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ALA2288955 Name:
(3aR,4S,9R,9aR)-6,7-bis(benzyloxy)-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,Show More⌵
Mol. Formula:
C42H37NO11
M.W.:
731.75
Type:
Small molecule
AlogP:
7.61
Polar Surface Area:
141.89
HBA:
11
HBD:
---
#RO5 Violations:
3
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
CLOSE
ALA2288954 Name:
(3aR,4S,9R,9aR)-6,7-bis(benzyloxy)-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,Show More⌵
Mol. Formula:
C47H42O9
M.W.:
750.84
Type:
Small molecule
AlogP:
8.79
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA2288953 Name:
(3aR,4S,9R,9aR)-6,7-bis(benzyloxy)-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,Show More⌵
Mol. Formula:
C43H40O9
M.W.:
700.78
Type:
Small molecule
AlogP:
7.63
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA2288952 Name:
(3aR,4S,9R,9aR)-6,7-bis(benzyloxy)-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,Show More⌵
Mol. Formula:
C41H44O9
M.W.:
680.79
Type:
Small molecule
AlogP:
7.97
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA2288951 Name:
(3aR,4S,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C30H29NO11
M.W.:
579.56
Type:
Small molecule
AlogP:
4.47
Polar Surface Area:
141.89
HBA:
11
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA2288950 Name:
(3aR,4S,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C35H34O9
M.W.:
598.65
Type:
Small molecule
AlogP:
5.64
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA2288949 Name:
(3aR,4S,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C31H32O9
M.W.:
548.59
Type:
Small molecule
AlogP:
4.49
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA2288948 Name:
(3aR,4S,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C29H36O9
M.W.:
528.60
Type:
Small molecule
AlogP:
4.83
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA2288947 Name:
(3aR,4S,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C27H32O9
M.W.:
500.54
Type:
Small molecule
AlogP:
4.05
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA2288946 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C32H34O9
M.W.:
562.62
Type:
Small molecule
AlogP:
4.88
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA2288945 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C30H29NO11
M.W.:
579.56
Type:
Small molecule
AlogP:
4.47
Polar Surface Area:
141.89
HBA:
11
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA2288944 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C30H29NO11
M.W.:
579.56
Type:
Small molecule
AlogP:
4.47
Polar Surface Area:
141.89
HBA:
11
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA2288943 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C30H29ClO9
M.W.:
569.01
Type:
Small molecule
AlogP:
5.22
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA2288942 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C31H32O9
M.W.:
548.59
Type:
Small molecule
AlogP:
4.87
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA2288941 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C30H30O9
M.W.:
534.56
Type:
Small molecule
AlogP:
4.56
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA2288940 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C35H34O9
M.W.:
598.65
Type:
Small molecule
AlogP:
5.64
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA2288939 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C31H32O9
M.W.:
548.59
Type:
Small molecule
AlogP:
4.49
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA2288938 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C31H40O9
M.W.:
556.65
Type:
Small molecule
AlogP:
5.61
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA2288937 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C29H36O9
M.W.:
528.60
Type:
Small molecule
AlogP:
4.83
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.30
DETAILS
CLOSE
ALA2288936 Name:
(3aR,4R,9R,9aR)-6,7-dimethoxy-1-oxo-9-(3,4,5-trimethoxyphenyl)-1,3,3a,4,9,9Show More⌵
Mol. Formula:
C27H32O9
M.W.:
500.54
Type:
Small molecule
AlogP:
4.05
Polar Surface Area:
98.75
HBA:
9
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
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