0  B9R1.22  Cc1c(sc(n1)N)CN BC678794 [0,0,0,0,0,0|2,0,1]=3
1  B9R1.22  Cc1cc([nH]c1C=O)C BC227861 [0,0,0,0,0,0|3,0,0]=3
2  B8R1.1  Cc1ncc(s1)C=O BC650857 [1,0,0,0,0,0|1,0,0]=2
3  B8R1.1  c1c(sc(n1)Cl)CCl BC209499 [1,0,0,0,0,0|2,0,1]=4
4  B8R1.1  c1c(sc(n1)Cl)CN BC201455 [1,0,0,0,0,0|2,0,1]=4
5  B8R1.1  c1c(sc(n1)N)C=O BC220680 [1,0,0,0,0,0|2,0,0]=3
6  B8R1.1  c1c(sc(n1)N)CO BC658236 [1,0,0,0,0,0|2,0,1]=4
7  B8R1.11  Cc1c([nH]cn1)CO BC216404 [1,0,0,0,0,0|2,0,1]=4
8  B8R1.11  Cc1c(scn1)C=O BC218797 [1,0,0,0,0,0|1,0,0]=2
9  B8R1.11  c1csc(c1Br)C=O BC219795 [1,0,0,0,0,0|3,0,0]=4
10  B8R1.11  c1csc(c1Cl)C=O BC679930 [1,0,0,0,0,0|3,0,0]=4
11  B8R1.18  Cc1c(sc(n1)Br)Br BC221844 [1,0,0,0,0,0|2,0,0]=3
12  B10R1.256  Cc1c(c(n(n1)C)Cl)C=O BC203666 [0,1,0,0,0,0|3,0,0]=4
13  B10R1.8  Cc1cc(cc(c1)C=O)C BC219818 [0,0,0,0,0,1|3,0,0]=4
14  B7R1.1  c1c(scn1)C=O BC678913 [2,0,0,0,0,0|1,0,0]=3
15  B7R1.1  c1c(scn1)CO BC200640 [2,0,0,0,0,0|1,0,1]=4
16  B7R1.1  c1cc(sc1)C=O BC225721 [2,0,0,0,0,0|2,0,0]=4
17  B7R1.2  Cc1ccc([nH]1)C BC203703 [2,0,0,0,0,0|1,0,1]=4
18  B7R1.2  Cc1cnc(s1)Br BC675562 [2,0,0,0,0,0|1,0,1]=4
19  B7R1.2  Cc1csc(n1)Br BC221845 [2,0,0,0,0,0|1,0,0]=3
20  B7R1.2  c1c(sc(n1)N)Br BC220490 [2,0,0,0,0,0|2,0,0]=4
21  B7R1.2  c1c(sc(n1)N)Cl BC244531 [2,0,0,0,0,0|2,0,0]=4
22  B7R1.4  Cc1c(scn1)C BC225737 [2,0,0,0,0,0|0,0,1]=3
23  B9R1.21  CSc1ccc(s1)C=O BC684303 [1,1,0,0,0,0|2,0,0]=4
24  B9R1.35  Cc1ccc(s1)C(=O)O BC213236 [1,1,0,0,0,0|2,0,0]=4
25  B9R1.35  Cc1ncc(s1)C(=O)O BC681903 [1,1,0,0,0,0|1,0,0]=3
26  B9R1.14  c1nc(c(s1)C=O)C=O BC225210 [1,1,0,0,0,0|1,0,1]=4
27  B9R1.33  Cc1c(scn1)CCO BC200852 [1,1,0,0,0,0|0,0,2]=4
28  B9R1.41  Cc1c(ocn1)C(=O)O BC689523 [1,1,0,0,0,0|1,1,0]=4
29  B9R1.41  Cc1c(scn1)C(=O)O BC679074 [1,1,0,0,0,0|1,0,0]=3
30  B9R1.34  Cc1cc(nc(n1)C)Br BC676346 [0,0,1,1,0,0|2,0,0]=4
31  B11R2.10  Cc1nc2cccnc2s1 BC600237 [0,1,0,1,0,0|0,0,1]=3
32  B11R2.10  c1ccc2c(c1)nc(s2)S BC202804 [0,1,0,1,0,0|1,0,1]=4
33  B9R1.1  Cc1ccc(cn1)C=C BC219567 [1,0,0,0,0,1|1,0,0]=3
34  B9R1.1  Cc1ccc(nc1)C=C BC211746 [1,0,0,0,0,1|2,0,0]=4
35  B9R1.1  Cc1ncc(cn1)C=O BC228073 [1,0,0,0,0,1|2,0,0]=4