Compounds

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ALA4872271
Name:
4-(isopropylamino)quinoline-6-carbonitrile
Mol. Formula:
C13H13N3
M.W.:
211.27
4 activity values
2 unique targets
Type:
Unknown
AlogP:
2.93
Polar Surface Area:
48.71
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.83
DETAILS
CLOSE
ALA4868408
Name:
4-(benzylamino)quinoline-6-carbonitrile
Mol. Formula:
C13H13N3
M.W.:
211.27
4 activity values
2 unique targets
Type:
Unknown
AlogP:
2.93
Polar Surface Area:
48.71
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.85
DETAILS
CLOSE
ALA4855789
Name:
4-(phenethylamino)quinoline-6-carbonitrile
Mol. Formula:
C18H15N3
M.W.:
273.34
7 activity values
4 unique targets
Type:
Unknown
AlogP:
3.76
Polar Surface Area:
48.71
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4855534
Name:
4-(propylamino)quinoline-6-carbonitrile
Mol. Formula:
C17H13N3
M.W.:
259.31
4 activity values
2 unique targets
Type:
Unknown
AlogP:
3.72
Polar Surface Area:
48.71
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE