Compounds

Select all

ALA4875238
Name:
N-(2-chloro-4-methylthiophen-3-yl)-2-(2-methyl-6-(4-methylpiperazin-1-yl)pyShow More⌵
Mol. Formula:
C19H22ClN7OS2
M.W.:
464.02
9 activity values
7 unique targets
Type:
Unknown
AlogP:
4.01
Polar Surface Area:
86.28
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4865466
Name:
2-(6-(4-acetylpiperazin-1-yl)-2-methylpyrimidin-4-ylamino)-N-(2-chloro-4-meShow More⌵
Mol. Formula:
C20H22ClN7O2S2
M.W.:
492.03
4 activity values
4 unique targets
Type:
Unknown
AlogP:
3.93
Polar Surface Area:
103.35
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA4859969
Name:
N-(2,4-dichlorothiophen-3-yl)-2-(6-(4-(2-hydroxyethyl)piperazin-1-yl)-2-metShow More⌵
Mol. Formula:
C19H21Cl2N7O2S2
M.W.:
514.46
7 activity values
5 unique targets
Type:
Unknown
AlogP:
3.72
Polar Surface Area:
106.51
HBA:
10
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4847716
Name:
N-(4-chloro-2-methylthiophen-3-yl)-2-(6-(4-(2-hydroxyethyl)piperazin-1-yl)-Show More⌵
Mol. Formula:
C20H24ClN7O2S2
M.W.:
494.05
7 activity values
5 unique targets
Type:
Unknown
AlogP:
3.38
Polar Surface Area:
106.51
HBA:
10
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE