0 B12R1.5 C/C=C(\C)/c1ccc(cc1)SC AIFCHEM-94584209307 [0,1,0,0,0,0|1,1,0]=3 1 B12R1.5 C/C=C(\C)/c1ccc(nn1)OC AIFCHEM-94584214288 [0,1,0,0,0,0|3,0,0]=4 2 B12R1.5 CCN(C)c1ccc(cc1)OC AIFCHEM-94537411832 [0,1,0,0,0,0|2,0,0]=3 3 B12R1.113 CC=Cc1ccc(cc1)N(C)C AIFCHEM-6355524594 [0,1,0,0,0,0|3,0,0]=4 4 B12R1.113 CCNc1ccc(cc1)C(C)O AIFCHEM-94537415613 [0,1,0,0,0,0|1,0,2]=4 5 B12R1.113 CCNc1ccc(cc1)N(C)C AIFCHEM-94537418001 [0,1,0,0,0,0|3,0,0]=4 6 B12R1.4 CCc1ccc(cc1)C=C(C)C AIFCHEM-6310436895 [0,0,0,0,0,1|2,0,0]=3 7 B12R1.4 COc1ccc(cn1)NC(=O)C AIFCHEM-5666168071 [0,0,0,0,0,1|1,0,0]=2 8 B12R1.4 COc1ccc(nc1)NC(=O)C AIFCHEM-94535588104 [0,0,0,0,0,1|1,0,0]=2 9 B12R1.4 COc1cnc(cn1)NC(=O)C AIFCHEM-94605354024 [0,0,0,0,0,1|2,0,0]=3 10 B12R1.4 CSc1ccc(cc1)C=C(C)C AIFCHEM-6350061194 [0,0,0,0,0,1|1,1,0]=3 11 B11R1.83 CC=Cc1ccc(cc1)C#N AIFCHEM-6320108023 [1,1,0,0,0,0|2,0,0]=4 12 B11R1.83 CC=Cc1ccc(nc1)OC AIFCHEM-6304788304 [1,1,0,0,0,0|1,0,0]=3 13 B11R1.83 CC=Cc1cnc(nc1)OC AIFCHEM-6405006277 [1,1,0,0,0,0|2,0,0]=4 14 B11R1.83 CC=Cc1ncc(cn1)OC AIFCHEM-6376224948 [1,1,0,0,0,0|2,0,0]=4 15 B11R1.83 CCNc1ccc(cc1)OC AIFCHEM-94577704899 [1,1,0,0,0,0|0,0,1]=3 16 B11R1.22 C/C=C(\C)/c1ccc(cc1)C AIFCHEM-94584220431 [1,1,0,0,0,0|1,0,0]=3 17 B11R1.22 C/C=C(\C)/c1ccc(nc1)O AIFCHEM-94584212304 [1,1,0,0,0,0|2,0,0]=4 18 B11R1.22 CCN(C)c1ccc(cc1)C AIFCHEM-94537423659 [1,1,0,0,0,0|2,0,0]=4 19 B11R1.22 CCN(C)c1ccc(cc1)O AIFCHEM-94520567749 [1,1,0,0,0,0|2,0,0]=4 20 B13R1.5 C#CC(=O)Nc1ccc(cc1)SC AIFCHEM-94525190848 [0,1,0,0,0,1|0,1,1]=4 21 B13R1.5 C#CC(=O)Nc1ccc(cn1)OC AIFCHEM-94525190579 [0,1,0,0,0,1|1,0,1]=4 22 B13R1.5 COc1ccc(cc1)NC(C)CO AIFCHEM-94577699851 [0,1,0,0,0,1|0,0,2]=4 23 B13R1.5 CSc1ccc(cn1)NC(=O)CO AIFCHEM-94532681260 [0,1,0,0,0,1|1,1,0]=4 24 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C#N AIFCHEM-94535597235 [0,1,0,0,0,1|2,0,0]=4 25 B13R1.35 COc1ccc(cc1Br)NC(=O)C AIFCHEM-94535593158 [0,1,0,0,0,1|0,0,0]=2 26 B13R1.35 COc1ccc(cc1F)NC(=O)C AIFCHEM-94535595845 [0,1,0,0,0,1|0,0,0]=2 27 B13R1.35 COc1ccc(nc1C)C=C(C)C AIFCHEM-6428371443 [0,1,0,0,0,1|2,0,0]=4 28 B13R1.35 COc1ncc(cc1Cl)NC(=O)C AIFCHEM-94535592042 [0,1,0,0,0,1|1,0,0]=3 29 B13R1.35 COc1ncc(cc1F)NC(=O)C AIFCHEM-5953332572 [0,1,0,0,0,1|1,0,0]=3 30 B13R1.35 COc1ncc(cc1O)C=C(C)C AIFCHEM-6295677022 [0,1,0,0,0,1|2,0,0]=4 31 B13R1.36 CC(=O)N(C)c1ccc(cc1)C#N AIFCHEM-94535596731 [0,1,0,0,0,1|2,0,0]=4 32 B13R1.36 COc1ccc(cc1)N(C)C(=O)C AIFCHEM-94605337723 [0,1,0,0,0,1|0,0,0]=2 33 B13R1.142 CC(=Cc1ccc(cc1)CCO)C AIFCHEM-6309537143 [0,1,0,0,0,1|2,0,0]=4 34 B13R1.142 CCCc1ccc(cc1)C=C(C)C AIFCHEM-6304430652 [0,1,0,0,0,1|2,0,0]=4 35 B13R1.142 CCNc1ccc(cc1)OC(=O)C AIFCHEM-94537415026 [0,1,0,0,0,1|1,0,0]=3 36 B13R1.142 CCOc1ccc(cc1)NC(=O)C AIFCHEM-6140367110 [0,1,0,0,0,1|0,0,0]=2 37 B13R1.142 CCOc1ncc(cn1)NC(=O)C AIFCHEM-94605355837 [0,1,0,0,0,1|2,0,0]=4 38 B13R1.142 CNCc1ccc(cc1)C=C(C)C AIFCHEM-5861088503 [0,1,0,0,0,1|2,0,0]=4 39 B13R1.142 COCc1ccc(cc1)NC(=O)C AIFCHEM-5883450590 [0,1,0,0,0,1|0,0,0]=2 40 B13R1.585 CC(=O)Nc1ccc(cc1)C(=S)N AIFCHEM-94605353431 [0,1,0,0,0,1|2,0,0]=4 41 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C AIFCHEM-5627058688 [0,1,0,0,0,1|1,0,0]=3 42 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C AIFCHEM-94533790707 [0,1,0,0,0,1|1,0,0]=3 43 B13R1.585 CC(=O)Nc1ccc(nc1)N(C)C AIFCHEM-94605353539 [0,1,0,0,0,1|2,0,0]=4 44 B13R1.653 COc1cc(c(cn1)C=C(C)C)F AIFCHEM-6351550836 [0,1,0,0,0,1|2,0,0]=4 45 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C AIFCHEM-94605352062 [0,1,0,0,0,1|0,0,0]=2 46 B13R1.653 COc1ccc(c(c1)C)NC(=O)C AIFCHEM-94555828642 [0,1,0,0,0,1|0,0,0]=2 47 B13R1.653 COc1cnc(c(c1)N)C=C(C)C AIFCHEM-6317177875 [0,1,0,0,0,1|2,0,0]=4 48 B13R1.653 CSc1ccc(c(c1)C)C=C(C)C AIFCHEM-6391590429 [0,1,0,0,0,1|1,1,0]=4 49 B13R1.95 C/C=C(\C)/c1ccc(cc1C)NC AIFCHEM-94584222064 [0,2,0,0,0,0|2,0,0]=4 50 B13R1.95 C/C=C(\C)/c1ccc(cc1F)OC AIFCHEM-94584218757 [0,2,0,0,0,0|1,0,0]=3 51 B13R1.95 C/C=C(\C)/c1ccc(cc1O)OC AIFCHEM-94584218405 [0,2,0,0,0,0|1,0,0]=3 52 B13R1.139 CC=Cc1ccc(cc1)C(=O)NC AIFCHEM-6328508123 [0,2,0,0,0,0|1,0,0]=3 53 B13R1.139 CC=Cc1ccc(nc1)C(=O)OC AIFCHEM-6287741204 [0,2,0,0,0,0|2,0,0]=4 54 B13R1.139 CCNc1ccc(cc1)C(=O)NC AIFCHEM-94537423740 [0,2,0,0,0,0|1,0,0]=3 55 B13R1.139 CCOc1ccc(cc1)N(C)CC AIFCHEM-94537420104 [0,2,0,0,0,0|2,0,0]=4 56 B13R1.452 CCCN(C)c1ccc(cc1)OC AIFCHEM-94569008915 [0,2,0,0,0,0|2,0,0]=4 57 B13R1.537 C/C=C(\C)/c1ccc(cc1)C(C)N AIFCHEM-94584216318 [0,2,0,0,0,0|2,0,0]=4 58 B13R1.537 C/C=C(\C)/c1ccc(cc1)N(C)C AIFCHEM-94584221172 [0,2,0,0,0,0|2,0,0]=4 59 B13R1.537 C/C=C(\C)/c1ccc(cc1)[C@@H](C)N AIFCHEM-94584220673 [0,2,0,0,0,0|2,0,0]=4 60 B13R1.537 C/C=C(\C)/c1ccc(cc1)[C@H](C)N AIFCHEM-94584212060 [0,2,0,0,0,0|2,0,0]=4 61 B13R1.537 CCN(C)c1ccc(cc1)C(=O)O AIFCHEM-94601127225 [0,2,0,0,0,0|2,0,0]=4 62 B13R1.3088 C/C=C(\C)/c1cc(c(cn1)OC)N AIFCHEM-94584212935 [0,2,0,0,0,0|2,0,0]=4 63 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)C)NC AIFCHEM-94584220162 [0,2,0,0,0,0|2,0,0]=4 64 B13R1.3088 C/C=C(\C)/c1ccc(c(n1)C)OC AIFCHEM-94584222398 [0,2,0,0,0,0|2,0,0]=4 65 B13R1.3088 C/C=C(\C)/c1ccc(c(n1)N)OC AIFCHEM-94584223710 [0,2,0,0,0,0|2,0,0]=4 66 B13R1.140 CC=Cc1ccc(cc1)S(=N)(=O)C AIFCHEM-6318230330 [0,2,0,0,0,0|2,0,0]=4 67 B13R1.144 CC=Cc1ccc(cc1F)C(=O)N AIFCHEM-6364549693 [0,2,0,0,0,0|2,0,0]=4 68 B13R1.144 CC=Cc1ccc(cc1O)C(=O)N AIFCHEM-6323486425 [0,2,0,0,0,0|2,0,0]=4 69 B13R1.74 CCCNc1ccc(cc1)C(=O)O AIFCHEM-94569015844 [0,2,0,0,0,0|2,0,0]=4 70 B13R1.74 O=C(O)c1ccc(cc1)C=CCO AIFCHEM-6312353296 [0,2,0,0,0,0|2,0,0]=4 71 B13R1.385 CC=Cc1ccc(c(c1)N)C(=O)N AIFCHEM-5641436662 [0,2,0,0,0,0|2,0,0]=4 72 B13R1.385 CC=Cc1ccc(c(c1)O)C(=O)O AIFCHEM-6333078875 [0,2,0,0,0,0|2,0,0]=4 73 B13R2.1279 CC(=Cc1ccc2c(c1)CC2)C AIFCHEM-6350037789 [0,0,0,1,0,1|2,0,0]=4 74 B11R1.20 CC(=O)Nc1ccc(cn1)C AIFCHEM-5874295902 [1,0,0,0,0,1|1,0,0]=3 75 B11R1.20 CC(=O)Nc1cnc(nc1)C AIFCHEM-94535596160 [1,0,0,0,0,1|2,0,0]=4 76 B13R1.3 CC(=O)NCc1ccc(cc1)C#N AIFCHEM-94535592120 [0,0,0,0,0,2|2,0,0]=4 77 B13R1.3 CCc1ccc(cc1)CNC(=O)C AIFCHEM-94605355910 [0,0,0,0,0,2|1,0,0]=3 78 B13R1.3 COc1ccc(cc1)NCC(C)C AIFCHEM-94577704988 [0,0,0,0,0,2|1,0,1]=4