0  B14R2.8239  Cc1ccc2c(c1)NC(=O)[C@H](O2)C 64R [0,0,0,0,0,0|3,0,1]=4
1  B13R2.155  c1cc2c(cc1Br)NC(=O)CN2 5GU [1,0,0,0,0,0|1,1,1]=4
2  B13R2.155  c1cc2c(cc1Cl)NC(=O)CO2 KJU [1,0,0,0,0,0|1,1,1]=4
3  B13R2.155  c1cc2c(cc1O)OC(=O)C=C2 07L [1,0,0,0,0,0|2,0,0]=3
4  B13R2.369  CC1=Cc2ccccc2NC1=O J5I [1,0,0,0,0,0|1,0,0]=2
5  B13R2.369  CN1Cc2ccccc2NC1=O 3PF [1,0,0,0,0,0|2,0,1]=4
6  B13R2.369  C[C@H]1C(=O)Nc2ccccc2N1 5QY [1,0,0,0,0,0|2,0,1]=4
7  B13R2.369  c1ccc2c(c1)C=C(C(=O)N2)O G3E [1,0,0,0,0,0|0,0,0]=1
8  B13R2.369  c1ccc2c(c1)C=C(C(=O)O2)O SE2 [1,0,0,0,0,0|1,0,0]=2
9  B13R2.3683  c1cc2c(cc1O)C=CC(=S)O2 FC5 [1,0,0,0,0,0|3,0,0]=4
10  B15R2.1754  c1cc2c(cc1O)OC(=O)C(=C2)C#N 3QV [0,1,0,0,0,0|3,0,0]=4
11  B13R1.133  c1cc(ccc1/C=C(\C(=O)[O-])/F)O FHC [0,0,1,0,0,0|3,0,0]=4
12  B13R1.133  c1cc(ccc1\C=C(/C(=O)O)\O)O EN1 [0,0,1,0,0,0|2,0,0]=3
13  B13R1.133  c1cc(ccc1\C=C(/C(=O)O)\S)Cl 2UB [0,0,1,0,0,0|1,2,0]=4
14  B13R2.3028  c1cc2c(cc1Cl)C(=O)C(=O)N2 2HQ [0,0,0,0,1,0|1,1,1]=4
15  B12R1.21  c1cc(ccc1/C=C/C(=O)O)O HC4 [1,0,1,0,0,0|2,0,0]=4
16  B12R1.43  C\C(=C/c1ccccc1)\C(=O)O 4LV [1,0,1,0,0,0|2,0,0]=4
17  B12R1.43  c1ccc(cc1)/C=C(/C(=O)O)\N 23F [1,0,1,0,0,0|2,0,0]=4
18  B12R1.43  c1ccc(cc1)CC(=O)C(=O)O 1PY [1,0,1,0,0,0|2,0,0]=4
19  B12R1.43  c1ccc(cc1)CC(=O)C(=O)O PPY [1,0,1,0,0,0|2,0,0]=4
20  B12R1.43  c1ccc(cc1)\C=C(\C(=O)O)/F 4LW [1,0,1,0,0,0|2,0,0]=4
21  B12R2.24  c1ccc2c(c1)C=CC(=O)N2 OCH [2,0,0,0,0,0|0,0,0]=2
22  B12R2.24  c1ccc2c(c1)C=CC(=O)O2 COU [2,0,0,0,0,0|1,0,0]=3
23  B12R2.24  c1ccc2c(c1)cc(cn2)N 4FS [2,0,0,0,0,0|1,0,1]=4
24  B12R2.24  c1ccc2c(c1)ccc(n2)N 2AQ [2,0,0,0,0,0|1,0,1]=4
25  B12R2.24  c1ccc2cc(ccc2c1)O 03V [2,0,0,0,0,0|1,0,0]=3
26  B14R2.29365  CC1=CC(=O)Oc2c1ccc(c2)N MCM [1,1,0,0,0,0|2,0,0]=4
27  B14R2.29365  CC1=CC(=O)Oc2c1ccc(c2)O 4MU [1,1,0,0,0,0|2,0,0]=4
28  B14R2.8188  CC1=C(C(=O)c2ccccc2N1)O HQD [1,1,0,0,0,0|1,0,0]=3
29  B14R2.8188  c1ccc2c(c1)CC(=O)N(C2=O)O 0N7 [1,1,0,0,0,0|2,0,0]=4
30  B16R2.23521  c1cc(cc2c1cc(c(c2)C(=O)O)O)O BIK [0,2,0,0,0,0|2,0,0]=4
31  B12R1.225  c1cc(cc(c1)O)C(=O)C(=O)O A29 [0,0,1,0,1,0|2,0,0]=4
32  B12R2.606  c1cc2c(cc1Br)NC(=O)C2 1P8 [1,0,0,0,1,0|0,1,1]=4
33  B12R2.606  c1cc2c(cc1Cl)NC(=O)C2 ES2 [1,0,0,0,1,0|0,1,1]=4
34  B12R2.606  c1cc2c(cc1Cl)NC(=O)O2 CLW [1,0,0,0,1,0|1,1,0]=4
35  B12R2.606  c1cc2c(cc1F)[nH]c(n2)N ET2 [1,0,0,0,1,0|2,0,0]=4
36  B12R2.18  c1ccc2c(c1)C(=O)C(=O)N2 ISN [1,0,0,0,1,0|0,0,1]=3