Compounds

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ALA3126676
Name:
4-((4-cyano-4-(pyridin-2-yl)piperidin-1-yl)methyl)-N-((1S,2S)-2-hydroxycyclShow More⌵
Mol. Formula:
C30H34N4O3
M.W.:
498.63
5 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.33
Polar Surface Area:
98.48
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.52
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ALA2074752
Name:
N-(n-pentyl)-quinidinium
Mol. Formula:
C25H35N2O2+
M.W.:
395.57
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
4.88
Polar Surface Area:
42.35
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
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ALA1742475
Name:
Flezelastine
Mol. Formula:
C29H30FN3O
M.W.:
455.58
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
5.40
Polar Surface Area:
38.13
HBA:
4
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE