Compounds

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ALA3645467
Name:
US8586620, 59

Mol. Formula:
C18H22N4S
M.W.:
326.47

3 activity values

3 unique targets
Type:
Small molecule
AlogP:
3.24
Polar Surface Area:
57.41
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA3645466
Name:
US8586620, 15

Mol. Formula:
C18H22N4S
M.W.:
326.47

4 activity values

4 unique targets
Type:
Small molecule
AlogP:
3.76
Polar Surface Area:
57.41
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA1963529
Name:
CHEMBL1957353::US8586620, 43

Mol. Formula:
C19H22N4S
M.W.:
338.48

Type:
Small molecule
AlogP:
4.08
Polar Surface Area:
57.41
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA1963527
Name:
CHEMBL1957349::US8586620, 42

Mol. Formula:
C19H20N4S
M.W.:
336.46

Type:
Small molecule
AlogP:
3.99
Polar Surface Area:
57.41
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA1963156
Name:
CHEMBL1957354::US8586620, 47

Mol. Formula:
C19H22N4O
M.W.:
322.41

Type:
Small molecule
AlogP:
3.61
Polar Surface Area:
70.55
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE