0  B13R1.148  CC(O)C(=O)Nc1cccc(c1)F AIFCHEM-94540231464 [0,0,1,0,0,0|0,0,2]=3
1  B13R1.148  C[C@@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579355466 [0,0,1,0,0,0|0,0,2]=3
2  B13R1.148  C[C@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579363490 [0,0,1,0,0,0|0,0,2]=3
3  B13R1.2872  CCC(=O)Nc1cc(ccc1Br)F AIFCHEM-94526498880 [0,0,1,0,0,0|2,0,1]=4
4  B13R1.2872  Cc1ccc(cc1NC(=O)CO)Br AIFCHEM-94532682233 [0,0,1,0,0,0|0,1,2]=4
5  B13R1.2872  Cc1ccc(cc1NC(=O)CO)Cl AIFCHEM-94528740326 [0,0,1,0,0,0|0,1,2]=4
6  B13R1.2872  Cc1ccc(cc1NC(=O)CO)F AIFCHEM-94532681982 [0,0,1,0,0,0|0,0,2]=3
7  B13R1.2872  O=C(CO)Nc1cc(ccc1Br)F AIFCHEM-94532674085 [0,0,1,0,0,0|1,0,1]=3
8  B13R1.2872  O=C(CO)Nc1cc(ccc1Cl)Br AIFCHEM-94532684117 [0,0,1,0,0,0|1,1,1]=4
9  B13R1.2872  O=C(CO)Nc1cc(ccc1F)Br AIFCHEM-94532681177 [0,0,1,0,0,0|1,1,1]=4
10  B13R1.2872  O=C(CO)Nc1cc(ccc1I)F AIFCHEM-94532680749 [0,0,1,0,0,0|1,0,1]=3
11  B13R1.2872  O=C(CO)Nc1cc(ccc1O)Br AIFCHEM-94532682433 [0,0,1,0,0,0|1,1,1]=4
12  B13R1.2872  O=C(CO)Nc1cc(ccc1O)Cl AIFCHEM-94532687440 [0,0,1,0,0,0|1,1,1]=4
13  B13R1.2872  O=C(CO)Nc1cc(ccc1O)O AIFCHEM-94523922057 [0,0,1,0,0,0|2,0,1]=4
14  B12R1.50  C#CC(=O)Nc1cccc(c1)F AIFCHEM-94579361398 [1,0,1,0,0,0|0,0,2]=4
15  B12R1.127  CC(=O)Nc1cc(ccc1I)F AIFCHEM-94535594622 [1,0,1,0,0,0|1,0,1]=4
16  B12R1.112  CC=Cc1ccc(cc1C=O)F AIFCHEM-6325996018 [1,0,1,0,0,0|1,0,0]=3
17  B12R1.112  CC=Cc1ccc(cc1C=O)O AIFCHEM-6326993859 [1,0,1,0,0,0|2,0,0]=4
18  B12R1.371  O=C(CO)Nc1ccccc1I AIFCHEM-94532684184 [1,0,1,0,0,0|1,0,1]=4
19  B14R1.135  CCC(O)C(=O)Nc1cccc(c1)F AIFCHEM-94579362383 [0,1,1,0,0,0|0,0,2]=4
20  B14R1.135  CC[C@@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579358827 [0,1,1,0,0,0|0,0,2]=4
21  B14R1.135  CC[C@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579360505 [0,1,1,0,0,0|0,0,2]=4
22  B14R1.4257  CC(O)C(=O)Nc1cc(cc(c1)F)O AIFCHEM-94540224744 [0,1,1,0,0,0|0,0,2]=4
23  B14R1.4474  CC(O)C(=O)Nc1cc(ccc1I)F AIFCHEM-94540230179 [0,1,1,0,0,0|0,0,2]=4
24  B14R1.6721  CC=Cc1ncc(cc1NC(=O)C)F AIFCHEM-35985294431 [0,1,1,0,0,0|2,0,0]=4
25  B14R1.950  COCC(=O)Nc1cc(ccc1O)F AIFCHEM-94535391645 [0,1,1,0,0,0|1,0,1]=4
26  B14R1.5978  CC(O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579360197 [0,0,1,0,0,1|0,0,2]=4
27  B14R1.5978  C[C@@H](O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579362559 [0,0,1,0,0,1|0,0,2]=4
28  B14R1.5978  C[C@H](O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579362498 [0,0,1,0,0,1|0,0,2]=4
29  B14R1.820  Cc1ccc(cc1CNC(=O)CO)F AIFCHEM-94532680828 [0,0,1,0,0,1|0,0,2]=4
30  B14R1.820  O=C(CO)NCc1cc(ccc1Cl)F AIFCHEM-5829808597 [0,0,1,0,0,1|1,0,1]=4
31  B14R1.820  O=C(CO)NCc1cc(ccc1O)F AIFCHEM-94532675221 [0,0,1,0,0,1|1,0,1]=4