM-6079326266 [0,1,0,1,0,0|1,0,0]=3 385 B14R2.21545 O=C(c1ccccc1F)N2CCC2 AIFCHEM-6083808217 [0,1,0,1,0,0|1,0,0]=3 386 B14R2.21545 O=C(c1ccncc1Cl)N2CCC2 AIFCHEM-6017578837 [0,1,0,1,0,0|2,0,0]=4 387 B14R2.21545 O=C(c1ccncc1F)N2CCC2 AIFCHEM-6079161402 [0,1,0,1,0,0|2,0,0]=4 388 B14R2.21545 O=C(c1ncccc1I)N2CCC2 AIFCHEM-94604933180 [0,1,0,1,0,0|2,0,0]=4 389 B10R1.21 CCCC=Cc1cccs1 AIFCHEM-94564040480 [1,0,0,0,1,0|2,0,0]=4 390 B14R1.156 CCCNC(=O)COc1ccccn1 AIFCHEM-5815026704 [0,0,0,0,0,2|2,0,0]=4 391 B14R1.156 CCCNC(=O)CSc1ccccc1 AIFCHEM-94521372545 [0,0,0,0,0,2|1,0,0]=3