0  B11R1.226  CCC(N)c1nc(c(s1)C)C Molport-003-738-244 [0,0,0,0,0,0|1,0,2]=3
1  B11R1.226  CCC(N)c1nc(c(s1)C)C Molport-016-583-347 [0,0,0,0,0,0|1,0,2]=3
2  B10R1.14  CC(CN)c1nc(cs1)C Molport-003-738-589 [1,0,0,0,0,0|1,0,2]=4
3  B10R1.14  CC(CN)c1ncc(s1)C Molport-003-752-509 [1,0,0,0,0,0|1,0,2]=4
4  B10R1.14  CCC(C)c1csc(n1)C Molport-035-368-020 [1,0,0,0,0,0|2,0,1]=4
5  B10R1.14  CCC(N)c1ncc(s1)C Molport-012-088-315 [1,0,0,0,0,0|1,0,2]=4
6  B10R1.14  CCC(N)c1ncc(s1)C Molport-051-783-055 [1,0,0,0,0,0|1,0,2]=4
7  B10R1.58  CC(C)c1nc(c([nH]1)C)C Molport-046-938-934 [1,0,0,0,0,0|1,0,2]=4
8  B10R1.58  CC(N)c1nc(c(s1)C)C Molport-003-738-214 [1,0,0,0,0,0|1,0,2]=4
9  B10R1.58  CC(N)c1nc(c(s1)C)C Molport-029-997-744 [1,0,0,0,0,0|1,0,2]=4
10  B10R1.58  CC(O)c1nc(c(s1)C)C Molport-006-830-795 [1,0,0,0,0,0|1,0,2]=4
11  B12R1.202  CCC(C)(N)c1nc(c(s1)C)C Molport-047-638-673 [0,1,0,0,0,0|0,0,2]=3
12  B9R1.11  CCC(C)c1nccs1 Molport-005-940-407 [2,0,0,0,0,0|0,0,2]=4
13  B9R1.11  CC[C@H](C)c1nccs1 Molport-051-570-647 [2,0,0,0,0,0|0,0,2]=4
14  B11R1.6  CCC(C)(N)c1nc(cs1)C Molport-012-805-877 [1,1,0,0,0,0|0,0,2]=4
15  B11R1.6  CCC(C)(N)c1ncc(s1)C Molport-047-459-825 [1,1,0,0,0,0|0,0,2]=4
16  B11R1.48  CC(C)c1nc(c(s1)CN)C Molport-006-066-804 [1,1,0,0,0,0|0,0,2]=4
17  B11R1.48  CC(C)c1nc(c(s1)CN)C Molport-006-705-116 [1,1,0,0,0,0|0,0,2]=4
18  B11R1.48  CC(C)c1nc(c(s1)CO)C Molport-004-793-828 [1,1,0,0,0,0|0,0,2]=4
19  B11R1.79  Cc1nc(sc1C)C(C)(C)N Molport-008-488-895 [1,1,0,0,0,0|0,0,2]=4
20  B13R2.149  Cc1nc(sc1C)C2CCCN2 Molport-051-773-620 [0,1,0,1,0,0|0,0,2]=4
21  B13R2.149  Cc1nc(sc1C)[C@@H]2CCCN2 Molport-047-917-606 [0,1,0,1,0,0|0,0,2]=4
22  B13R2.149  Cc1nc(sc1C)[C@H]2CCCN2 Molport-046-594-006 [0,1,0,1,0,0|0,0,2]=4