Compounds

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ALA4250868
Name:
6-(1-(Cyclopropylmethyl)-1H-pyrrol-3-yl)-3-(((7-methoxyquinolin-4-yl)oxy)meShow More⌵
Mol. Formula:
C22H20N6O2S
M.W.:
432.51
7 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.20
Polar Surface Area:
79.36
HBA:
9
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4249969
Name:
6-(3-Fluorophenyl)-3-(((7-methoxyquinolin-4-yl)oxy)methyl)-[1,2,4]triazolo[Show More⌵
Mol. Formula:
C20H14FN5O2S
M.W.:
407.43
7 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.13
Polar Surface Area:
74.43
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4247603
Name:
6-(1-(2-Methoxyethyl)-1H-pyrrol-3-yl)-3-(((7-methoxyquinolin-4-yl)oxy)methyShow More⌵
Mol. Formula:
C21H20N6O3S
M.W.:
436.50
7 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.44
Polar Surface Area:
88.59
HBA:
10
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4247327
Name:
6-(1-Cyclopentyl-1H-pyrrol-3-yl)-3-(((7-methoxyquinolin-4-yl)oxy)methyl)-[1Show More⌵
Mol. Formula:
C23H22N6O2S
M.W.:
446.54
7 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.91
Polar Surface Area:
79.36
HBA:
9
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4239116
Name:
3-(((7-Methoxyquinolin-4-yl)oxy)methyl)-6-(3,4,5-trifluorophenyl)-[1,2,4]trShow More⌵
Mol. Formula:
C20H12F3N5O2S
M.W.:
443.41
7 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.41
Polar Surface Area:
74.43
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE