0  B9R1.11  CCC(=O)C1=CC=CS1 BB01-4952 [0,0,0,0,0,0|2,0,1]=3
1  B9R1.11  CCC(N)C1=CC=CS1 BB01-4366 [0,0,0,0,0,0|2,0,0]=2
2  B9R1.11  O=C(CBr)C1=CC=CS1 BB20-0496 [0,0,0,0,0,0|3,0,1]=4
3  B8R1.7  CC(N)C1=CC=CO1 BB01-4826 [1,0,0,0,0,0|2,1,0]=4
4  B8R1.7  CC(N)C1=CC=CS1 BB01-4334 [1,0,0,0,0,0|2,0,0]=3
5  B8R1.8  CNCC1=CC=CO1 BB01-5301 [1,0,0,0,0,0|2,1,0]=4
6  B8R1.8  CNCC1=CC=CS1 BB55-3486 [1,0,0,0,0,0|2,0,0]=3
7  B8R1.8  NCCC1=CC=CS1 BB01-0963 [1,0,0,0,0,0|2,0,0]=3
8  B8R1.8  NCCC1=CNC=N1 BB01-4493 [1,0,0,0,0,0|3,0,0]=4
9  B8R1.8  NCCN1C=CC=N1 BB05-1654 [1,0,0,0,0,0|3,0,0]=4
10  B8R1.8  OCCN1C=CC=N1 BB05-2235 [1,0,0,0,0,0|3,0,0]=4
11  B10R1.11  CCCC(=O)C1=CC=CS1 BB55-2280 [0,1,0,0,0,0|2,0,1]=4
12  B10R1.11  CCCC(N)C1=CC=CS1 BB01-4372 [0,1,0,0,0,0|2,0,0]=3
13  B10R1.14  CCC(=O)C1=CC=C(Br)S1 BB55-2283 [0,1,0,0,0,0|2,0,1]=4
14  B10R1.14  CCC(=O)C1=CC=C(Cl)S1 BB55-2282 [0,1,0,0,0,0|2,0,1]=4
15  B10R1.27  O=C(CCl)NC1=NC=CS1 BB01-5548 [0,0,0,0,0,1|2,0,1]=4
16  B7R1.1  CCN1C=CC=N1 BB01-5044 [2,0,0,0,0,0|2,0,0]=4
17  B7R1.1  NCC1=CC=CS1 BB01-5532 [2,0,0,0,0,0|2,0,0]=4
18  B7R1.1  OCC1=NC=CS1 BB17-2991 [2,0,0,0,0,0|1,0,0]=3
19  B9R1.35  CC(C)C1=NC(I)=CN1 BB58-4144 [1,1,0,0,0,0|1,0,0]=3
20  B9R1.35  CC(C)C1=NC(N)=NN1 BB55-5154 [1,1,0,0,0,0|2,0,0]=4
21  B9R1.35  CC(C)C1=NC(N)=NO1 BB58-5052 [1,1,0,0,0,0|1,1,0]=4
22  B9R1.35  CC(C)N1C=C(N)C=N1 BB05-4215 [1,1,0,0,0,0|2,0,0]=4
23  B9R1.7  CC1=CSC(CCN)=N1 BB58-4488 [1,1,0,0,0,0|1,0,0]=3
24  B9R1.7  CCCC1=NNC(N)=N1 BB52-6651 [1,1,0,0,0,0|2,0,0]=4
25  B9R1.7  CNCC1=CC=C(C)S1 BB55-8316 [1,1,0,0,0,0|2,0,0]=4
26  B9R1.12  NCCCN1C=CC=N1 BB01-4860 [1,1,0,0,0,0|2,0,0]=4
27  B9R1.12  OCCCN1C=CC=N1 BB05-2436 [1,1,0,0,0,0|2,0,0]=4
28  B9R1.13  CC(N)CN1C=CC=N1 BB05-2151 [1,1,0,0,0,0|2,0,0]=4
29  B11R1.16  CN(CCO)C1=NC=CC=C1 BB20-1277 [0,1,0,0,0,1|2,0,0]=4
30  B11R1.23  CCC(N)C1=NC=CC(C)=C1 BB58-3616 [0,1,0,0,0,1|2,0,0]=4
31  B11R1.222  CCC(N)C1=NC=CC=C1C BB58-3609 [0,1,0,0,0,1|2,0,0]=4
32  B11R1.30  O=C(CCCl)NC1=NC=CS1 BB57-1665 [0,1,0,0,0,1|1,0,1]=4
33  B11R1.35  CC(Cl)C(=O)NC1=NC=CS1 BB57-1147 [0,1,0,0,0,1|1,0,1]=4
34  B11R1.39  CCC(C)SC1=NN=C(N)S1 BB55-7863 [0,1,0,0,0,1|1,0,0]=3
35  B11R1.6  CCC(C)(C)C1=NN=C(N)S1 BB55-4748 [0,2,0,0,0,0|1,0,0]=3
36  B11R1.11  CCC(CC)C1=NN=C(N)S1 BB55-4642 [0,2,0,0,0,0|1,0,0]=3
37  B11R1.168  CCC(CC)N1N=CC=C1N BB55-6343 [0,2,0,0,0,0|2,0,0]=4
38  B11R1.15  CCCC(C)C1=NN=C(N)S1 BB55-4639 [0,2,0,0,0,0|1,0,0]=3
39  B11R1.199  CCCC(C)N1N=CC=C1N BB55-6345 [0,2,0,0,0,0|2,0,0]=4
40  B11R1.199  CCCC(N)C1=NC=CN1C BB58-3605 [0,2,0,0,0,0|2,0,0]=4
41  B11R1.314  CC(C)C(N)C1=NN=C(N)S1 BB57-1525 [0,2,0,0,0,0|2,0,0]=4
42  B11R1.89  CC(C)C(N)C1=NC=CN1C BB58-3606 [0,2,0,0,0,0|2,0,0]=4
43  B11R2.2  C1=CSC(C2OCCO2)=N1 BB58-3259 [0,1,0,1,0,0|1,0,0]=3
44  B9R1.6  CC(N)C1=CC=CC=N1 BB01-4954 [1,0,0,0,0,1|2,0,0]=4
45  B9R1.6  CC(N)C1=CN=CC=C1 BB01-4888 [1,0,0,0,0,1|2,0,0]=4
46  B9R1.8  CNCC1=CC=CN=C1 BB01-7899 [1,0,0,0,0,1|2,0,0]=4
47  B9R1.8  NCCC1=CC=CN=C1 BB01-0960 [1,0,0,0,0,1|2,0,0]=4
48  B9R1.8  NCCC1=NC=CC=C1 BB01-0959 [1,0,0,0,0,1|2,0,0]=4