0  B10R1.113  CC(=O)C1=NC(C)=CC=C1 08-1281 [1,0,0,0,0,0|2,0,1]=4
1  B10R1.113  CC1=CC=CC([C@H](C)N)=C1 08-10340 [1,0,0,0,0,0|3,0,0]=4
2  B10R1.113  CN(C)C1=CN=CC(I)=N1 08-1078 [1,0,0,0,0,0|2,0,0]=3
3  B10R1.172  COC1=CC(C=O)=CN=C1 08-2669 [1,0,0,0,0,0|2,0,1]=4
4  B10R1.172  COC1=CC(CO)=CC=C1 CS-651 [1,0,0,0,0,0|3,0,0]=4
5  B10R1.172  COC1=CC=CC(OC)=C1 CS-398 [1,0,0,0,0,0|3,0,0]=4
6  B10R1.172  COC1=CN=CC(CN)=C1 08-8117 [1,0,0,0,0,0|2,0,0]=3
7  B10R1.172  COC1=CN=CC(CO)=C1 08-8532 [1,0,0,0,0,0|2,0,0]=3
8  B12R1.453  COC1=NC(N(C)C)=C(Br)C=N1 08-545 [0,1,0,0,0,0|3,0,0]=4
9  B10R1.31  CC(C)C1=NC(C=O)=CS1 08-1139 [0,0,0,0,1,0|3,0,0]=4
10  B10R1.31  CC(C)C1=NC(CCl)=CS1 08-1022 [0,0,0,0,1,0|3,0,0]=4
11  B10R1.31  CC(C)C1=NC(CN)=CS1 08-877 [0,0,0,0,1,0|3,0,0]=4
12  B10R1.31  CC(C)C1=NC(CO)=CS1 08-2236 [0,0,0,0,1,0|3,0,0]=4
13  B9R1.2  CCC1=CC=CC(O)=C1 CS-543 [2,0,0,0,0,0|2,0,0]=4
14  B9R1.2  COC1=CC(Br)=CN=C1 08-117 [2,0,0,0,0,0|2,0,0]=4
15  B9R1.2  COC1=CC(C)=CC=C1 CS-726 [2,0,0,0,0,0|2,0,0]=4
16  B9R1.2  COC1=CC=CC(Br)=N1 08-952 [2,0,0,0,0,0|2,0,0]=4
17  B9R1.2  COC1=CN=CC(Br)=N1 08-4210 [2,0,0,0,0,0|1,0,0]=3
18  B9R1.2  COC1=CN=CC(Cl)=N1 08-1017 [2,0,0,0,0,0|1,0,0]=3
19  B9R1.2  COC1=CN=CC(I)=N1 08-1162 [2,0,0,0,0,0|1,0,0]=3
20  B9R1.2  COC1=CN=CC(N)=C1 08-6370 [2,0,0,0,0,0|2,0,0]=4
21  B9R1.2  COC1=CN=CC(O)=C1 08-6045 [2,0,0,0,0,0|2,0,0]=4
22  B9R1.2  COC1=NC(N)=CN=C1 08-10108 [2,0,0,0,0,0|1,0,0]=3
23  B11R1.21  CC1=C(O)C=C(C(C)C)C=C1 025440S [1,1,0,0,0,0|2,0,0]=4
24  B11R1.280  COC1=NC(OC)=C(Br)C=C1 08-9849 [1,1,0,0,0,0|2,0,0]=4
25  B9R1.35  CC(C)C1=NC(Br)=CS1 08-948 [1,0,0,0,1,0|2,0,0]=4
26  B9R1.35  CC1=CSC([C@H](C)N)=N1 08-10034 [1,0,0,0,1,0|2,0,0]=4
27  B9R1.41  CC(C)C1=C(N)NN=C1 08-10014 [1,0,0,0,1,0|2,0,0]=4
28  B11R1.3  COC1=NC=C(C(C)=O)C=C1 08-8093 [0,0,0,0,1,1|1,0,1]=4