0  B14R2.20  Cc1ccc(cc1)c2csc(n2)N A2Z00097830 [0,0,0,0,0,0|1,1,2]=4
1  B14R2.20  c1cc(ccc1C2CNC(=O)O2)Br A2Z00049290 [0,0,0,0,0,0|3,1,0]=4
2  B14R2.20  c1cc(ccc1C2CNC(=O)O2)Cl A2Z00049232 [0,0,0,0,0,0|3,0,0]=3
3  B14R2.20  c1cc(ccc1c2[nH]nc(n2)N)Cl A2Z00087326 [0,0,0,0,0,0|2,0,1]=3
4  B14R2.20  c1cc(ccc1c2cc([nH]n2)N)Cl A2Z00095254 [0,0,0,0,0,0|3,0,1]=4
5  B14R2.20  c1cc(ccc1c2cc(on2)N)Br A2Z00083461 [0,0,0,0,0,0|2,1,1]=4
6  B14R2.20  c1cc(ccc1c2cc(on2)N)Cl A2Z00083542 [0,0,0,0,0,0|2,0,1]=3
7  B14R2.20  c1cc(ccc1c2cc(on2)N)F A2Z00007008 [0,0,0,0,0,0|2,1,1]=4
8  B14R2.20  c1cc(ccc1c2csc(n2)N)Br A2Z00076317 [0,0,0,0,0,0|0,2,2]=4
9  B14R2.20  c1cc(ccc1c2csc(n2)N)Cl A2Z00050854 [0,0,0,0,0,0|0,1,2]=3
10  B14R2.20  c1cc(ccc1c2csc(n2)N)Cl A2Z00098005 [0,0,0,0,0,0|0,1,2]=3
11  B14R2.20  c1cc(ccc1c2nc(no2)N)Cl A2Z00009316 [0,0,0,0,0,0|2,0,1]=3
12  B13R2.10  c1ccc(cc1)c2cc(on2)N A2Z00083397 [1,0,0,0,0,0|2,0,1]=4
13  B13R2.10  c1ccc(cc1)c2csc(n2)N A2Z00070573 [1,0,0,0,0,0|0,1,2]=4
14  B13R2.10  c1ccc(cc1)c2nc(no2)N A2Z00009352 [1,0,0,0,0,0|2,0,1]=4
15  B15R2.275  c1cc(ccc1c2nc(on2)CN)F A2Z00047170 [0,1,0,0,0,0|1,1,1]=4
16  B15R2.309  Cc1c(nc(s1)N)c2ccc(cc2)Cl A2Z00078084 [0,1,0,0,0,0|0,1,2]=4
17  B15R2.309  c1cc(ccc1C2CC(=O)OC2=O)Cl A2Z00049254 [0,1,0,0,0,0|2,0,1]=4
18  B15R2.1153  c1cc(c(cc1Cl)Cl)c2csc(n2)N A2Z00069979 [0,1,0,0,0,0|0,1,2]=4
19  B15R2.1153  c1cc(c(cc1Cl)Cl)c2csc(n2)N A2Z00097862 [0,1,0,0,0,0|0,1,2]=4
20  B13R1.14  Cc1ccc(cc1)CCC(=O)OC A2Z00096852 [0,0,1,0,0,0|3,0,0]=4
21  B13R1.132  CC(CC(=O)O)c1ccc(cc1)Cl A2Z00046281 [0,0,1,0,0,0|2,0,0]=3
22  B13R1.132  CC(CC(=O)O)c1ccc(cc1)F A2Z00046280 [0,0,1,0,0,0|2,1,0]=4
23  B13R1.132  C\C(=C/C(=O)O)\c1ccc(cc1)Cl A2Z00094005 [0,0,1,0,0,0|2,0,1]=4
24  B13R1.513  c1cc(ccc1CCCC(=O)O)Cl A2Z00094023 [0,0,1,0,0,0|3,0,0]=4
25  B15R2.28  c1cc(ccc1c2ccnc(n2)N)Cl A2Z00087159 [0,0,0,0,0,1|1,0,2]=4
26  B12R1.16  CC(CCN)c1ccc(cc1)Cl A2Z00046308 [1,0,1,0,0,0|1,0,1]=4
27  B12R1.1  c1cc(ccc1CCCCN)Cl A2Z00046209 [1,0,1,0,0,0|1,0,1]=4
28  B12R1.21  c1cc(ccc1CCC(=O)O)Cl A2Z00038303 [1,0,1,0,0,0|2,0,0]=4
29  B12R1.107  CC(CC(=O)O)c1ccccc1 A2Z00094013 [1,0,1,0,0,0|2,0,0]=4
30  B14R1.694  CC(C)(CC(=O)O)c1ccc(cc1)Cl A2Z00048055 [0,1,1,0,0,0|2,0,0]=4
31  B14R2.380  c1cc2c(cc1Cl)NC(=O)CCC2 A2Z00094767 [0,0,1,1,0,0|2,0,0]=4
32  B12R1.49  COC(=O)Cc1ccc(cc1)N A2Z00094801 [0,0,1,0,1,0|2,0,0]=4
33  B12R1.20  CC(c1ccc(cc1)Br)C(=O)O A2Z00047901 [0,0,1,0,1,0|1,1,0]=4
34  B12R1.20  Cc1ccc(cc1)C(C)C(=O)O A2Z00094214 [0,0,1,0,1,0|2,0,0]=4
35  B12R1.20  c1cc(ccc1C(C(=O)O)Cl)Cl A2Z00049239 [0,0,1,0,1,0|2,0,0]=4
36  B14R2.19  c1ccc(cc1)CC2COC(=O)N2 A2Z00094895 [1,0,0,0,0,1|1,0,1]=4