0 B12R1.75 CC(=Cc1cccnc1C=O)C AIFCHEM-6375816642 [1,0,0,0,0,0|3,0,0]=4 1 B12R1.75 CC(=O)Nc1cccnc1CO AIFCHEM-94535597140 [1,0,0,0,0,0|2,0,1]=4 2 B12R1.75 COc1ccccc1NC(=O)C AIFCHEM-94535590793 [1,0,0,0,0,0|3,0,0]=4 3 B12R1.75 CSc1ccccc1NC(=O)C AIFCHEM-5786942629 [1,0,0,0,0,0|3,0,0]=4 4 B12R1.283 CC=Cc1ccccc1C(C)O AIFCHEM-6288711231 [1,0,0,0,0,0|2,0,1]=4 5 B12R1.283 CC=Cc1ccccc1[C@@H](C)O AIFCHEM-6346903517 [1,0,0,0,0,0|2,0,1]=4 6 B12R1.283 CC=Cc1ccccc1[C@H](C)O AIFCHEM-6312488097 [1,0,0,0,0,0|2,0,1]=4 7 B12R1.283 CC=Cc1cnccc1C(=O)N AIFCHEM-6400340262 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.283 CCNc1cnccc1C(=O)O AIFCHEM-94537425147 [1,0,0,0,0,0|2,0,1]=4 9 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)C)C AIFCHEM-6249629739 [0,1,0,0,0,0|2,0,0]=3 10 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)C)F AIFCHEM-5692781909 [0,1,0,0,0,0|2,0,0]=3 11 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Cl AIFCHEM-94605354519 [0,1,0,0,0,0|2,0,0]=3 12 B14R1.429 CC(=O)c1ccccc1N(C)C(=O)C AIFCHEM-94535593041 [0,1,0,0,0,0|2,0,0]=3 13 B14R1.744 CNC(=O)c1ccccc1NC(=O)C AIFCHEM-5612530178 [0,1,0,0,0,0|2,0,0]=3 14 B14R1.744 COC(=O)c1ccccc1C=C(C)C AIFCHEM-94545894680 [0,1,0,0,0,0|2,0,0]=3 15 B14R1.3302 CCN(C)Cc1ccccc1C(=O)O AIFCHEM-94563255386 [0,1,0,0,0,0|3,0,0]=4 16 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F AIFCHEM-94605339811 [0,1,0,0,0,0|2,0,0]=3 17 B14R1.6074 CC(=Cc1ccc(cc1C(=O)N)F)C AIFCHEM-6299328016 [0,1,0,0,0,0|3,0,0]=4 18 B12R1.392 CC(=O)Nc1sccc1C(=O)C AIFCHEM-94535600578 [0,0,0,0,1,0|3,0,0]=4 19 B14R1.814 CC(=Cc1ccccc1CC(=O)N)C AIFCHEM-6368778029 [0,0,0,0,0,1|3,0,0]=4 20 B14R1.4522 CC(C)NCc1ccccc1C(=O)O AIFCHEM-94520536914 [0,0,0,0,0,1|2,0,1]=4 21 B11R1.86 CC(=O)Nc1ccccc1C AIFCHEM-94578149958 [2,0,0,0,0,0|1,0,1]=4 22 B11R1.86 CC(=O)Nc1ccccc1F AIFCHEM-6022739701 [2,0,0,0,0,0|2,0,0]=4 23 B11R1.86 CC(=O)Nc1ccccc1I AIFCHEM-94605354755 [2,0,0,0,0,0|2,0,0]=4 24 B11R1.86 CC(=O)Nc1ccccc1O AIFCHEM-94605355387 [2,0,0,0,0,0|1,0,0]=3 25 B11R1.86 CC(=O)Nc1cnccc1O AIFCHEM-94605354960 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.51 CC(=Cc1ccc(cc1C=O)F)C AIFCHEM-6443662225 [1,1,0,0,0,0|2,0,0]=4 27 B13R1.51 CC(=Cc1ccc(cc1C=O)O)C AIFCHEM-6378391178 [1,1,0,0,0,0|2,0,0]=4 28 B13R1.115 CC(=Cc1cccc(c1C=O)C)C AIFCHEM-6415859396 [1,1,0,0,0,0|2,0,0]=4 29 B13R1.3089 CC(=Cc1cc(ccc1C=O)O)C AIFCHEM-6378110403 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.141 CCNc1ccc(cc1C(=O)O)C AIFCHEM-94537419843 [1,1,0,0,0,0|1,0,1]=4 31 B13R1.141 CCNc1ccc(cc1C(=O)O)Cl AIFCHEM-94537423869 [1,1,0,0,0,0|1,0,1]=4 32 B13R1.141 CCNc1ccc(cc1C(=O)O)F AIFCHEM-94537421741 [1,1,0,0,0,0|1,0,1]=4 33 B13R1.141 CCNc1ccc(cc1C(=O)O)O AIFCHEM-94537421126 [1,1,0,0,0,0|1,0,1]=4 34 B13R1.381 CC=Cc1ccccc1S(=O)(=O)O AIFCHEM-6313472469 [1,1,0,0,0,0|2,0,0]=4 35 B13R1.382 CC=Cc1ncccc1C(=O)OC AIFCHEM-94589200249 [1,1,0,0,0,0|2,0,0]=4 36 B13R1.547 C/C=C(\C)/c1ncccc1C(=O)O AIFCHEM-94584217770 [1,1,0,0,0,0|2,0,0]=4 37 B13R1.572 CCNCc1ccccc1C(=O)O AIFCHEM-94588821659 [1,1,0,0,0,0|1,0,1]=4 38 B13R1.551 COC(=O)c1cscc1NC(=O)C AIFCHEM-5685323257 [0,1,0,0,1,0|2,0,0]=4 39 B15R1.3845 CC(=Cc1ccccc1NC(=O)CO)C AIFCHEM-95037247073 [0,1,0,0,0,1|2,0,0]=4 40 B15R1.91 COc1ccc(c(c1)NC(=O)C)C(=O)C AIFCHEM-94535596451 [0,2,0,0,0,0|2,0,0]=4 41 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)C AIFCHEM-6340567240 [0,2,0,0,0,0|2,0,0]=4 42 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)N AIFCHEM-6160849299 [0,2,0,0,0,0|2,0,0]=4 43 B15R1.11677 COC(=O)c1ccc(cc1NC(=O)C)Cl AIFCHEM-5690621718 [0,2,0,0,0,0|1,0,0]=3 44 B15R1.11677 COC(=O)c1ncc(cc1NC(=O)C)Br AIFCHEM-6112345467 [0,2,0,0,0,0|2,0,0]=4 45 B15R1.925 CNC(=O)c1cc(ccc1NC(=O)C)Br AIFCHEM-94535590292 [0,2,0,0,0,0|2,0,0]=4 46 B15R1.925 COC(=O)c1cc(ccc1NC(=O)C)Br AIFCHEM-6155487072 [0,2,0,0,0,0|1,0,0]=3 47 B15R1.925 COC(=O)c1cc(ccc1NC(=O)C)O AIFCHEM-94535593105 [0,2,0,0,0,0|1,0,0]=3 48 B15R1.925 COC(=O)c1nc(ccc1NC(=O)C)C AIFCHEM-6090453365 [0,2,0,0,0,0|2,0,0]=4 49 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)O AIFCHEM-6341126679 [0,2,0,0,0,0|2,0,0]=4 50 B15R2.1106 CC(=O)Nc1cccc2c1oc(=O)[nH]2 AIFCHEM-94535599708 [0,0,0,1,0,1|2,0,0]=4 51 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)C AIFCHEM-5894380099 [0,0,0,0,1,1|2,0,0]=4