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ALA3393932 Name:
2-(15-Carboxyhexadecyl)sulfanyl-4,5-dihydro-(1,2-d
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Mol. Formula:
C23H41NO7S
M.W.:
475.65
Type:
Small molecule
AlogP:
3.46
Polar Surface Area:
128.81
HBA:
8
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.24
DETAILS
CLOSE
ALA3393931 Name:
2-(16-Hydroxyhexadecyl)sulfanyl-4,5-dihydro-(1,2-d
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Mol. Formula:
C23H43NO6S
M.W.:
461.67
Type:
Small molecule
AlogP:
3.37
Polar Surface Area:
111.74
HBA:
8
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA3393930 Name:
2-(16-Fluorohexadecyl)sulfanyl-4,5-dihydro-(1,2-di
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Mol. Formula:
C23H42FNO5S
M.W.:
463.66
Type:
Small molecule
AlogP:
4.34
Polar Surface Area:
91.51
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA3393929 Name:
1,16-Bis((4,5-dihydro-(1,2-dideoxy-alpha-D-glucopy
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Mol. Formula:
C30H52N2O10S2
M.W.:
664.88
Type:
Small molecule
AlogP:
2.30
Polar Surface Area:
183.02
HBA:
14
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA3393928 Name:
2-(16-Iodohexadecyl)sulfanyl-4,5-dihydro-(1,2-dide
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Mol. Formula:
C23H42INO5S
M.W.:
571.56
Type:
Small molecule
AlogP:
4.81
Polar Surface Area:
91.51
HBA:
7
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA3393927 Name:
methyl 16-((3aS,5R,6S,7S,7aR)-6,7-dihydroxy-5-(hyd
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Mol. Formula:
C24H43NO7S
M.W.:
489.68
Type:
Small molecule
AlogP:
3.55
Polar Surface Area:
117.81
HBA:
9
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA2409345 Name:
(2S,3R,4R,5S,6R)-2,6-Diethylpiperidine-3,4,5-triol
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Mol. Formula:
C9H20ClNO3
M.W.:
225.72
Type:
Small molecule
AlogP:
-0.77
Polar Surface Area:
72.72
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
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