0 B12R1.5 C/C=C(\C)/c1ccc(cc1)SC AIFCHEM-94584209307 [0,1,0,0,0,0|2,1,0]=4 1 B12R1.5 CCN(C)c1ccc(cc1)OC AIFCHEM-94537411832 [0,1,0,0,0,0|3,0,0]=4 2 B12R1.113 CCNc1ccc(cc1)C(C)O AIFCHEM-94537415613 [0,1,0,0,0,0|2,0,1]=4 3 B12R1.4 CCc1ccc(cc1)C=C(C)C AIFCHEM-6310436895 [0,0,0,0,0,1|3,0,0]=4 4 B12R1.4 COc1ccc(cn1)NC(=O)C AIFCHEM-5666168071 [0,0,0,0,0,1|2,0,0]=3 5 B12R1.4 COc1ccc(nc1)NC(=O)C AIFCHEM-94535588104 [0,0,0,0,0,1|2,0,0]=3 6 B12R1.4 COc1cnc(cn1)NC(=O)C AIFCHEM-94605354024 [0,0,0,0,0,1|3,0,0]=4 7 B12R1.4 CSc1ccc(cc1)C=C(C)C AIFCHEM-6350061194 [0,0,0,0,0,1|2,1,0]=4 8 B11R1.83 CC=Cc1ccc(nc1)OC AIFCHEM-6304788304 [1,1,0,0,0,0|2,0,0]=4 9 B11R1.83 CCNc1ccc(cc1)OC AIFCHEM-94577704899 [1,1,0,0,0,0|1,0,1]=4 10 B11R1.22 C/C=C(\C)/c1ccc(cc1)C AIFCHEM-94584220431 [1,1,0,0,0,0|2,0,0]=4 11 B11R1.124 CC=Cc1cc(co1)C(=O)O AIFCHEM-6322307882 [0,1,0,0,1,0|2,0,0]=4 12 B13R1.5 C#CC(=O)Nc1ccc(cc1)SC AIFCHEM-94525190848 [0,1,0,0,0,1|1,1,0]=4 13 B13R1.5 C#CC(=O)Nc1ccc(cn1)OC AIFCHEM-94525190579 [0,1,0,0,0,1|2,0,0]=4 14 B13R1.5 COc1ccc(cc1)NC(C)CO AIFCHEM-94577699851 [0,1,0,0,0,1|1,0,1]=4 15 B13R1.5 CSc1ccc(cn1)NC(=O)CO AIFCHEM-94532681260 [0,1,0,0,0,1|1,1,0]=4 16 B13R1.35 COc1ccc(cc1Br)NC(=O)C AIFCHEM-94535593158 [0,1,0,0,0,1|1,0,0]=3 17 B13R1.35 COc1ccc(cc1F)NC(=O)C AIFCHEM-94535595845 [0,1,0,0,0,1|1,0,0]=3 18 B13R1.35 COc1ncc(cc1Cl)NC(=O)C AIFCHEM-94535592042 [0,1,0,0,0,1|2,0,0]=4 19 B13R1.35 COc1ncc(cc1F)NC(=O)C AIFCHEM-5953332572 [0,1,0,0,0,1|2,0,0]=4 20 B13R1.36 COc1ccc(cc1)N(C)C(=O)C AIFCHEM-94605337723 [0,1,0,0,0,1|1,0,0]=3 21 B13R1.142 CCNc1ccc(cc1)OC(=O)C AIFCHEM-94537415026 [0,1,0,0,0,1|2,0,0]=4 22 B13R1.142 CCOc1ccc(cc1)NC(=O)C AIFCHEM-6140367110 [0,1,0,0,0,1|1,0,0]=3 23 B13R1.142 COCc1ccc(cc1)NC(=O)C AIFCHEM-5883450590 [0,1,0,0,0,1|1,0,0]=3 24 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C AIFCHEM-5627058688 [0,1,0,0,0,1|2,0,0]=4 25 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C AIFCHEM-94533790707 [0,1,0,0,0,1|2,0,0]=4 26 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C AIFCHEM-94605352062 [0,1,0,0,0,1|1,0,0]=3 27 B13R1.653 COc1ccc(c(c1)C)NC(=O)C AIFCHEM-94555828642 [0,1,0,0,0,1|1,0,0]=3 28 B13R1.95 C/C=C(\C)/c1ccc(cc1F)OC AIFCHEM-94584218757 [0,2,0,0,0,0|2,0,0]=4 29 B13R1.95 C/C=C(\C)/c1ccc(cc1O)OC AIFCHEM-94584218405 [0,2,0,0,0,0|2,0,0]=4 30 B13R1.139 CC=Cc1ccc(cc1)C(=O)NC AIFCHEM-6328508123 [0,2,0,0,0,0|2,0,0]=4 31 B13R1.139 CC=Cc1ccc(nc1)C(=O)OC AIFCHEM-6287741204 [0,2,0,0,0,0|2,0,0]=4 32 B13R1.139 CCNc1ccc(cc1)C(=O)NC AIFCHEM-94537423740 [0,2,0,0,0,0|2,0,0]=4 33 B13R1.537 CCN(C)c1ccc(cc1)C(=O)O AIFCHEM-94601127225 [0,2,0,0,0,0|1,0,0]=3 34 B13R1.140 CC=Cc1ccc(cc1)S(=O)(=O)O AIFCHEM-94581980330 [0,2,0,0,0,0|2,0,0]=4 35 B13R1.144 CC=Cc1ccc(cc1F)C(=O)N AIFCHEM-6364549693 [0,2,0,0,0,0|2,0,0]=4 36 B13R1.144 CC=Cc1ccc(cc1O)C(=O)N AIFCHEM-6323486425 [0,2,0,0,0,0|2,0,0]=4 37 B13R1.144 CCNc1ncc(cc1Cl)C(=O)O AIFCHEM-94537421457 [0,2,0,0,0,0|2,0,0]=4 38 B13R1.74 CCCNc1ccc(cc1)C(=O)O AIFCHEM-94569015844 [0,2,0,0,0,0|1,0,0]=3 39 B13R1.74 O=C(O)c1ccc(cc1)C=CCO AIFCHEM-6312353296 [0,2,0,0,0,0|1,0,0]=3 40 B13R1.74 O=C(O)c1ccc(nc1)C=CCO AIFCHEM-6330213043 [0,2,0,0,0,0|2,0,0]=4 41 B13R1.385 CC=Cc1ccc(c(c1)N)C(=O)N AIFCHEM-5641436662 [0,2,0,0,0,0|2,0,0]=4 42 B13R1.385 CC=Cc1ccc(c(c1)O)C(=O)O AIFCHEM-6333078875 [0,2,0,0,0,0|1,0,0]=3 43 B13R1.385 CCNc1cc(c(cn1)C(=O)O)Cl AIFCHEM-94537411882 [0,2,0,0,0,0|2,0,0]=4 44 B13R1.385 CCNc1ccc(c(n1)Cl)C(=O)O AIFCHEM-94537411887 [0,2,0,0,0,0|2,0,0]=4 45 B11R1.20 CC(=O)Nc1ccc(cn1)C AIFCHEM-5874295902 [1,0,0,0,0,1|2,0,0]=4 46 B13R1.3 CCc1ccc(cc1)CNC(=O)C AIFCHEM-94605355910 [0,0,0,0,0,2|2,0,0]=4