Compounds

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ALA3798296
Name:
N,N'-Dibenzyl-N-[2-(dimethylamino)ethyl]-N'-(3-methoxybenzyl)ethane-1,2-diaShow More⌵
Mol. Formula:
C28H37N3O
M.W.:
431.62
5 activity values
5 unique targets
Type:
Small molecule
AlogP:
4.76
Polar Surface Area:
18.95
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.39
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ALA446877
Name:
(2R,7S,8S,9R)-2,7,8-trihydroxy-9-propyl-5-nonen-9-olide
Mol. Formula:
C12H20O5
M.W.:
244.29
14 activity values
14 unique targets
Type:
Small molecule
AlogP:
0.13
Polar Surface Area:
86.99
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA453686
Name:
(7S,8S,9R)-7,8-dihydroxy-9-propyl-5-nonen-9-olide
Mol. Formula:
C12H20O4
M.W.:
228.29
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
1.16
Polar Surface Area:
66.76
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE