0  B8R0.3  CC/C=C(\C)/C(=O)NC WXVL_AK00442SB0037 [0,0,1,0,0,0|1,0,2]=4
1  B8R0.3  CC/C=C(\C)/C(=O)NC WXVL_AK00442SB0037 [0,0,1,0,0,0|1,0,2]=4
2  B8R0.8  C=C(F)C(=O)NCCC WXVL_AK00504SB1376 [0,0,1,0,0,0|1,0,2]=4
3  B8R0.8  C=C(F)C(=O)NCCC WXVL_AK00504SB1376 [0,0,1,0,0,0|1,0,2]=4
4  B8R0.8  C=CCNC(=O)C(=C)F WXVL_AK00561SB1376 [0,0,1,0,0,0|1,0,2]=4
5  B8R0.8  C=CCNC(=O)C(=C)F WXVL_AK00561SB1376 [0,0,1,0,0,0|1,0,2]=4
6  B8R0.9  C#CC(=O)NCC(=C)C WXVL_AK0761SB0338 [0,0,1,0,0,0|1,0,2]=4
7  B8R0.9  C#CC(=O)NCC(=C)C WXVL_AK0761SB0338 [0,0,1,0,0,0|1,0,2]=4
8  B8R0.9  C=C(C)CNC(=O)CC WXVL_AK0761SB0064 [0,0,1,0,0,0|1,0,2]=4
9  B8R0.9  C=C(C)CNC(=O)CC WXVL_AK0761SB0064 [0,0,1,0,0,0|1,0,2]=4
10  B8R0.9  C=C(C)CNC(=O)CO WXVL_AK0761SB2706 [0,0,1,0,0,0|0,0,2]=3
11  B8R0.9  C=C(C)CNC(=O)CO WXVL_AK0761SB2706 [0,0,1,0,0,0|0,0,2]=3
12  B7R0.3  C=CCNC(=O)CO WXVL_AK00561SB2706 [1,0,1,0,0,0|0,0,2]=4
13  B7R0.3  C=CCNC(=O)CO WXVL_AK00561SB2706 [1,0,1,0,0,0|0,0,2]=4
14  B7R0.5  C=C(F)C(=O)NCC WXVL_AK00476SB1376 [1,0,1,0,0,0|1,0,1]=4
15  B7R0.5  C=C(F)C(=O)NCC WXVL_AK00476SB1376 [1,0,1,0,0,0|1,0,1]=4
16  B7R0.5  CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [1,0,1,0,0,0|1,0,1]=4
17  B7R0.5  CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [1,0,1,0,0,0|1,0,1]=4
18  B7R0.10  C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [1,0,1,0,0,0|1,0,1]=4
19  B7R0.10  C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [1,0,1,0,0,0|1,0,1]=4
20  B7R0.6  C=C(C)CNC(=O)C WXVL_AK0761SB0150 [1,0,1,0,0,0|0,0,2]=4
21  B7R0.6  C=C(C)CNC(=O)C WXVL_AK0761SB0150 [1,0,1,0,0,0|0,0,2]=4
22  B7R0.6  CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [1,0,1,0,0,0|0,0,2]=4
23  B7R0.6  CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [1,0,1,0,0,0|0,0,2]=4
24  B9R0.7  C=C(C)CNC(=O)C(=C)F WXVL_AK0761SB1376 [0,1,1,0,0,0|1,0,1]=4
25  B9R0.7  C=C(C)CNC(=O)C(=C)F WXVL_AK0761SB1376 [0,1,1,0,0,0|1,0,1]=4
26  B11R1.166  Cc1ccc(c(c1)Br)C(=O)N WXVL_AK0084SD1112 [0,2,0,0,0,0|2,0,0]=4
27  B11R1.166  Cc1ccc(c(c1)Br)C(=O)N WXVL_AK0084SD1112 [0,2,0,0,0,0|2,0,0]=4
28  B11R1.166  Cc1ccc(c(c1)C)C(=O)N WXVL_AK0084SD0038 [0,2,0,0,0,0|2,0,0]=4
29  B11R1.166  Cc1ccc(c(c1)C)C(=O)N WXVL_AK0084SD0038 [0,2,0,0,0,0|2,0,0]=4
30  B11R1.166  Cc1ccc(c(c1)Cl)C(=O)N WXVL_AK0084SD0171 [0,2,0,0,0,0|2,0,0]=4
31  B11R1.166  Cc1ccc(c(c1)Cl)C(=O)N WXVL_AK0084SD0171 [0,2,0,0,0,0|2,0,0]=4
32  B11R1.166  Cc1ccc(c(c1)F)C(=O)N WXVL_AK0084SD0394 [0,2,0,0,0,0|2,0,0]=4
33  B11R1.166  Cc1ccc(c(c1)F)C(=O)N WXVL_AK0084SD0394 [0,2,0,0,0,0|2,0,0]=4
34  B11R1.166  Cc1ccc(c(c1)I)C(=O)N WXVL_AK0084SD1846 [0,2,0,0,0,0|2,0,0]=4
35  B11R1.166  Cc1ccc(c(c1)I)C(=O)N WXVL_AK0084SD1846 [0,2,0,0,0,0|2,0,0]=4
36  B11R1.166  Cc1ccc(c(c1)O)C(=O)N WXVL_AK0084SD0148 [0,2,0,0,0,0|1,0,0]=3
37  B11R1.166  Cc1ccc(c(c1)O)C(=O)N WXVL_AK0084SD0148 [0,2,0,0,0,0|1,0,0]=3
38  B11R1.166  NC(=O)c1ccc(cc1O)Br WXVL_AK0084SD0411 [0,2,0,0,0,0|2,0,0]=4
39  B11R1.166  NC(=O)c1ccc(cc1O)Br WXVL_AK0084SD0411 [0,2,0,0,0,0|2,0,0]=4
40  B11R1.166  NC(=O)c1ccc(cc1O)Cl WXVL_AK0084SD0550 [0,2,0,0,0,0|2,0,0]=4
41  B11R1.166  NC(=O)c1ccc(cc1O)Cl WXVL_AK0084SD0550 [0,2,0,0,0,0|2,0,0]=4
42  B11R1.166  NC(=O)c1ccc(cc1O)F WXVL_AK0084SD0561 [0,2,0,0,0,0|2,0,0]=4
43  B11R1.166  NC(=O)c1ccc(cc1O)F WXVL_AK0084SD0561 [0,2,0,0,0,0|2,0,0]=4
44  B11R1.166  NC(=O)c1ccc(cc1O)I WXVL_AK0084SD0717 [0,2,0,0,0,0|2,0,0]=4
45  B11R1.166  NC(=O)c1ccc(cc1O)I WXVL_AK0084SD0717 [0,2,0,0,0,0|2,0,0]=4
46  B11R1.166  NC(=O)c1ccc(cc1O)O WXVL_AK0084SD0149 [0,2,0,0,0,0|2,0,0]=4
47  B11R1.166  NC(=O)c1ccc(cc1O)O WXVL_AK0084SD0149 [0,2,0,0,0,0|2,0,0]=4
48  B9R1.11  CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,1,1,0,0|0,0,2]=4
49  B9R1.11  CNC(=O)c1ccco1 WXVL_AK00442SC0049 [0,0,1,1,0,0|0,0,2]=4
50  B9R1.11  CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,1,1,0,0|1,0,1]=4
51  B9R1.11  CNC(=O)c1ccno1 WXVL_AK00442SC0080 [0,0,1,1,0,0|1,0,1]=4