Type:
Small moleculeAlogP:
2.78Polar Surface Area:
60.17HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.84DETAILS
Type:
Small moleculeAlogP:
3.17Polar Surface Area:
45.59HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS
Type:
Small moleculeAlogP:
5.58Polar Surface Area:
35.01HBA:
5HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.43DETAILS
Type:
Small moleculeAlogP:
5.63Polar Surface Area:
22.12HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.56DETAILS
Type:
Small moleculeAlogP:
6.13Polar Surface Area:
22.12HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.40DETAILS-
Type:
Small moleculeAlogP:
4.97Polar Surface Area:
22.12HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA560600
Name:
3-((4-methoxyphenyl)(o-tolylthio)methyl)pyridineMol. Formula:
C20H19NOSM.W.:
321.45Type:
Small moleculeAlogP:
5.28Polar Surface Area:
22.12HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.60DETAILS - ALA560880
Name:
2-((4-methoxyphenyl)(p-tolylthio)methyl)pyridineMol. Formula:
C20H19NOSM.W.:
321.45Type:
Small moleculeAlogP:
5.28Polar Surface Area:
22.12HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.60DETAILS - ALA560680
Name:
3-((4-methoxyphenyl)(p-tolylthio)methyl)pyridineMol. Formula:
C20H19NOSM.W.:
321.45Type:
Small moleculeAlogP:
5.28Polar Surface Area:
22.12HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
Small moleculeAlogP:
3.67Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
4.22Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
3.56Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
3.56Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
2.92Polar Surface Area:
124.43HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
2.92Polar Surface Area:
124.43HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
3.53Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
Small moleculeAlogP:
3.22Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
3.22Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
2.91Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.53DETAILS -
Type:
Small moleculeAlogP:
3.67Polar Surface Area:
115.20HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.45DETAILS
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