0  B12R1.43  CC(=Cc1ccccc1)[N+](=O)[O-] CM13917 [0,0,0,0,0,0|2,0,2]=4
1  B11R1.91  CC(=O)COc1ccccc1 CM11227 [1,0,0,0,0,0|2,0,1]=4
2  B13R2.435  c1cc2cc(sc2nc1)C(=O)O CM10774 [0,0,0,1,0,0|1,1,1]=4
3  B13R2.435  c1cncc2c1sc(c2)C(=O)O CM10782 [0,0,0,1,0,0|1,1,1]=4
4  B12R1.49  COC(=O)Cc1ccc(cc1)O CM13716 [1,1,0,0,0,0|2,0,0]=4
5  B12R1.50  COC(=O)Cc1cccc(c1)F CM13702 [1,1,0,0,0,0|2,0,0]=4
6  B12R1.50  COC(=O)Cc1cccc(c1)N CM13647 [1,1,0,0,0,0|2,0,0]=4
7  B12R1.21  c1cc(ncc1C=CC(=O)O)N CM11013 [1,1,0,0,0,0|1,0,1]=4
8  B12R1.27  COC(=O)CCc1ccccc1 CM13745 [1,1,0,0,0,0|0,0,1]=3
9  B12R1.107  CC(c1ccccc1)NC(=O)C CM11017 [1,1,0,0,0,0|2,0,0]=4
10  B12R1.125  c1ccc(c(c1)CCC(=O)O)Br CM13747 [1,1,0,0,0,0|0,0,1]=3
11  B12R1.226  c1cc(cc(c1)Br)C=CC(=O)O CM13573 [1,1,0,0,0,0|0,0,1]=3
12  B14R1.4257  c1c(cc(cc1F)F)C[C@@H](C(=O)O)N CM13813 [0,2,0,0,0,0|1,0,1]=4
13  B12R2.24  c1ccc2c(c1)[nH]c(=O)cn2 CM14099 [1,0,0,1,0,0|2,0,0]=4
14  B14R2.768  c1ccc2c(c1)cc([nH]2)CC(=O)O CM14084 [0,0,0,1,0,1|1,0,1]=4
15  B14R2.4529  Cc1ccc2c(c1)cc([nH]2)C(=O)O CM13617 [0,1,0,1,0,0|1,0,1]=4
16  B14R2.4529  Cc1ccc2cc(sc2c1)C(=O)O CM13912 [0,1,0,1,0,0|0,1,1]=4
17  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)Br CM13591 [0,1,0,1,0,0|1,0,1]=4
18  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)F CM13608 [0,1,0,1,0,0|1,0,1]=4
19  B14R2.4529  c1cc(cc2c1cc(o2)C(=O)O)Br CM10749 [0,1,0,1,0,0|0,0,2]=4
20  B14R2.4529  c1cc(cc2c1cc(s2)C(=O)O)Br CM10506 [0,1,0,1,0,0|0,1,1]=4
21  B14R2.4529  c1cc2c(cc1Br)cc(o2)C(=O)O CM10748 [0,1,0,1,0,0|0,0,2]=4
22  B14R2.4529  c1cc2c(cc1Br)cc(s2)C(=O)O CM10713 [0,1,0,1,0,0|0,1,1]=4
23  B14R2.4529  c1cc2c(cc1Cl)cc(o2)C(=O)O CM10766 [0,1,0,1,0,0|0,0,2]=4
24  B14R2.4529  c1cc2c(cc1Cl)cc(s2)C(=O)O CM10714 [0,1,0,1,0,0|0,1,1]=4
25  B14R2.4529  c1cc2c(cc1F)cc([nH]2)C(=O)O CM13610 [0,1,0,1,0,0|1,0,1]=4
26  B14R2.4529  c1cc2c(cc1F)cc(o2)C(=O)O CM10767 [0,1,0,1,0,0|0,0,2]=4
27  B14R2.4529  c1cc2c(cc1F)cc(s2)C(=O)O CM10715 [0,1,0,1,0,0|0,1,1]=4
28  B14R2.7969  Cc1cccc2c1cc(s2)C(=O)O CM10546 [0,1,0,1,0,0|0,1,1]=4
29  B14R2.7969  Cc1cccc2c1sc(c2)C(=O)O CM10716 [0,1,0,1,0,0|0,1,1]=4
30  B14R2.7969  c1cc(c2cc(sc2c1)C(=O)O)F CM10720 [0,1,0,1,0,0|0,1,1]=4
31  B14R2.7969  c1cc2c(cc(s2)C(=O)O)c(c1)Br CM10718 [0,1,0,1,0,0|0,1,1]=4
32  B14R2.7969  c1cc2cc([nH]c2c(c1)Cl)C(=O)O CM13596 [0,1,0,1,0,0|1,0,1]=4
33  B14R2.7969  c1cc2cc(sc2c(c1)Br)C(=O)O CM10717 [0,1,0,1,0,0|0,1,1]=4
34  B14R2.7969  c1cc2cc(sc2c(c1)F)C(=O)O CM10719 [0,1,0,1,0,0|0,1,1]=4
35  B10R1.15  c1ccc(cc1)C(=O)CF CM11196 [1,0,0,0,1,0|1,0,1]=4
36  B12R1.252  c1ccc(cc1)COCC(=O)O CM13869 [1,0,0,0,0,1|0,0,1]=3