0  B12R2.252  c1coc2c1[nH]c(c2)C(=O)O ICA-0171 [0,0,0,0,0,0|0,1,0]=1
1  B12R2.252  c1csc2c1[nH]c(c2)C(=O)O ICA-0170 [0,0,0,0,0,0|0,0,0]=0
2  B12R2.252  c1csc2c1sc(c2)C(=O)O MIX-0117 [0,0,0,0,0,0|1,0,0]=1
3  B13R2.400  Cc1cc2c(o1)cc([nH]2)C(=O)O ICA-0172 [0,1,0,0,0,0|0,1,0]=2
4  B13R2.400  Cc1cc2c(s1)cc([nH]2)C(=O)O ICA-0182 [0,1,0,0,0,0|0,0,0]=1
5  B13R2.531  COC(=O)c1cc2c([nH]1)cco2 MIX-0593 [0,1,0,0,0,0|0,1,0]=2
6  B13R2.531  COC(=O)c1cc2c([nH]1)ccs2 MIX-0595 [0,1,0,0,0,0|0,0,0]=1
7  B13R2.435  c1ccn2c(c1)cc(n2)C(=O)O MIX-0614 [0,0,0,0,0,1|2,0,1]=4
8  B13R2.435  c1ccn2cc(nc2c1)C(=O)O 2IP-0002 [0,0,0,0,0,1|2,0,1]=4
9  B13R2.435  c1cnc2nc(cn2c1)C(=O)O MIX-0587 [0,0,0,0,0,1|2,0,1]=4
10  B10R1.66  c1cc(sc1)\C=C\C(=O)O MIX-0404 [1,0,1,0,0,0|0,0,0]=2
11  B14R2.601  c1cc2c(cc1C(=O)O)sc(n2)N ABT-0060 [0,1,0,0,0,1|2,0,0]=4
12  B14R2.601  c1cc2c(cc1C(=O)O)sc(n2)N ABT-0060 [0,1,0,0,0,1|2,0,0]=4
13  B14R2.450  c1ccc2c(c1)c(c(s2)C(=O)O)Cl MIX-0400 [0,1,0,0,0,1|2,0,0]=4
14  B14R2.4529  Cc1ccc2c(c1)cc([nH]2)C(=O)O ICA-0044 [0,1,0,0,0,1|1,0,0]=3
15  B14R2.4529  Cc1ccc2cc([nH]c2c1)C(=O)O ICA-0082 [0,1,0,0,0,1|1,0,0]=3
16  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)Br ICA-0072 [0,1,0,0,0,1|1,0,0]=3
17  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)Cl ICA-0073 [0,1,0,0,0,1|1,0,0]=3
18  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)F ICA-0079 [0,1,0,0,0,1|1,0,0]=3
19  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)I ICA-0114 [0,1,0,0,0,1|1,0,0]=3
20  B14R2.4529  c1cc(cc2c1cc(s2)C(=O)O)Cl MIX-0565 [0,1,0,0,0,1|2,0,0]=4
21  B14R2.4529  c1cc(cc2c1cc(s2)C(=O)O)F MIX-0556 [0,1,0,0,0,1|2,0,0]=4
22  B14R2.4529  c1cc2c(cc1Br)cc([nH]2)C(=O)O ICA-0027 [0,1,0,0,0,1|1,0,0]=3
23  B14R2.4529  c1cc2c(cc1N)cc(s2)C(=O)O MIX-0602 [0,1,0,0,0,1|2,0,0]=4
24  B14R2.7969  Cc1cccc2c1[nH]c(c2)C(=O)O ICA-0043 [0,1,0,0,0,1|1,0,0]=3
25  B14R2.7969  Cc1cccc2c1cc([nH]2)C(=O)O ICA-0081 [0,1,0,0,0,1|1,0,0]=3
26  B14R2.7969  c1cc2c(cc([nH]2)C(=O)O)c(c1)Br ICA-0071 [0,1,0,0,0,1|1,0,0]=3
27  B14R2.7969  c1cc2c(cc([nH]2)C(=O)O)c(c1)Cl ICA-0074 [0,1,0,0,0,1|1,0,0]=3
28  B14R2.7969  c1cc2c(cc([nH]2)C(=O)O)c(c1)F ICA-0075 [0,1,0,0,0,1|1,0,0]=3
29  B14R2.7969  c1cc2cc([nH]c2c(c1)Cl)C(=O)O ICA-0015 [0,1,0,0,0,1|1,0,0]=3
30  B14R2.7969  c1cc2cc([nH]c2c(c1)F)C(=O)O ICA-0017 [0,1,0,0,0,1|1,0,0]=3
31  B14R2.10815  Cc1cc2c(o1)cc([nH]2)C(=O)OC MIX-0592 [0,2,0,0,0,0|0,1,0]=3
32  B10R1.23  c1cc(sc1)C(C(=O)O)N AAA-0365 [0,0,1,0,1,0|0,0,1]=3
33  B12R1.125  Cc1ccccc1\C=C\C(=O)O MIX-0402 [0,0,1,0,0,1|2,0,0]=4
34  B12R1.125  c1ccc(c(c1)\C=C\C(=O)O)F MIX-0419 [0,0,1,0,0,1|2,0,0]=4
35  B12R1.226  Cc1cccc(c1)\C=C\C(=O)O MIX-0421 [0,0,1,0,0,1|2,0,0]=4
36  B12R1.226  c1cc(cc(c1)I)\C=C\C(=O)O MIX-0829 [0,0,1,0,0,1|2,0,0]=4