0  B7R0.7  CCOC(=O)CCN WX600219 [0,0,0,0,0,0|2,0,0]=2
1  B7R0.7  CCOC(=O)\C=C\I WX618027 [0,0,0,0,0,0|2,0,1]=3
2  B6R0.1  CCNC(=O)CCl WX630212 [1,0,0,0,0,0|2,0,0]=3
3  B6R0.1  CNC(=O)CC#N WX619018 [1,0,0,0,0,0|3,0,0]=4
4  B6R0.1  CNCC(=O)NC WX600331 [1,0,0,0,0,0|2,0,0]=3
5  B8R0.3  CCOC(=O)C(=O)NC WXC01946 [0,1,0,0,0,0|1,0,1]=3
6  B8R0.3  CCOC(=O)\C(=N\O)\N WX619086 [0,1,0,0,0,0|2,0,1]=4
7  B8R0.5  CCOC(=O)CC(=N)N WX619913 [0,1,0,0,0,0|2,0,0]=3
8  B8R1.4  CC1CC(=O)CCN1 WX604553 [0,0,0,1,0,0|3,0,0]=4
9  B8R1.4  CC1CNCC(=O)N1 WX604173 [0,0,0,1,0,0|2,0,0]=3
10  B8R1.4  C[C@@H]1CNC[C@H](O1)C WXC01422 [0,0,0,1,0,0|2,0,1]=4
11  B8R1.22  C1CC(=O)CCOC1 WXC02242 [0,0,0,1,0,0|3,0,0]=4
12  B8R1.22  C1CNC(=O)COC1 WX619937 [0,0,0,1,0,0|1,1,0]=3
13  B8R1.22  C1CNCC(=O)NC1 WX604239 [0,0,0,1,0,0|2,0,0]=3
14  B8R1.22  CC1CNCCCO1 WX604057 [0,0,0,1,0,0|2,0,1]=4
15  B5R0.1  C(CF)C(=O)O WX610266 [2,0,0,0,0,0|2,0,0]=4
16  B5R0.1  CC(=O)CNC WX600212 [2,0,0,0,0,0|1,0,0]=3
17  B5R0.2  CCO\C=C/Br WX630081 [2,0,0,0,0,0|1,0,1]=4
18  B7R0.3  COC(=O)CCCN WX600050 [1,1,0,0,0,0|1,0,0]=3
19  B7R0.10  CCN(C)C(=O)CBr WX630206 [1,1,0,0,0,0|2,0,0]=4
20  B9R0.35  CCCN(C(=O)OCC)N WXC01005 [0,2,0,0,0,0|1,0,0]=3
21  B9R0.48  CCOC(=O)\C=C\C(=O)C WX685448 [0,2,0,0,0,0|1,0,1]=4
22  B9R0.48  CCOC(=O)\C=C\C(F)F WX685437 [0,2,0,0,0,0|1,0,1]=4
23  B9R0.44  CCNC(=O)OC(C)(C)C WXC04011 [0,2,0,0,0,0|2,0,0]=4
24  B9R0.44  CCOC(=O)CC(C)(C)N WX600232 [0,2,0,0,0,0|1,0,0]=3
25  B7R1.2  C1C(COC1=O)N WXC01359 [1,0,0,1,0,0|2,0,0]=4
26  B7R1.2  CC1CC(=O)NC1 WXC00781 [1,0,0,1,0,0|2,0,0]=4
27  B7R1.3  C1CC(=O)COC1 WX625057 [1,0,0,1,0,0|0,1,0]=3
28  B7R1.3  C1CNC(=O)CN1 WX604543 [1,0,0,1,0,0|2,0,0]=4
29  B7R1.3  C1CNCCC1=O WX604552 [1,0,0,1,0,0|2,0,0]=4
30  B7R1.3  C1COC(=O)C=C1 WX685450 [1,0,0,1,0,0|0,0,2]=4
31  B7R1.4  C1CNC(=O)[C@@H]1N WX604202 [1,0,0,1,0,0|2,0,0]=4
32  B7R1.4  C1CNC(=O)[C@H]1O WX642165 [1,0,0,1,0,0|1,1,0]=4
33  B7R1.4  C1COC(=O)C1N WXC03217 [1,0,0,1,0,0|1,0,0]=3
34  B7R1.22  CCC(=O)C1CC1 WX625032 [1,0,0,1,0,0|1,0,0]=3
35  B7R1.24  C1CNCCOC1 WX604716 [1,0,0,1,0,0|1,0,1]=4
36  B9R1.2  C1CNC(=O)CC1CN WX600136 [0,1,0,1,0,0|2,0,0]=4
37  B9R1.2  C1CNC(=O)CC1CN WX600354 [0,1,0,1,0,0|2,0,0]=4
38  B9R1.33  C1CC(=O)N(C1)CCCl WX630020 [0,1,0,1,0,0|2,0,0]=4
39  B9R1.49  CN1CCCC(=O)CC1 WX625013 [0,1,0,1,0,0|2,0,0]=4
40  B9R1.5  C1CC(C(=O)CNC1)F WX601127 [0,1,0,1,0,0|2,0,0]=4
41  B9R1.5  C1CCNC(=O)[C@H](C1)N WX604515 [0,1,0,1,0,0|2,0,0]=4
42  B9R1.5  CC1C(=O)NCCCO1 WX619938 [0,1,0,1,0,0|1,1,0]=4