0 B12R1.71 CCCNc1ccc(cc1)OC AIFCHEM-94569015005 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.71 COc1ccc(cn1)C=CCO AIFCHEM-6336731333 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.71 COc1ccc(nn1)C=CCO AIFCHEM-6322035013 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.71 COc1ncc(cn1)C=CCO AIFCHEM-6428335626 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.71 CSc1ccc(cc1)C=CCO AIFCHEM-6381160487 [0,0,0,0,0,0|0,1,2]=3 5 B12R1.71 CSc1ccc(nc1)C=CCO AIFCHEM-6294282278 [0,0,0,0,0,0|1,1,2]=4 6 B12R1.71 N#Cc1ccc(cc1)C=CCO AIFCHEM-6325207024 [0,0,0,0,0,0|2,0,2]=4 7 B12R1.71 NCc1ccc(cc1)C=CCO AIFCHEM-5598304750 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.1 Cc1ccc(cc1)C=CCO AIFCHEM-6341313267 [1,0,0,0,0,0|0,0,2]=3 9 B11R1.1 OCC=Cc1ccc(cc1)F AIFCHEM-6361757288 [1,0,0,0,0,0|1,0,2]=4 10 B11R1.83 CC=Cc1ccc(cc1)C#N AIFCHEM-6320108023 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.83 CC=Cc1ccc(nc1)OC AIFCHEM-6304788304 [1,0,0,0,0,0|1,0,1]=3 12 B11R1.83 CC=Cc1cnc(nc1)OC AIFCHEM-6405006277 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.83 CC=Cc1ncc(cn1)OC AIFCHEM-6376224948 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.83 CCNc1ccc(cc1)OC AIFCHEM-94577704899 [1,0,0,0,0,0|1,0,2]=4 15 B13R1.3 CCc1ccc(cc1)CNC(=O)C AIFCHEM-94605355910 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.3 CSc1ccc(cc1)C=CC(C)O AIFCHEM-6317931953 [0,1,0,0,0,0|0,1,2]=4 17 B13R1.74 CC(C)c1ccc(cc1)C=CCO AIFCHEM-6310734992 [0,1,0,0,0,0|1,0,2]=4 18 B13R1.74 CN(C)c1ccc(cc1)C=CCO AIFCHEM-6384987558 [0,1,0,0,0,0|1,0,2]=4 19 B13R1.75 COc1cc(=O)c(c[nH]1)C=CCO AIFCHEM-6334910205 [0,1,0,0,0,0|1,0,2]=4 20 B13R1.75 COc1ccc(c(c1)O)C=CCO AIFCHEM-6338734778 [0,1,0,0,0,0|0,0,2]=3 21 B13R1.75 COc1ccc(c(n1)N)C=CCO AIFCHEM-5617324179 [0,1,0,0,0,0|1,0,2]=4 22 B13R1.75 COc1cnc(c(c1)N)C=CCO AIFCHEM-6302097306 [0,1,0,0,0,0|1,0,2]=4 23 B13R1.75 CSc1ccc(c(c1)F)C=CCO AIFCHEM-6359073454 [0,1,0,0,0,0|0,1,2]=4 24 B13R1.77 CCSc1ccc(cc1)C=CCO AIFCHEM-6255233891 [0,1,0,0,0,0|0,1,2]=4 25 B13R1.77 OCC=Cc1ccc(cc1)CCO AIFCHEM-6325347260 [0,1,0,0,0,0|1,0,2]=4 26 B13R1.371 CCCC=Cc1ccc(cc1)CC AIFCHEM-6348323184 [0,1,0,0,0,0|2,0,1]=4 27 B13R1.371 CCCC=Cc1ccc(cc1)SC AIFCHEM-6381274452 [0,1,0,0,0,0|1,1,1]=4 28 B13R1.371 COCC=Cc1ccc(nc1)OC AIFCHEM-6304796703 [0,1,0,0,0,0|1,0,2]=4 29 B13R1.577 CNc1ccc(cc1F)C=CCO AIFCHEM-5782011411 [0,1,0,0,0,0|1,0,2]=4 30 B13R1.577 CNc1ccc(cc1N)C=CCO AIFCHEM-6354636532 [0,1,0,0,0,0|1,0,2]=4 31 B13R1.577 COc1ccc(cc1C)C=CCO AIFCHEM-6299143739 [0,1,0,0,0,0|0,0,2]=3 32 B13R1.577 COc1ccc(nc1C)C=CCO AIFCHEM-6442335950 [0,1,0,0,0,0|1,0,2]=4 33 B13R1.577 COc1ncc(cc1C)C=CCO AIFCHEM-6372536874 [0,1,0,0,0,0|1,0,2]=4 34 B13R1.577 COc1ncc(cc1N)C=CCO AIFCHEM-6022451627 [0,1,0,0,0,0|1,0,2]=4 35 B13R1.577 CSc1ccc(cc1F)C=CCO AIFCHEM-6462485112 [0,1,0,0,0,0|0,1,2]=4 36 B10R1.1 CC=Cc1ccc(cc1)N AIFCHEM-94608719473 [2,0,0,0,0,0|1,0,1]=4 37 B12R1.21 CC(O)C=Cc1ccc(cc1)O AIFCHEM-94601033022 [1,1,0,0,0,0|0,0,2]=4 38 B12R1.21 Cc1ccc(cc1)C=CC(C)O AIFCHEM-94528939842 [1,1,0,0,0,0|0,0,2]=4 39 B12R1.69 Cc1ccc(c(c1)C)C=CCO AIFCHEM-94607013894 [1,1,0,0,0,0|0,0,2]=4 40 B12R1.69 Cc1ccc(c(c1)F)C=CCO AIFCHEM-6337803033 [1,1,0,0,0,0|0,0,2]=4 41 B12R1.69 Nc1cc(ccc1C=CCO)O AIFCHEM-6118720578 [1,1,0,0,0,0|0,0,2]=4 42 B12R1.69 OCC=Cc1ccc(cc1O)O AIFCHEM-6301496114 [1,1,0,0,0,0|0,0,2]=4 43 B12R1.385 OCC=Cc1ccc(c(c1)F)O AIFCHEM-6209350294 [1,1,0,0,0,0|0,0,2]=4 44 B12R1.385 OCC=Cc1ccc(c(c1)O)O AIFCHEM-6413125974 [1,1,0,0,0,0|0,0,2]=4 45 B12R1.4 CCc1ccc(cc1)C=C(C)C AIFCHEM-6310436895 [1,1,0,0,0,0|1,0,1]=4 46 B12R1.4 COc1ccc(cn1)NC(=O)C AIFCHEM-5666168071 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.4 COc1ccc(nc1)NC(=O)C AIFCHEM-94535588104 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.4 CSc1ccc(cc1)C=C(C)C AIFCHEM-6350061194 [1,1,0,0,0,0|0,1,1]=4 49 B12R1.5 C/C=C(\C)/c1ccc(cc1)SC AIFCHEM-94584209307 [1,1,0,0,0,0|0,1,1]=4 50 B12R1.113 CC=Cc1ccc(cc1)N(C)C AIFCHEM-6355524594 [1,1,0,0,0,0|1,0,1]=4 51 B12R1.114 CC=Cc1ccc(cc1C)NC AIFCHEM-6231664050 [1,1,0,0,0,0|1,0,1]=4 52 B12R1.114 CC=Cc1ncc(cc1F)OC AIFCHEM-6350006579 [1,1,0,0,0,0|1,0,1]=4 53 B12R1.116 CC=Cc1ccc(nc1)OCC AIFCHEM-6353407578 [1,1,0,0,0,0|1,0,1]=4 54 B12R1.288 CC=Cc1cc(=O)c(c[nH]1)OC AIFCHEM-6294545198 [1,1,0,0,0,0|1,0,1]=4 55 B12R1.288 CC=Cc1cc(c(cn1)OC)N AIFCHEM-6334757480 [1,1,0,0,0,0|1,0,1]=4 56 B12R1.288 CC=Cc1ccc(c(c1)F)NC AIFCHEM-5767755365 [1,1,0,0,0,0|1,0,1]=4 57 B14R1.5 C#CC(=O)NCc1ccc(cc1)OC AIFCHEM-94525196876 [0,2,0,0,0,0|1,0,1]=4 58 B14R1.103 COc1ccc(c(c1)Cl)CNC(=O)C AIFCHEM-94535600299 [0,2,0,0,0,0|1,0,1]=4 59 B14R1.103 COc1ccc(c(c1)F)C=CC(C)O AIFCHEM-6354347402 [0,2,0,0,0,0|0,0,2]=4 60 B14R1.103 COc1ccc(c(c1)O)C=CC(C)O AIFCHEM-6326373023 [0,2,0,0,0,0|0,0,2]=4 61 B14R1.103 COc1ccc(c(c1)O)CNC(=O)C AIFCHEM-94605347676 [0,2,0,0,0,0|1,0,1]=4 62 B14R1.142 COCc1ccc(cc1)CNC(=O)C AIFCHEM-94596712100 [0,2,0,0,0,0|1,0,1]=4 63 B14R1.463 CCCC=Cc1ccc(cc1O)OC AIFCHEM-6304178659 [0,2,0,0,0,0|1,0,1]=4 64 B14R1.463 COCC=Cc1ccc(cc1C)OC AIFCHEM-6424498148 [0,2,0,0,0,0|0,0,2]=4 65 B14R1.1355 COc1ccc(c(c1)CO)C=CCO AIFCHEM-6295718299 [0,2,0,0,0,0|0,0,2]=4 66 B14R1.1361 COc1ccc(c(c1C)C)C=CCO AIFCHEM-6296657217 [0,2,0,0,0,0|0,0,2]=4 67 B14R1.7407 COc1cc(c(c(c1)C)C=CCO)C AIFCHEM-6414144581 [0,2,0,0,0,0|0,0,2]=4 68 B14R1.70 CCOCc1ccc(cc1)C=CCO AIFCHEM-94600770775 [0,2,0,0,0,0|0,0,2]=4 69 B14R1.70 N#CCOc1ccc(cc1)C=CCO AIFCHEM-6341270593 [0,2,0,0,0,0|0,0,2]=4 70 B14R1.465 CCOC=Cc1ccc(cc1)OCC AIFCHEM-6292871988 [0,2,0,0,0,0|1,0,1]=4 71 B14R1.909 CCOC=Cc1ccc(c(c1)F)OC AIFCHEM-6388524461 [0,2,0,0,0,0|1,0,1]=4 72 B14R1.909 COCC=Cc1ccc(c(c1)O)OC AIFCHEM-6366693902 [0,2,0,0,0,0|0,0,2]=4 73 B14R1.7500 COc1c(cc(cc1F)C=CCO)F AIFCHEM-6432902768 [0,2,0,0,0,0|0,0,2]=4 74 B12R1.270 CC=Cc1cc(ccc1O)OC AIFCHEM-6347348005 [0,0,1,1,0,0|2,0,0]=4 75 B12R1.280 CC=Cc1cccc(c1C)OC AIFCHEM-6189756030 [0,0,1,1,0,0|1,0,1]=4 76 B12R2.143 CC=Cc1ccc2c(c1)CC2 AIFCHEM-6307603872 [1,0,0,1,0,0|1,0,1]=4 77 B14R2.331 COc1ccc(cc1)C=C2CCC2 AIFCHEM-94553274097 [0,1,0,1,0,0|1,0,1]=4 78 B14R2.991 OCC=Cc1ccc2c(c1)COC2 AIFCHEM-6315505975 [0,1,0,1,0,0|0,0,2]=4 79 B14R2.1 CCc1ccc(cc1)c2cccs2 AIFCHEM-6452902086 [0,1,0,1,0,0|1,1,0]=4 80 B14R2.1 CCc1ccc(cc1)c2ccsn2 AIFCHEM-6298432488 [0,1,0,1,0,0|1,1,0]=4 81 B14R2.1 CCc1ccc(cc1)c2cncs2 AIFCHEM-6364348120 [0,1,0,1,0,0|1,1,0]=4 82 B14R2.1 CNc1ccc(cc1)c2cc[nH]c2 AIFCHEM-5733259305 [0,1,0,1,0,0|2,0,0]=4 83 B14R2.1 COc1ccc(cc1)C2=CCCC2 AIFCHEM-94553274362 [0,1,0,1,0,0|1,0,1]=4 84 B14R2.1 COc1ccc(cc1)c2cc[nH]c2 AIFCHEM-6311780181 [0,1,0,1,0,0|1,0,0]=3 85 B14R2.1 COc1ccc(cc1)c2ccon2 AIFCHEM-6444949374 [0,1,0,1,0,0|0,0,1]=3 86 B14R2.1 COc1ccc(cn1)c2ccon2 AIFCHEM-6417901255 [0,1,0,1,0,0|1,0,1]=4 87 B14R2.1 CSc1ccc(cc1)c2cc[nH]c2 AIFCHEM-6340330782 [0,1,0,1,0,0|1,1,0]=4 88 B14R2.1 CSc1ccc(cc1)c2cccs2 AIFCHEM-6416198070 [0,1,0,1,0,0|0,2,0]=4 89 B14R2.1 CSc1ccc(cc1)c2cncs2 AIFCHEM-6344255543 [0,1,0,1,0,0|0,2,0]=4