Compounds

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ALA3787048
Name:
(E)-N-butyl-3-(4-hydroxy-3-methoxyphenyl)acrylamide
Mol. Formula:
C14H19NO3
M.W.:
249.31
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
2.33
Polar Surface Area:
58.56
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA3787558
Name:
(2E,2'E)-N,N'-(Ethane-1,2-diyl)bis(3-(2,4-dimethoxyphenyl)-acrylamide)
Mol. Formula:
C24H28N2O6
M.W.:
440.50
64 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.68
Polar Surface Area:
95.12
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.41
DETAILS
CLOSE
ALA3787030
Name:
(E)-3-(2,3-Dichlorophenyl)-N-(4-fluorobenzyl)acrylamide
Mol. Formula:
C16H12Cl2FNO
M.W.:
324.18
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
4.46
Polar Surface Area:
29.10
HBA:
1
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE
ALA3787465
Name:
(E)-N-(4-Chlorobenzyl)-3-(4-hydroxy-3-methoxyphenyl)-acrylamide
Mol. Formula:
C17H16ClNO3
M.W.:
317.77
4 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.38
Polar Surface Area:
58.56
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.83
DETAILS
CLOSE