0  B9R1.23  CC1=C(C)SC(C=O)=N1 SBB110188 [0,0,0,0,0,0|1,0,3]=4
1  B9R1.23  CC1=C(C)SC(NN)=N1 SBB010296 [0,0,0,0,0,0|2,0,2]=4
2  B9R1.23  CCN1C=C(Br)C(C)=N1 SBB020342 [0,0,0,0,0,0|3,0,1]=4
3  B9R1.23  CCN1C=C(C)C(N)=N1 SBB027023 [0,0,0,0,0,0|3,0,1]=4
4  B9R1.23  CCN1C=C(Cl)C(C)=N1 SBB046652 [0,0,0,0,0,0|3,0,1]=4
5  B9R1.23  CCN1C=C(I)C(C)=N1 SBB051459 [0,0,0,0,0,0|3,0,1]=4
6  B9R1.23  CCN1C=C(N)C(C)=N1 SBB009354 [0,0,0,0,0,0|3,0,1]=4
7  B8R1.1  CC1=CN=C(CO)S1 SBB054807 [1,0,0,0,0,0|1,0,2]=4
8  B8R1.1  CC1=CSC(CO)=N1 SBB054809 [1,0,0,0,0,0|1,0,2]=4
9  B8R1.1  CCN1C=CC(C)=N1 SBB020339 [1,0,0,0,0,0|2,0,1]=4
10  B8R1.1  N1C=C(C)N=C1CC SBB004334 [1,0,0,0,0,0|1,0,2]=4
11  B8R1.18  CC1=C(C)SC(Br)=N1 SBB110187 [1,0,0,0,0,0|1,0,2]=4
12  B8R1.18  CC1=C(C)SC(N)=N1 SBB003911 [1,0,0,0,0,0|1,0,2]=4
13  B8R1.18  CC1=C(C)SC(N)=N1 SBB028421 [1,0,0,0,0,0|1,0,2]=4
14  B8R1.18  CC1=C(C)SC(N)=N1 SBB037835 [1,0,0,0,0,0|1,0,2]=4
15  B8R1.18  CC1=C(C)SC(S)=N1 SBB059522 [1,0,0,0,0,0|1,0,2]=4
16  B8R1.18  CC1=NC(C)=C(Br)S1 SBB054427 [1,0,0,0,0,0|1,0,2]=4
17  B10R1.35  CCN1C=C(CN)C(C)=N1 SBB014762 [0,1,0,0,0,0|2,0,1]=4
18  B10R1.35  CCN1C=C(CO)C(C)=N1 SBB009188 [0,1,0,0,0,0|2,0,1]=4
19  B10R1.58  CC(=O)C1=NC(C)=C(C)S1 SBB055796 [0,1,0,0,0,0|0,0,3]=4
20  B8R0.8  CCCCC(C)C(=O)O SBB072714 [0,0,1,0,0,0|3,0,0]=4
21  B8R0.8  CCCCC(N)C(C)=O SBB014561 [0,0,1,0,0,0|3,0,0]=4
22  B8R0.8  CCCOC(=O)C(C)Cl SBB060963 [0,0,1,0,0,0|3,0,0]=4
23  B8R0.19  CCC(=O)OC(C)CC SBB061103 [0,0,1,0,0,0|3,0,0]=4
24  B8R0.19  CCC(C)NC(C)CC SBB059801 [0,0,1,0,0,0|1,0,2]=4
25  B7R0.3  C=C(CC)CCCC SBB060475 [1,0,1,0,0,0|1,0,1]=4
26  B7R0.3  CCCOC(=O)CS SBB061003 [1,0,1,0,0,0|2,0,0]=4
27  B7R0.4  CCCCCC(C)=O SBB061125 [1,0,1,0,0,0|2,0,0]=4
28  B7R0.5  CCCC(C)C(=O)O SBB065915 [1,0,1,0,0,0|2,0,0]=4
29  B7R0.5  CCCC(C)C(C)O SBB061491 [1,0,1,0,0,0|0,1,1]=4
30  B7R0.2  CC\C(C)=C\C(C)C SBB060471 [1,0,1,0,0,0|2,0,0]=4
31  B9R0.14  CCCC(CC)OC(C)=O SBB060029 [0,1,1,0,0,0|2,0,0]=4
32  B9R1.7  CC1=CN=C(CCN)S1 SBB027447 [1,1,0,0,0,0|0,0,2]=4
33  B9R1.7  CC1=CSC(CCN)=N1 SBB044025 [1,1,0,0,0,0|0,0,2]=4