0 B21R3.7428576 Cc1cccc(c1)c2cccc3c2cc(o3)C(=O)O AIFCHEM-6316720688 [0,0,0,0,0,0|3,1,0]=4 1 B21R3.7428576 Cc1cccc(c1)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6402740113 [0,0,0,0,0,0|3,0,0]=3 2 B21R3.7428576 Cc1cncc(c1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6335689080 [0,0,0,0,0,0|3,0,0]=3 3 B21R3.7428576 Nc1cncc(c1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6311838883 [0,0,0,0,0,0|3,0,0]=3 4 B21R3.7428576 O=C(O)c1cc2c(cccc2s1)c3cccc(c3)F AIFCHEM-6483039321 [0,0,0,0,0,0|2,0,0]=2 5 B21R3.7428576 O=C(O)c1cc2c(cncc2s1)c3cncc(c3)F AIFCHEM-6368255485 [0,0,0,0,0,0|2,0,0]=2 6 B20R3.15874 O=C(O)c1cc2c(cncc2s1)c3ccncc3 AIFCHEM-94530052397 [1,0,0,0,0,0|2,0,0]=3 7 B20R3.15874 O=C(O)c1cc2c(cncc2s1)c3cncnc3 AIFCHEM-6311922656 [1,0,0,0,0,0|3,0,0]=4 8 B20R3.24900 OCc1cc2c(cncc2s1)c3cccc(c3)F AIFCHEM-6446956773 [1,0,0,0,0,0|0,0,2]=3 9 B20R3.24900 OCc1cc2c(cncc2s1)c3cncc(c3)F AIFCHEM-6446780535 [1,0,0,0,0,0|1,0,2]=4 10 B22R3.1056704 COC(=O)c1cc2c(cccc2s1)c3cncc(c3)F AIFCHEM-6410277150 [0,1,0,0,0,0|3,0,0]=4 11 B22R3.1056704 COC(=O)c1cc2c(cncc2s1)c3cc[nH]c(=O)c3 AIFCHEM-6419050485 [0,1,0,0,0,0|3,0,0]=4 12 B22R3.1056704 COC(=O)c1cc2c(cncc2s1)c3cccc(c3)C AIFCHEM-6469710994 [0,1,0,0,0,0|2,0,0]=3 13 B22R3.1056704 COC(=O)c1cc2c(cncc2s1)c3cccc(c3)O AIFCHEM-6386950823 [0,1,0,0,0,0|2,0,0]=3 14 B22R3.5268270 Cc1cc(cc(c1)c2cccc3c2cc(s3)C(=O)O)F AIFCHEM-6402424651 [0,1,0,0,0,0|2,0,0]=3 15 B22R3.5268270 Cc1cc(cc(c1)c2cncc3c2cc(s3)C(=O)O)F AIFCHEM-6296516459 [0,1,0,0,0,0|1,0,0]=2 16 B22R3.5268270 O=C(O)c1cc2c(cccc2s1)c3cc(cc(c3)F)O AIFCHEM-6470069795 [0,1,0,0,0,0|2,0,0]=3 17 B22R3.5268270 O=C(O)c1cc2c(cncc2s1)c3cc(cc(c3)F)F AIFCHEM-6296405686 [0,1,0,0,0,0|1,0,0]=2 18 B22R3.5463932 Cc1c(cccc1c2cccc3c2cc(o3)C(=O)O)F AIFCHEM-6301849763 [0,1,0,0,0,0|2,1,0]=4 19 B22R3.5463932 Cc1cccc(c1C)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6388067838 [0,1,0,0,0,0|3,0,0]=4 20 B22R3.5463932 Cc1cccc(c1C)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6368025700 [0,1,0,0,0,0|2,0,0]=3 21 B22R3.5463932 Cc1cccc(c1F)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6402464494 [0,1,0,0,0,0|3,0,0]=4 22 B22R3.5463932 Cc1cccc(c1O)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6319368073 [0,1,0,0,0,0|2,0,0]=3 23 B22R3.5463932 Nc1c(cccc1c2cccc3c2cc(o3)C(=O)O)F AIFCHEM-94536178173 [0,1,0,0,0,0|2,1,0]=4 24 B22R3.5463932 Nc1cccc(c1F)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6388046485 [0,1,0,0,0,0|3,0,0]=4 25 B22R3.5463932 O=C(O)c1cc2c(cccc2s1)c3cccc(c3F)F AIFCHEM-6402504420 [0,1,0,0,0,0|2,0,0]=3 26 B22R3.5463932 O=C(O)c1cc2c(cncc2s1)c3cccc(c3F)O AIFCHEM-6335792589 [0,1,0,0,0,0|2,0,0]=3 27 B22R3.11654031 Cc1ccc(c(c1)c2cccc3c2cc(s3)C(=O)O)O AIFCHEM-6470095944 [0,1,0,0,0,0|3,0,0]=4 28 B22R3.11654031 Nc1ccc(c(c1)c2cccc3c2cc(s3)C(=O)O)F AIFCHEM-6483059099 [0,1,0,0,0,0|3,0,0]=4 29 B22R3.11654031 O=C(O)c1cc2c(cccc2s1)c3cc(ccc3O)F AIFCHEM-6388103234 [0,1,0,0,0,0|2,0,0]=3 30 B22R3.11654031 O=C(O)c1cc2c(cncc2s1)c3cc(=O)[nH]cc3F AIFCHEM-6312058559 [0,1,0,0,0,0|3,0,0]=4 31 B22R3.11654031 O=C(O)c1cc2c(cncc2s1)c3cc(ccc3F)O AIFCHEM-6311783865 [0,1,0,0,0,0|2,0,0]=3 32 B22R3.15226290 Cc1cc(ccc1F)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6368200961 [0,1,0,0,0,0|2,0,0]=3 33 B22R3.15226290 Cc1cc(ccc1N)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6483161644 [0,1,0,0,0,0|3,0,0]=4 34 B22R3.15226290 Cc1cc(ccc1O)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6470190136 [0,1,0,0,0,0|3,0,0]=4 35 B22R3.15226290 Cc1ccc(cc1F)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6296511967 [0,1,0,0,0,0|1,0,0]=2 36 B22R3.15226290 Nc1ncc(cc1F)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6402908534 [0,1,0,0,0,0|3,0,0]=4 37 B22R3.15226290 O=C(O)c1cc2c(cccc2s1)c3ccc(c(c3)F)F AIFCHEM-6470092599 [0,1,0,0,0,0|2,0,0]=3 38 B22R3.18896787 COc1cc(ccn1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-94557846984 [0,1,0,0,0,0|3,0,0]=4 39 B20R3.103535 Cc1sccc1c2cncc3c2cc(s3)C(=O)O AIFCHEM-6296478570 [0,0,0,0,1,0|3,0,0]=4 40 B22R3.11523992 CC(=O)Nc1nc2c(cccc2s1)c3cccc(c3)F AIFCHEM-95315250900 [0,0,0,0,0,1|3,0,0]=4 41 B21R3.160599 Nc1ccncc1c2cncc3c2cc(s3)C(=O)O AIFCHEM-6368219241 [1,1,0,0,0,0|2,0,0]=4 42 B21R3.160599 Nc1ncccc1c2cncc3c2cc(s3)C(=O)O AIFCHEM-6368373359 [1,1,0,0,0,0|2,0,0]=4 43 B21R3.650011 Cc1ccc(cn1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-94583766532 [1,1,0,0,0,0|2,0,0]=4 44 B21R3.650011 Nc1ccc(cc1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6296411749 [1,1,0,0,0,0|1,0,0]=3 45 B21R3.650011 O=C(O)c1cc2c(cccc2s1)c3ccc(cc3)F AIFCHEM-6387823223 [1,1,0,0,0,0|2,0,0]=4 46 B21R3.38780 Nc1c(cccc1c2cncc3c2cc(s3)CO)F AIFCHEM-94536188312 [1,1,0,0,0,0|0,0,2]=4 47 B21R3.38780 O=Cc1cc2c(cccc2[nH]1)c3cccc(c3F)F AIFCHEM-6274582916 [1,1,0,0,0,0|2,0,0]=4 48 B21R3.38780 OCc1cc2c(cncc2s1)c3cccc(c3O)F AIFCHEM-6392921116 [1,1,0,0,0,0|0,0,2]=4 49 B21R3.38782 Cc1ccc(cc1F)c2cncc3c2cc(s3)CO AIFCHEM-6446886229 [1,1,0,0,0,0|0,0,2]=4 50 B21R3.38782 Nc1ccc(cc1F)c2cccc3c2cc([nH]3)C=O AIFCHEM-94527661379 [1,1,0,0,0,0|2,0,0]=4 51 B21R3.38782 Nc1ccc(cc1F)c2cncc3c2cc(s3)CO AIFCHEM-94527671526 [1,1,0,0,0,0|0,0,2]=4 52 B21R3.38782 OCc1cc2c(cncc2s1)c3ccc(c(c3)F)O AIFCHEM-6423086047 [1,1,0,0,0,0|0,0,2]=4 53 B21R3.832528 Cc1cc(cc(c1)c2cncc3c2cc(s3)CO)F AIFCHEM-6423158968 [1,1,0,0,0,0|0,0,2]=4 54 B23R3.1089340 CCOC(=O)c1cc2c(cccc2s1)c3cccc(c3)F AIFCHEM-6336540679 [0,2,0,0,0,0|2,0,0]=4 55 B23R3.1089340 CCOC(=O)c1cc2c(cncc2s1)c3cccc(c3)F AIFCHEM-6397446060 [0,2,0,0,0,0|1,0,0]=3 56 B23R3.1378594 COC(=O)c1cc2c(cncc2s1)c3cccc(c3F)F AIFCHEM-6386766201 [0,2,0,0,0,0|1,0,0]=3 57 B23R3.1378594 COC(=O)c1cc2c(cncc2s1)c3cccc(c3N)N AIFCHEM-6386790843 [0,2,0,0,0,0|2,0,0]=4 58 B23R3.1378594 COC(=O)c1cc2c(cncc2s1)c3cccc(c3O)C AIFCHEM-6469709624 [0,2,0,0,0,0|2,0,0]=4 59 B23R3.1378596 COC(=O)c1cc2c(cccc2s1)c3ccc(c(c3)F)O AIFCHEM-6374447732 [0,2,0,0,0,0|2,0,0]=4 60 B23R3.1378596 COC(=O)c1cc2c(cncc2s1)c3ccc(c(c3)C)N AIFCHEM-6428761494 [0,2,0,0,0,0|2,0,0]=4 61 B23R3.1378596 COC(=O)c1cc2c(cncc2s1)c3ccc(c(c3)N)F AIFCHEM-6386762988 [0,2,0,0,0,0|2,0,0]=4 62 B23R3.1378596 COC(=O)c1cc2c(cncc2s1)c3cnc(c(c3)F)N AIFCHEM-6428796911 [0,2,0,0,0,0|2,0,0]=4 63 B23R3.25300010 COC(=O)c1cc2c(cncc2s1)c3cc(ccc3C)C AIFCHEM-6431531292 [0,2,0,0,0,0|2,0,0]=4 64 B23R3.25300010 COC(=O)c1cc2c(cncc2s1)c3cc(ccc3F)C AIFCHEM-6386750727 [0,2,0,0,0,0|2,0,0]=4 65 B23R3.25300978 COC(=O)c1cc2c(cccc2s1)c3cc(cc(c3)F)F AIFCHEM-6395426757 [0,2,0,0,0,0|2,0,0]=4 66 B23R3.25300978 COC(=O)c1cc2c(cncc2s1)c3cc(cc(c3)O)C AIFCHEM-6458620235 [0,2,0,0,0,0|2,0,0]=4 67 B23R3.25300978 COC(=O)c1cc2c(cncc2s1)c3cc(cc(c3)O)O AIFCHEM-6469676687 [0,2,0,0,0,0|2,0,0]=4 68 B23R3.25301001 COC(=O)c1sc2cccc(c2c1N)c3cccc(c3)F AIFCHEM-94552355243 [0,2,0,0,0,0|2,0,0]=4 69 B23R3.37900371 Cc1c(cc(cc1c2cncc3c2cc(s3)C(=O)O)F)N AIFCHEM-6335659584 [0,2,0,0,0,0|1,0,0]=3 70 B23R3.37900371 O=C(O)c1cc2c(cncc2s1)c3cc(cc(c3O)F)F AIFCHEM-6296509491 [0,2,0,0,0,0|1,0,0]=3 71 B23R3.576780981 Nc1c(cc(cc1F)c2cccc3c2cc(s3)C(=O)O)F AIFCHEM-6402560484 [0,2,0,0,0,0|2,0,0]=4 72 B23R3.576780981 O=C(O)c1cc2c(cncc2s1)c3cc(c(c(c3)F)F)O AIFCHEM-6312223837 [0,2,0,0,0,0|1,0,0]=3 73 B23R3.4791021 COc1cccc(c1F)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6295928843 [0,2,0,0,0,0|2,0,0]=4 74 B23R3.4791021 O=Cc1cccc(c1F)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6368068028 [0,2,0,0,0,0|2,0,0]=4 75 B23R3.5540520 O=C(O)c1cc2c(cccc2s1)c3cccc(c3CO)F AIFCHEM-6475466362 [0,2,0,0,0,0|2,0,0]=4 76 B23R3.5540520 O=C(O)c1cc2c(cncc2s1)c3cccc(c3CO)F AIFCHEM-6319038715 [0,2,0,0,0,0|1,0,0]=3 77 B23R3.142679667 Cc1ccc(c(c1F)F)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6470178000 [0,2,0,0,0,0|2,0,0]=4 78 B23R3.142679667 O=C(O)c1cc2c(cccc2s1)c3ccc(c(c3F)F)F AIFCHEM-6483105404 [0,2,0,0,0,0|2,0,0]=4 79 B23R3.142679667 O=C(O)c1cc2c(cncc2s1)c3ccc(c(c3F)F)O AIFCHEM-6336321568 [0,2,0,0,0,0|1,0,0]=3 80 B23R3.17987778 Cc1cc(c(cc1C)c2cncc3c2cc(s3)C(=O)O)C AIFCHEM-6296001271 [0,2,0,0,0,0|2,0,0]=4 81 B23R3.31446686 COc1ccc(c(c1)c2cncc3c2cc(s3)C(=O)O)F AIFCHEM-6295636432 [0,2,0,0,0,0|2,0,0]=4 82 B23R3.31446686 COc1ccc(c(c1)c2cncc3c2cc(s3)C(=O)O)N AIFCHEM-6319751449 [0,2,0,0,0,0|2,0,0]=4 83 B23R3.4392416 CCc1cc(ccc1O)c2cncc3c2cc(s3)C(=O)O AIFCHEM-94523449476 [0,2,0,0,0,0|2,0,0]=4 84 B23R3.4392416 Cc1ccc(cc1C#N)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6335942728 [0,2,0,0,0,0|2,0,0]=4 85 B23R3.4392416 Cc1ccc(cc1C=O)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6368174008 [0,2,0,0,0,0|2,0,0]=4 86 B23R3.4392416 Cc1ccc(cc1CO)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6296317367 [0,2,0,0,0,0|2,0,0]=4 87 B23R3.4392416 O=C(O)c1cc2c(cncc2s1)c3ccc(c(c3)CO)F AIFCHEM-6311708336 [0,2,0,0,0,0|2,0,0]=4 88 B23R3.49224380 COc1ccc(cc1C)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6319376523 [0,2,0,0,0,0|2,0,0]=4 89 B23R3.49224380 CSc1ccc(cc1F)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6470162356 [0,2,0,0,0,0|2,0,0]=4 90 B23R3.49224380 NCc1ccc(cc1F)c2cncc3c2cc(s3)C(=O)O AIFCHEM-94593383656 [0,2,0,0,0,0|1,0,0]=3 91 B23R3.49224380 Nc1cc(ccc1C=O)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6296078485 [0,2,0,0,0,0|2,0,0]=4 92 B23R3.49224380 O=Cc1ccc(cc1F)c2cccc3c2cc(s3)C(=O)O AIFCHEM-6470048910 [0,2,0,0,0,0|2,0,0]=4 93 B23R3.19248805 CN(C)c1cccc(c1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6311825650 [0,2,0,0,0,0|2,0,0]=4 94 B23R3.19248805 C[S+]([O-])c1cccc(c1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6295926557 [0,2,0,0,0,0|2,0,0]=4 95 B23R3.19248805 O=C(O)c1cc2c(cccc2s1)c3cccc(c3)C(F)F AIFCHEM-6388415408 [0,2,0,0,0,0|2,0,0]=4 96 B23R3.19886066 N#CCc1cccc(c1)c2cncc3c2cc(s3)C(=O)O AIFCHEM-6295926552 [0,2,0,0,0,0|2,0,0]=4 97 B23R3.19886066 O=C(O)c1cc2c(cncc2s1)c3cccc(c3)CCO AIFCHEM-6311838885 [0,2,0,0,0,0|2,0,0]=4 98 B21R3.155073 NC(=O)c1cc(cs1)c2cccc3c2cc(cc3)O AIFCHEM-6322350123 [0,0,1,1,0,0|2,0,0]=4 99 B21R3.398209 NC(=O)c1cc(cs1)c2ccnc3c2cccc3F AIFCHEM-6364983626 [0,0,1,1,0,0|2,0,0]=4