ALA2017165Name:
3-oxo-1,3-diphenylpropyl dimethylcarbamodithioateMol. Formula:
C18H19NOS2M.W.:
329.49Type:
Small moleculeAlogP:
4.58Polar Surface Area:
20.31HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.59DETAILS
Type:
Small moleculeAlogP:
6.74Polar Surface Area:
41.99HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.27DETAILS
Type:
Small moleculeAlogP:
4.35Polar Surface Area:
29.54HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.58DETAILS
Type:
Small moleculeAlogP:
5.50Polar Surface Area:
20.31HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.51DETAILS
Type:
Small moleculeAlogP:
5.11Polar Surface Area:
20.31HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS-
Type:
Small moleculeAlogP:
3.47Polar Surface Area:
40.71HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
Small moleculeAlogP:
3.08Polar Surface Area:
40.71HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
3.42Polar Surface Area:
31.92HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS -
Type:
Small moleculeAlogP:
2.64Polar Surface Area:
31.92HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
3.57Polar Surface Area:
31.92HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
2.41Polar Surface Area:
41.15HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
3.18Polar Surface Area:
31.92HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.85DETAILS
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