Compounds

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ALA1778071
Name:
(N-tert-butyl-N-((4aR,4bS,6aS,7S,9aS,9bS)-4a,6a-dimethyl-2-oxo-2,4a,4b,5,6,Show More⌵
Mol. Formula:
C32H46N4O5S
M.W.:
598.81
13 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.23
Polar Surface Area:
115.89
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.48
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ALA203098
Name:
4-(4-(4-phenoxybenzoyl))phenylbutyric acid
Mol. Formula:
C23H20O4
M.W.:
360.41
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
5.12
Polar Surface Area:
63.60
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.57
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ALA382214
Name:
(3-fluoro-4-(4-phenoxybenzoyl)phenyl)acetic acid
Mol. Formula:
C21H15FO4
M.W.:
350.35
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.48
Polar Surface Area:
63.60
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
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