0 B14R2.112 CC=Cc1ccc2ccncc2c1 AIFCHEM-6471266307 [0,1,0,0,0,0|2,0,0]=3 1 B14R2.112 CC=Cc1ccc2cnncc2c1 AIFCHEM-6375150437 [0,1,0,0,0,0|3,0,0]=4 2 B14R2.112 CC=Cc1cnc2ccccc2c1 AIFCHEM-6417161046 [0,1,0,0,0,0|2,0,0]=3 3 B14R2.112 CCNc1cc2ccccc2cn1 AIFCHEM-94537419260 [0,1,0,0,0,0|2,0,0]=3 4 B14R2.112 CCNc1ccc2cccnc2n1 AIFCHEM-94537416232 [0,1,0,0,0,0|3,0,0]=4 5 B14R2.112 CCNc1ncc2ccccc2n1 AIFCHEM-94537416615 [0,1,0,0,0,0|3,0,0]=4 6 B12R1.71 COc1ccc(cn1)C=CCO AIFCHEM-6336731333 [0,0,1,0,0,0|2,0,1]=4 7 B12R1.71 CSc1ccc(cc1)C=CCO AIFCHEM-6381160487 [0,0,1,0,0,0|1,1,1]=4 8 B12R1.114 CC=Cc1ccc(cc1C)NC AIFCHEM-6231664050 [0,0,1,0,0,0|1,0,2]=4 9 B12R1.114 CC=Cc1ncc(cc1F)OC AIFCHEM-6350006579 [0,0,1,0,0,0|2,0,1]=4 10 B12R1.267 CCOC=Cc1ccccc1C AIFCHEM-94536265848 [0,0,1,0,0,0|2,0,1]=4 11 B12R1.267 COCC=Cc1ccccc1F AIFCHEM-6203896649 [0,0,1,0,0,0|1,0,1]=3 12 B12R1.267 COCC=Cc1ccccc1O AIFCHEM-6341471182 [0,0,1,0,0,0|1,0,1]=3 13 B12R1.267 COCC=Cc1ccncc1C AIFCHEM-6297417169 [0,0,1,0,0,0|1,0,2]=4 14 B12R1.267 COCC=Cc1ccncc1N AIFCHEM-5885975071 [0,0,1,0,0,0|2,0,1]=4 15 B12R1.267 COCC=Cc1cnccc1F AIFCHEM-6319091736 [0,0,1,0,0,0|2,0,1]=4 16 B12R1.270 CC=Cc1cc(ccc1N)CC AIFCHEM-6189151926 [0,0,1,0,0,0|2,0,1]=4 17 B12R1.270 CC=Cc1cc(ccc1O)CC AIFCHEM-6387526475 [0,0,1,0,0,0|2,0,1]=4 18 B12R1.270 CC=Cc1cc(ccc1O)OC AIFCHEM-6347348005 [0,0,1,0,0,0|1,0,1]=3 19 B12R1.270 CC=Cc1cc(ncc1C)OC AIFCHEM-6337456605 [0,0,1,0,0,0|1,0,2]=4 20 B12R1.270 CC=Cc1nc(ccc1O)OC AIFCHEM-6380064637 [0,0,1,0,0,0|2,0,1]=4 21 B11R1.1 Cc1ccc(cc1)C=CCO AIFCHEM-6341313267 [1,0,1,0,0,0|1,0,1]=4 22 B11R1.83 CC=Cc1ccc(nc1)OC AIFCHEM-6304788304 [1,0,1,0,0,0|1,0,1]=4 23 B11R1.81 CC=Cc1ccc(cc1C)C AIFCHEM-94527147474 [1,0,1,0,0,0|0,0,2]=4 24 B11R1.81 CC=Cc1ccc(cc1F)C AIFCHEM-6296674060 [1,0,1,0,0,0|1,0,1]=4 25 B11R1.81 CC=Cc1ccc(cc1F)O AIFCHEM-6364616607 [1,0,1,0,0,0|1,0,1]=4 26 B11R1.17 OCC=Cc1ccccc1O AIFCHEM-6364368587 [1,0,1,0,0,0|1,0,1]=4 27 B11R1.189 CC=Cc1ccnc(c1)OC AIFCHEM-6344092018 [1,0,1,0,0,0|1,0,1]=4 28 B11R1.24 Cc1cccc(c1)C=CCO AIFCHEM-6381275994 [1,0,1,0,0,0|1,0,1]=4 29 B11R1.24 OCC=Cc1cccc(c1)O AIFCHEM-6420389960 [1,0,1,0,0,0|1,0,1]=4 30 B13R1.75 COc1ccc(c(c1)O)C=CCO AIFCHEM-6338734778 [0,1,1,0,0,0|1,0,1]=4 31 B13R1.577 COc1ccc(cc1C)C=CCO AIFCHEM-6299143739 [0,1,1,0,0,0|1,0,1]=4 32 B13R1.355 CC=Cc1cc(ccc1C#N)OC AIFCHEM-6339243804 [0,1,1,0,0,0|1,0,1]=4 33 B13R1.95 C/C=C(\C)/c1ccc(cc1F)OC AIFCHEM-94584218757 [0,1,1,0,0,0|1,0,1]=4 34 B13R1.95 C/C=C(\C)/c1ccc(cc1O)OC AIFCHEM-94584218405 [0,1,1,0,0,0|1,0,1]=4 35 B13R1.2901 CC=Cc1cc(c(cc1C)OC)C AIFCHEM-6428141232 [0,1,1,0,0,0|0,0,2]=4 36 B13R1.84 CCOC=Cc1ccccc1NC AIFCHEM-94580724089 [0,1,1,0,0,0|1,0,1]=4 37 B13R1.84 CNc1ccccc1C=CCOC AIFCHEM-5742657972 [0,1,1,0,0,0|1,0,1]=4 38 B13R1.84 COCC=Cc1ccccc1CN AIFCHEM-94588407439 [0,1,1,0,0,0|1,0,1]=4 39 B13R1.16 COCC=Cc1cccc(c1C)O AIFCHEM-6362140984 [0,1,1,0,0,0|0,0,2]=4 40 B13R1.16 COCC=Cc1cccc(c1F)C AIFCHEM-6424424721 [0,1,1,0,0,0|1,0,1]=4 41 B13R1.16 COCC=Cc1cccc(c1N)N AIFCHEM-6407686245 [0,1,1,0,0,0|1,0,1]=4 42 B13R1.16 COCC=Cc1cccc(c1O)F AIFCHEM-6386230192 [0,1,1,0,0,0|1,0,1]=4 43 B13R1.16 COCC=Cc1cccc(c1O)O AIFCHEM-6309292724 [0,1,1,0,0,0|1,0,1]=4 44 B13R1.369 COCC=Cc1ccc(cc1C)F AIFCHEM-6371669513 [0,1,1,0,0,0|0,0,2]=4 45 B13R1.369 COCC=Cc1ccc(cc1C)O AIFCHEM-6384387505 [0,1,1,0,0,0|0,0,2]=4 46 B13R1.369 COCC=Cc1ccc(cc1F)O AIFCHEM-6375933210 [0,1,1,0,0,0|1,0,1]=4 47 B13R1.369 COCC=Cc1ccc(cc1N)F AIFCHEM-5726800806 [0,1,1,0,0,0|1,0,1]=4 48 B13R1.656 COCC=Cc1cc(ccc1C)O AIFCHEM-6363227323 [0,1,1,0,0,0|0,0,2]=4 49 B13R1.656 COCC=Cc1cc(ccc1F)C AIFCHEM-6305454024 [0,1,1,0,0,0|1,0,1]=4 50 B13R1.656 COCC=Cc1cc(ccc1N)C AIFCHEM-5920440781 [0,1,1,0,0,0|1,0,1]=4 51 B13R1.656 COCC=Cc1cc(ccc1N)N AIFCHEM-6475223151 [0,1,1,0,0,0|1,0,1]=4 52 B13R1.656 COCC=Cc1cc(ccc1O)F AIFCHEM-6389052808 [0,1,1,0,0,0|1,0,1]=4 53 B13R1.8919 COCC=Cc1c(cccc1C)C AIFCHEM-6406861026 [0,1,1,0,0,0|0,0,2]=4 54 B13R1.384 CC=Cc1cc(ccc1F)COC AIFCHEM-6365143456 [0,1,1,0,0,0|1,0,1]=4 55 B13R1.558 COc1ccc(c(c1)C=CCO)N AIFCHEM-5705471852 [0,1,1,0,0,0|1,0,1]=4 56 B13R1.2431 C/C=C(\C)/c1cc(ccc1O)OC AIFCHEM-94584214295 [0,1,1,0,0,0|1,0,1]=4 57 B13R1.2900 CC=Cc1cc(c(cc1F)N)OC AIFCHEM-6076013335 [0,1,1,0,0,0|1,0,1]=4 58 B13R1.124 COc1cc(cc(c1)C=CCO)C AIFCHEM-6470302096 [0,1,1,0,0,0|1,0,1]=4 59 B13R1.124 COc1cc(cc(c1)C=CCO)N AIFCHEM-6172452366 [0,1,1,0,0,0|1,0,1]=4 60 B13R1.567 COCc1cccc(c1)C=CCO AIFCHEM-6442413770 [0,1,1,0,0,0|1,0,1]=4 61 B13R2.1 CC=Cc1coc2c1cccc2 AIFCHEM-6431447641 [0,1,0,0,1,0|2,0,0]=4 62 B13R2.26 CC=Cc1cc2ccccc2[nH]1 AIFCHEM-6292408953 [0,1,0,0,1,0|2,0,0]=4 63 B13R2.26 CC=Cc1cc2ccccc2o1 AIFCHEM-6485783759 [0,1,0,0,1,0|2,0,0]=4 64 B13R2.26 CCNc1cc2ccccc2s1 AIFCHEM-94537421792 [0,1,0,0,1,0|2,0,0]=4 65 B13R2.449 CC=Cc1ccc2[nH]ccc2c1 AIFCHEM-6409041289 [0,1,0,0,1,0|2,0,0]=4 66 B13R2.449 CC=Cc1ccc2occc2c1 AIFCHEM-6341830459 [0,1,0,0,1,0|2,0,0]=4 67 B13R2.449 CCNc1ccc2[nH]ccc2c1 AIFCHEM-94537424131 [0,1,0,0,1,0|2,0,0]=4 68 B15R2.2220 CC=Cc1cnc2ccccc2c1N AIFCHEM-5771595186 [0,2,0,0,0,0|2,0,0]=4 69 B15R2.2220 CC=Cc1cnc2ccccc2c1O AIFCHEM-6445325979 [0,2,0,0,0,0|2,0,0]=4 70 B15R2.2220 CC=Cc1ncc2ccccc2c1N AIFCHEM-5617598826 [0,2,0,0,0,0|2,0,0]=4 71 B15R2.352 CCCNc1ccc2cccnc2c1 AIFCHEM-94559314503 [0,2,0,0,0,0|2,0,0]=4 72 B15R2.352 CCCNc1ccc2ncccc2c1 AIFCHEM-94569020219 [0,2,0,0,0,0|2,0,0]=4 73 B15R2.886 CC=Cc1cc(c2ncccc2c1)F AIFCHEM-6339674533 [0,2,0,0,0,0|2,0,0]=4 74 B15R2.886 CCNc1cc(c2ccccc2c1)Br AIFCHEM-94537425083 [0,2,0,0,0,0|1,0,0]=3 75 B15R2.886 CCNc1cc(c2ncccc2c1)Cl AIFCHEM-94537422146 [0,2,0,0,0,0|2,0,0]=4 76 B15R2.888 CC=Cc1cc2ccccc2cc1O AIFCHEM-6404596270 [0,2,0,0,0,0|1,0,0]=3 77 B15R2.888 CC=Cc1cc2cccnc2cc1C AIFCHEM-6405199079 [0,2,0,0,0,0|2,0,0]=4 78 B15R2.888 CCNc1cc2ccccc2[nH]c1=O AIFCHEM-94537423240 [0,2,0,0,0,0|2,0,0]=4 79 B15R2.1282 CC=Cc1ccc2c[nH]c(=O)cc2c1 AIFCHEM-6311551432 [0,2,0,0,0,0|2,0,0]=4 80 B15R2.1282 CC=Cc1ccc2ncc(cc2c1)C AIFCHEM-6305969637 [0,2,0,0,0,0|2,0,0]=4 81 B15R2.1282 CC=Cc1ccc2ncc(cc2c1)O AIFCHEM-6361337571 [0,2,0,0,0,0|2,0,0]=4 82 B15R2.1282 CC=Cc1cnc2ccc(cc2c1)C AIFCHEM-6295911122 [0,2,0,0,0,0|2,0,0]=4 83 B15R2.1282 CC=Cc1cnc2ccc(cc2c1)F AIFCHEM-6443115016 [0,2,0,0,0,0|2,0,0]=4 84 B15R2.1290 CC=Cc1ccc2cccc(c2c1)O AIFCHEM-6397472782 [0,2,0,0,0,0|1,0,0]=3 85 B15R2.1290 CC=Cc1ccc2ccnc(c2c1)N AIFCHEM-5985129403 [0,2,0,0,0,0|2,0,0]=4 86 B15R2.1290 CC=Cc1cnc2cccc(c2c1)N AIFCHEM-6149080582 [0,2,0,0,0,0|2,0,0]=4 87 B15R2.1290 CCNc1ccc2cccc(c2n1)O AIFCHEM-94537424593 [0,2,0,0,0,0|2,0,0]=4 88 B15R2.1290 CCNc1ccc2nccc(c2c1)Br AIFCHEM-94537414018 [0,2,0,0,0,0|2,0,0]=4 89 B15R2.1290 CCNc1cnc2cccc(c2c1)Cl AIFCHEM-94537415281 [0,2,0,0,0,0|2,0,0]=4 90 B15R2.1290 CCNc1cnc2cccc(c2c1)O AIFCHEM-94537414043 [0,2,0,0,0,0|2,0,0]=4 91 B15R2.10252 CC=Cc1ccc2cc(cnc2c1)F AIFCHEM-6414198414 [0,2,0,0,0,0|2,0,0]=4 92 B15R2.10252 CCNc1ccc2[nH]c(=O)ccc2c1 AIFCHEM-94537425502 [0,2,0,0,0,0|2,0,0]=4 93 B15R2.10252 CCNc1ccc2cc(cnc2c1)Cl AIFCHEM-94537414747 [0,2,0,0,0,0|2,0,0]=4 94 B15R2.54379 CC=Cc1ccc2c(cccc2c1)N AIFCHEM-5894119533 [0,2,0,0,0,0|1,0,0]=3 95 B15R2.54379 CC=Cc1cnc2c(cccc2c1)C AIFCHEM-6286631498 [0,2,0,0,0,0|2,0,0]=4 96 B15R2.54379 CCNc1cc2cccc(c2cn1)Br AIFCHEM-94537414011 [0,2,0,0,0,0|2,0,0]=4 97 B13R2.18 Nc1ccccc1c2ccoc2 AIFCHEM-5900639402 [0,0,1,1,0,0|1,0,1]=4