0  B9R1.69  C=C1C=NC(C)=NC1=N DB01788 [0,0,0,0,0,0|2,0,2]=4
1  B9R1.69  CC1=CC=C(C)C(N)=C1 DB02163 [0,0,0,0,0,0|4,0,0]=4
2  B9R1.69  CC1=CC=C(O)C(N)=C1 DB04533 [0,0,0,0,0,0|4,0,0]=4
3  B9R1.69  CC1=CN=C(C)N=C1N DB02372 [0,0,0,0,0,0|2,0,1]=3
4  B9R1.69  CC1=CNC(=O)NC1=O DB03462 [0,0,0,0,0,0|2,0,1]=3
5  B9R1.69  NC1=C(F)C=NC(=O)N1 DB01099 [0,0,0,0,0,0|0,0,0]=0
6  B9R1.69  NC1=CNC(=O)NC1=O DB03792 [0,0,0,0,0,0|2,0,1]=3
7  B9R1.69  O=C1C=C(O)C(Cl)=CN1 DB09257 [0,0,0,0,0,0|2,1,1]=4
8  B9R1.69  O=C1NC=C(F)C(=O)N1 DB00544 [0,0,0,0,0,0|1,0,1]=2
9  B9R1.69  O=C1NC=C(I)C(=O)N1 DB03554 [0,0,0,0,0,0|1,1,1]=3
10  B9R1.69  [C@@H]1(O)NC(O)=NC=C1F DB04135 [0,0,0,0,0,0|1,0,2]=3
11  B8R1.4  O=C1C=CNC(=O)N1 DB03419 [1,0,0,0,0,0|1,0,1]=3
12  B8R1.4  [C@H]1(O)C=CN=C(O)N1 DB03939 [1,0,0,0,0,0|1,0,2]=4
13  B8R1.5  NC1=CC=CC=C1F DB02403 [1,0,0,0,0,0|2,0,0]=3
14  B8R1.5  NC1=CC=CC=C1O DB01726 [1,0,0,0,0,0|3,0,0]=4
15  B10R1.22  NC1=C(N)C(=O)NC(=O)N1 DB03826 [0,1,0,0,0,0|1,0,1]=3
16  B10R1.25  C#CC1=CNC(=O)NC1=O DB03516 [0,1,0,0,0,0|2,0,1]=4
17  B10R1.25  CC1=NC=C(CN)C(N)=N1 DB03204 [0,1,0,0,0,0|2,0,1]=4
18  B10R1.25  CC1=NC=C(CO)C(N)=N1 DB02022 [0,1,0,0,0,0|2,0,1]=4
19  B7R1.3  CC1=CC=CC=N1 DB04874 [2,0,0,0,0,0|2,0,0]=4
20  B7R1.3  CC1=CC=CN=C1 DB01996 [2,0,0,0,0,0|2,0,0]=4
21  B7R1.3  NC1=CC=CC=C1 DB06728 [2,0,0,0,0,0|2,0,0]=4
22  B7R1.3  SC1=CC=CC=N1 DB03329 [2,0,0,0,0,0|1,1,0]=4
23  B9R1.3  C[N+]1=C(N)C=CNC1=O DB04103 [1,1,0,0,0,0|0,0,2]=4