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ALA3806198 Name:
serratidine
Mol. Formula:
C16H23NO2
M.W.:
261.36
Type:
Small molecule
AlogP:
1.90
Polar Surface Area:
40.54
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.68
DETAILS
CLOSE
ALA3805710 Name:
lycopodine
Mol. Formula:
C16H25NO
M.W.:
247.38
Type:
Small molecule
AlogP:
2.87
Polar Surface Area:
20.31
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.66
DETAILS
CLOSE
ALA3805411 Name:
huperzine E
Mol. Formula:
C16H21NO2
M.W.:
259.35
Type:
Small molecule
AlogP:
2.45
Polar Surface Area:
40.54
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.73
DETAILS
CLOSE
ALA3806307 Name:
N-methylhuperzine B
Mol. Formula:
C17H22N2O
M.W.:
270.38
Type:
Small molecule
AlogP:
2.43
Polar Surface Area:
36.10
HBA:
2
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
Y
QED Weighted:
0.74
DETAILS
CLOSE
ALA3805795 Name:
Dihydrodeoxyserralongamine B
Mol. Formula:
C30H53N3
M.W.:
455.78
Type:
Small molecule
AlogP:
5.65
Polar Surface Area:
18.51
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA3805043 Name:
Serralongamine D
Mol. Formula:
C28H49N3
M.W.:
427.72
Type:
Small molecule
AlogP:
4.91
Polar Surface Area:
27.30
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA3805648 Name:
Serralongamine C
Mol. Formula:
C29H51N3
M.W.:
441.75
Type:
Small molecule
AlogP:
5.26
Polar Surface Area:
18.51
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA3806116 Name:
Serralongamine B
Mol. Formula:
C30H51N3O
M.W.:
469.76
Type:
Small molecule
AlogP:
5.17
Polar Surface Area:
35.58
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
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