Compounds

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ALA3986794
Name:
(8S,9S,10R,13S,14S)-6,10,13-trimethyl-17-(pyridin-
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Mol. Formula:
C25H31NO
M.W.:
361.53

8 activity values

4 unique targets
Type:
Small molecule
AlogP:
5.72
Polar Surface Area:
29.96
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA3973535
Name:
(8R,9S,10R,13S,14S)-17-(5-(difluoromethyl)pyridin-
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Mol. Formula:
C26H31F2NO
M.W.:
411.54

8 activity values

4 unique targets
Type:
Small molecule
AlogP:
6.79
Polar Surface Area:
29.96
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA3976223
Name:
(8R,9S,10S,13S)-10,13-dimethyl-17-(4-methylpyridin
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Mol. Formula:
C25H31NO
M.W.:
361.53

8 activity values

4 unique targets
Type:
Small molecule
AlogP:
5.92
Polar Surface Area:
29.96
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA3948301
Name:
(3S,10S,13S)-17-(5-chloropyridin-3-yl)-3,10,13-tri
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Mol. Formula:
C25H34ClNO
M.W.:
400.01

8 activity values

4 unique targets
Type:
Small molecule
AlogP:
6.52
Polar Surface Area:
33.12
HBA:
2
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA3937430
Name:
(8S,9S,10R,13S,14S)-6-fluoro-10,13-dimethyl-17-(py
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Mol. Formula:
C24H28FNO
M.W.:
365.49

8 activity values

4 unique targets
Type:
Small molecule
AlogP:
5.55
Polar Surface Area:
29.96
HBA:
2
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE