0  B9R1.12  c1cnn(c1)CCCCl WX630289 [0,0,0,0,0,0|4,0,0]=4
1  B8R1.8  CNCc1[nH]ccn1 WX609046 [1,0,0,0,0,0|3,0,0]=4
2  B8R1.8  CNCc1cncs1 WX609042 [1,0,0,0,0,0|2,1,0]=4
3  B8R1.8  c1cc(oc1)CCO WX640320 [1,0,0,0,0,0|1,0,0]=2
4  B8R1.8  c1cc(sc1)CCN WX600201 [1,0,0,0,0,0|1,1,0]=3
5  B8R1.8  c1cnn(c1)CCBr WX630022 [1,0,0,0,0,0|3,0,0]=4
6  B10R1.11  CCOC(=O)c1cc[nH]c1 WX618469 [0,1,0,0,0,0|2,0,1]=4
7  B10R1.11  CCOC(=O)c1cc[nH]n1 WX618308 [0,1,0,0,0,0|2,0,1]=4
8  B10R1.11  CCOC(=O)c1cnc[nH]1 WX618277 [0,1,0,0,0,0|2,0,1]=4
9  B10R1.11  CCOC(=O)c1cocn1 WX618478 [0,1,0,0,0,0|2,0,1]=4
10  B10R1.16  Cc1ccc(s1)CCCN WX607136 [0,1,0,0,0,0|2,1,0]=4
11  B10R1.16  Cc1ccc(s1)CCCN WXC02874 [0,1,0,0,0,0|2,1,0]=4
12  B10R1.21  c1cc(sc1)CNCCO WXC04465 [0,1,0,0,0,0|1,1,0]=3
13  B10R2.7  c1[nH]c2c(n1)CNCC2 WX606075 [0,0,0,1,0,0|3,0,0]=4
14  B10R2.7  c1[nH]c2c(n1)CNCC2 WX606111 [0,0,0,1,0,0|3,0,0]=4
15  B10R1.17  C1C=CCC(=C1)CCCO WX640164 [0,0,0,0,0,1|3,0,0]=4
16  B7R0.7  CCOC(=O)\C=C\I WX618027 [1,0,1,0,0,0|1,0,1]=4
17  B7R1.1  CNc1ncco1 WX606024 [2,0,0,0,0,0|2,0,0]=4
18  B7R1.1  c1c([nH]cn1)CO WX640062 [2,0,0,0,0,0|2,0,0]=4
19  B7R1.1  c1c(nc[nH]1)CO WX640292 [2,0,0,0,0,0|2,0,0]=4
20  B7R1.1  c1c(nco1)CO WX640327 [2,0,0,0,0,0|2,0,0]=4
21  B7R1.1  c1c(ocn1)CO WX640330 [2,0,0,0,0,0|1,0,0]=3
22  B7R1.1  c1cc(sc1)CO WX640288 [2,0,0,0,0,0|0,1,0]=3
23  B7R1.1  c1cnc([nH]1)CO WXC03352 [2,0,0,0,0,0|2,0,0]=4
24  B7R1.1  c1cnoc1CBr WX630186 [2,0,0,0,0,0|2,0,0]=4
25  B7R1.1  c1cnoc1CN WX603009 [2,0,0,0,0,0|2,0,0]=4
26  B7R1.1  c1csc(n1)CO WX640084 [2,0,0,0,0,0|1,1,0]=4
27  B9R1.7  CCCc1cc(on1)N WX609183 [1,1,0,0,0,0|2,0,0]=4
28  B9R1.11  CCC(=O)c1ccc[nH]1 WX626090 [1,1,0,0,0,0|1,0,1]=4
29  B9R1.11  COC(=O)c1ccc[nH]1 WX618294 [1,1,0,0,0,0|1,0,1]=4
30  B9R1.11  c1cc(oc1)C(CN)O WX600098 [1,1,0,0,0,0|1,0,0]=3
31  B9R1.13  c1cc(oc1)CC(=O)O WX610351 [1,1,0,0,0,0|1,0,1]=4
32  B11R1.16  CCOC(=O)c1cnccn1 WX618267 [0,1,0,0,0,1|1,0,1]=4
33  B11R1.28  c1ccc(cc1)COCCN WXC01524 [0,1,0,0,0,1|1,0,0]=3
34  B11R1.15  CCOC(=O)c1cc(no1)Br WX637016 [0,2,0,0,0,0|1,0,1]=4
35  B11R1.30  CCOC(=O)Cc1nnco1 WX613761 [0,2,0,0,0,0|2,0,0]=4
36  B11R1.30  CCOC(=O)Cn1cccn1 WX618052 [0,2,0,0,0,0|2,0,0]=4
37  B9R2.2  c1cnc([nH]1)C2CC2 WX690116 [1,0,0,1,0,0|2,0,0]=4
38  B11R2.106  c1coc2c1CCCC2=O WXC02601 [0,1,0,1,0,0|1,0,1]=4