0 B12R1.77 C/C=C(\C)/c1ccccc1OC AIFCHEM-94584219949 [1,0,0,0,0,0|3,0,0]=4 1 B12R1.283 CC=Cc1ccccc1C(C)O AIFCHEM-6288711231 [1,0,0,0,0,0|3,0,0]=4 2 B12R1.283 CC=Cc1ccccc1[C@@H](C)O AIFCHEM-6346903517 [1,0,0,0,0,0|3,0,0]=4 3 B12R1.283 CC=Cc1ccccc1[C@H](C)O AIFCHEM-6312488097 [1,0,0,0,0,0|3,0,0]=4 4 B12R1.283 CCNc1ccccc1C(C)C AIFCHEM-94537423981 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.283 CCNc1ccccc1N(C)C AIFCHEM-94537419712 [1,0,0,0,0,0|2,0,0]=3 6 B14R1.745 C/C=C(\C)/c1ccccc1C(C)(C)C AIFCHEM-94584221267 [0,1,0,0,0,0|3,0,0]=4 7 B14R1.745 C/C=C(\C)/c1ccccc1C(C)(C)O AIFCHEM-94584221265 [0,1,0,0,0,0|3,0,0]=4 8 B14R2.10655 C/C=C(\C)/c1ccccc1C2CC2 AIFCHEM-94531037447 [0,0,0,1,0,0|3,0,0]=4 9 B14R1.744 CNC(=O)c1ccccc1NC(=O)C AIFCHEM-5612530178 [0,0,0,0,0,1|3,0,0]=4 10 B14R1.744 COC(=O)c1ccccc1C=C(C)C AIFCHEM-94545894680 [0,0,0,0,0,1|1,0,0]=2 11 B14R1.744 COC(=O)c1ncncc1C=C(C)C AIFCHEM-6353497503 [0,0,0,0,0,1|3,0,0]=4 12 B14R1.3302 C#CC(=O)Nc1ccccc1C(C)C AIFCHEM-94525200867 [0,0,0,0,0,1|2,0,1]=4 13 B14R1.3302 CC(C)c1ccccc1NC(=O)CO AIFCHEM-94532684519 [0,0,0,0,0,1|3,0,0]=4 14 B11R1.41 CC=Cc1cccnc1NC AIFCHEM-5624892479 [2,0,0,0,0,0|2,0,0]=4 15 B13R1.382 CC=Cc1ncccc1C(=O)OC AIFCHEM-94589200249 [1,1,0,0,0,0|2,0,0]=4 16 B13R1.382 CCNc1ccncc1C(=O)OC AIFCHEM-94537416296 [1,1,0,0,0,0|1,0,0]=3 17 B13R1.381 CC=Cc1ccccc1C(C)(C)N AIFCHEM-5734713739 [1,1,0,0,0,0|2,0,0]=4 18 B13R1.572 CCNCc1ccccc1N(C)C AIFCHEM-94537423097 [1,1,0,0,0,0|1,0,1]=4 19 B13R1.572 CN(C)c1ccccc1C=CCO AIFCHEM-6474240917 [1,1,0,0,0,0|1,0,0]=3 20 B13R1.553 C/C=C(\C)/c1ccoc1C(=O)OC AIFCHEM-94584220185 [0,1,0,0,1,0|2,0,0]=4 21 B13R1.553 C/C=C(\C)/c1occc1C(=O)OC AIFCHEM-94584215190 [0,1,0,0,1,0|2,0,0]=4 22 B13R1.553 C/C=C(\C)/c1sccc1C(=O)OC AIFCHEM-94584221717 [0,1,0,0,1,0|2,0,0]=4 23 B15R1.810 CCOC(=O)c1cccnc1C=C(C)C AIFCHEM-6485185017 [0,1,0,0,0,1|2,0,0]=4 24 B15R1.925 COC(=O)c1cc(=O)[nH]cc1C=C(C)C AIFCHEM-6319571646 [0,1,0,0,0,1|2,0,0]=4 25 B15R1.925 COC(=O)c1cc(ccc1NC(=O)C)Br AIFCHEM-6155487072 [0,1,0,0,0,1|2,0,0]=4 26 B15R1.925 COC(=O)c1cc(ccc1NC(=O)C)O AIFCHEM-94535593105 [0,1,0,0,0,1|2,0,0]=4 27 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)C AIFCHEM-6340567240 [0,1,0,0,0,1|1,0,0]=3 28 B15R1.11677 COC(=O)c1ccc(cc1C=C(C)C)N AIFCHEM-6160849299 [0,1,0,0,0,1|1,0,0]=3 29 B15R1.11677 COC(=O)c1ccc(cc1NC(=O)C)Cl AIFCHEM-5690621718 [0,1,0,0,0,1|2,0,0]=4 30 B15R1.11746 COC(=O)c1c(cccc1C=C(C)C)O AIFCHEM-6341126679 [0,1,0,0,0,1|1,0,0]=3 31 B15R1.2996 CCC(=O)Nc1ccc(cc1C(C)C)Br AIFCHEM-94526510612 [0,1,0,0,0,1|2,0,0]=4 32 B15R1.2996 CCC(=O)Nc1ccc(cc1C(C)C)F AIFCHEM-94526501713 [0,1,0,0,0,1|2,0,0]=4 33 B15R1.812 C/C=C(\C)/c1ncccc1C(=O)OCC AIFCHEM-94584219391 [0,2,0,0,0,0|2,0,0]=4 34 B15R1.1239 C#CCNC(=O)c1ccccc1C(C)C AIFCHEM-94588317312 [0,2,0,0,0,0|2,0,0]=4 35 B15R1.1239 CCCNC(=O)c1ccccc1C(C)C AIFCHEM-94521376719 [0,2,0,0,0,0|2,0,0]=4 36 B15R1.1239 CCCNC(=O)c1cnccc1N(C)C AIFCHEM-5875661184 [0,2,0,0,0,0|2,0,0]=4 37 B15R1.38521 C/C=C(\C)/c1cc(ccc1C(=O)OC)F AIFCHEM-94584211755 [0,2,0,0,0,0|1,0,0]=3 38 B15R1.38521 C/C=C(\C)/c1cc(ccc1C(=O)OC)O AIFCHEM-94584208954 [0,2,0,0,0,0|1,0,0]=3 39 B15R1.38521 C/C=C(\C)/c1cc(cnc1C(=O)OC)F AIFCHEM-94584210966 [0,2,0,0,0,0|2,0,0]=4 40 B15R1.38521 C/C=C(\C)/c1ccc(cc1C(=O)OC)C AIFCHEM-94584209233 [0,2,0,0,0,0|1,0,0]=3 41 B15R1.38521 C/C=C(\C)/c1ccc(nc1C(=O)OC)O AIFCHEM-94584210976 [0,2,0,0,0,0|2,0,0]=4 42 B15R2.16320 CN(C)c1ccccc1C=C2CCC2 AIFCHEM-6399760053 [0,0,0,1,0,1|2,0,0]=4 43 B15R2.19516 CCC(=O)Nc1ccccc1C2CC2 AIFCHEM-94545450737 [0,0,0,1,0,1|2,0,0]=4 44 B15R2.1221 CN(C)c1ccccc1C2=CCOC2 AIFCHEM-6474148980 [0,1,0,1,0,0|1,0,0]=3 45 B15R2.1221 CN(C)c1ncccc1C2=CCOC2 AIFCHEM-6451700214 [0,1,0,1,0,0|2,0,0]=4