0  B9R1.6  c1cc(cnc1)C(=O)N 11127 [0,0,0,0,0,0|3,0,1]=4
1  B9R1.6  c1ccnc(c1)C(=S)N 13043 [0,0,0,0,0,0|3,0,1]=4
2  B9R1.6  c1cnc(cn1)C(=S)N 10551 [0,0,0,0,0,0|2,0,1]=3
3  B8R1.2  c1cnc(nc1)CCl 10007122 [1,0,0,0,0,0|3,0,0]=4
4  B8R1.2  c1cnc(nc1)CN 10007106 [1,0,0,0,0,0|3,0,0]=4
5  B8R1.2  c1cnc(nc1)CO 10007112 [1,0,0,0,0,0|3,0,0]=4
6  B8R1.2  c1cncnc1CN 10007124 [1,0,0,0,0,0|3,0,0]=4
7  B8R1.2  c1cncnc1CO 10007111 [1,0,0,0,0,0|3,0,0]=4
8  B10R1.15  CC(CN)c1ccccc1 17742 [0,1,0,0,0,0|2,0,0]=3
9  B10R1.15  c1ccc(cc1)[C@H](CO)N 10007132 [0,1,0,0,0,0|3,0,0]=4
10  B10R1.15  c1cnc(cn1)\C(=N\O)\N 11059 [0,1,0,0,0,0|2,0,1]=4
11  B10R1.18  C[C@@H](Cc1ccccc1)N 14204 [0,0,0,0,0,1|3,0,0]=4
12  B10R1.18  C[C@@H](Cc1ccccc1)N 15650 [0,0,0,0,0,1|3,0,0]=4
13  B7R1.3  c1cnc(cn1)N 10007093 [2,0,0,0,0,0|1,0,0]=3
14  B9R1.8  c1ccc(cc1)CCBr 20087 [1,1,0,0,0,0|2,0,0]=4
15  B9R1.8  c1ccc(cc1)CCN 14206 [1,1,0,0,0,0|2,0,0]=4
16  B11R1.40  CC(CC1=CCC=CC1)NC 90001067 [0,1,0,0,0,1|2,0,0]=4
17  B11R1.40  C[C@@H](Cc1ccccc1)NC 13997 [0,1,0,0,0,1|2,0,0]=4
18  B11R1.40  C[C@H](Cc1ccccc1)NC 13998 [0,1,0,0,0,1|2,0,0]=4
19  B11R1.509  CC(C)(Cc1ccccc1)N 14207 [0,1,0,0,0,1|2,0,0]=4
20  B11R1.12  CCC(c1ccccc1)NC 21630 [0,2,0,0,0,0|2,0,0]=4
21  B11R1.12  COC(c1ccncn1)OC 10007120 [0,2,0,0,0,0|2,0,0]=4
22  B11R1.16  CC(CNC)c1ccccc1 18563 [0,2,0,0,0,0|2,0,0]=4