Compounds

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ALA2289676
Name:
(2S,3S)-ethyl 2-(3-(4-isopropylphenyl)acrylamido)-3-methylpentanoate
Mol. Formula:
C20H29NO3
M.W.:
331.46
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.92
Polar Surface Area:
55.40
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA2289673
Name:
(2S,3S)-ethyl 2-(3-(2,4-dichlorophenyl)acrylamido)-3-methylpentanoate
Mol. Formula:
C17H21Cl2NO3
M.W.:
358.26
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
4.10
Polar Surface Area:
55.40
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA2289672
Name:
(2S,3S)-methyl 2-(3-(2,4-dichlorophenyl)acrylamido)-3-methylpentanoate
Mol. Formula:
C16H19Cl2NO3
M.W.:
344.24
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.71
Polar Surface Area:
55.40
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA2289668
Name:
(S)-methyl 2-(3-(2,4-dichlorophenyl)acrylamido)-4-methylpentanoate
Mol. Formula:
C16H19Cl2NO3
M.W.:
344.24
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.71
Polar Surface Area:
55.40
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA2289667
Name:
(S)-ethyl 2-(3-(2,4-dichlorophenyl)acrylamido)-3-methylbutanoate
Mol. Formula:
C16H19Cl2NO3
M.W.:
344.24
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.71
Polar Surface Area:
55.40
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA2285890
Name:
(S)-methyl 2-(3-(4-isopropylphenyl)acrylamido)-4-methylpentanoate
Mol. Formula:
C19H27NO3
M.W.:
317.43
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
3.53
Polar Surface Area:
55.40
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE