Type:
---AlogP:
4.04Polar Surface Area:
81.06HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.51DETAILS
Type:
---AlogP:
4.67Polar Surface Area:
61.19HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.41DETAILS
Type:
---AlogP:
5.08Polar Surface Area:
73.22HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.35DETAILS
Type:
---AlogP:
4.94Polar Surface Area:
74.33HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
Small moleculeAlogP:
3.29Polar Surface Area:
62.12HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS-
Type:
Small moleculeAlogP:
3.57Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.92DETAILS -
Type:
Small moleculeAlogP:
3.18Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.92DETAILS -
Type:
Small moleculeAlogP:
4.33Polar Surface Area:
29.10HBA:
1HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
Small moleculeAlogP:
4.29Polar Surface Area:
29.10HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.90DETAILS -
Type:
Small moleculeAlogP:
3.90Polar Surface Area:
29.10HBA:
1HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.89DETAILS -
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.92DETAILS -
Type:
Small moleculeAlogP:
3.81Polar Surface Area:
29.10HBA:
1HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.84DETAILS -
Type:
Small moleculeAlogP:
3.58Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.92DETAILS -
Type:
Small moleculeAlogP:
3.31Polar Surface Area:
52.16HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS -
Type:
Small moleculeAlogP:
2.92Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.89DETAILS -
Type:
Small moleculeAlogP:
2.98Polar Surface Area:
63.24HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.92DETAILS - ALA2286938
Name:
N-(1-(4-chlorophenyl)ethyl)-2-cyanopropanamideMol. Formula:
C12H13ClN2OM.W.:
236.70Type:
Small moleculeAlogP:
2.68Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.88DETAILS -
Type:
Small moleculeAlogP:
3.31Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA2286936
Name:
N-(1-(4-chlorophenyl)ethyl)-2-cyanohexanamideMol. Formula:
C15H19ClN2OM.W.:
278.78Type:
Small moleculeAlogP:
3.85Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
52.89HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.89DETAILS
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