Compounds

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ALA4777933
Name:
(E)-2-(Hept-2'-en-1'-yl)-3-methylquinolin-4(1H)-one N-Oxide
Mol. Formula:
C17H21NO2
M.W.:
271.36
15 activity values
14 unique targets
Type:
Unknown
AlogP:
3.84
Polar Surface Area:
42.23
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4753618
Name:
(E)-2-(Oct-2'-en-1'-yl)-3-methylquinolin-4(1H)-one; Burkholone
Mol. Formula:
C18H23NO
M.W.:
269.39
16 activity values
14 unique targets
Type:
Unknown
AlogP:
4.52
Polar Surface Area:
32.86
HBA:
1
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4752770
Name:
(E)-2-(Non-2'-en-1'-yl)-3-methylquinolin-4(1H)-one N-Oxide
Mol. Formula:
C19H25NO2
M.W.:
299.41
15 activity values
14 unique targets
Type:
Unknown
AlogP:
4.62
Polar Surface Area:
42.23
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4750461
Name:
(E)-2-(Oct-2'-en-1'-yl)-3-methylquinolin-4(1H)-one N-Oxide
Mol. Formula:
C18H23NO2
M.W.:
285.39
15 activity values
14 unique targets
Type:
Unknown
AlogP:
4.23
Polar Surface Area:
42.23
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE