Type:
UnknownAlogP:
1.40Polar Surface Area:
97.35HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.45DETAILS
ALA4514605Name:
5-acetamido-2-(azepan-1-yl)benzoic acidCas Number:
1224012-97-8Mol. Formula:
C15H20N2O3M.W.:
276.34Type:
UnknownAlogP:
2.72Polar Surface Area:
69.64HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.89DETAILS
Type:
UnknownAlogP:
4.63Polar Surface Area:
93.74HBA:
9HBD:
3#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.27DETAILS
Type:
UnknownAlogP:
3.39Polar Surface Area:
78.94HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.58DETAILS
Type:
UnknownAlogP:
4.26Polar Surface Area:
91.83HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.34DETAILS-
Type:
UnknownAlogP:
5.51Polar Surface Area:
57.26HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
3.97Polar Surface Area:
66.91HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
UnknownAlogP:
3.37Polar Surface Area:
104.38HBA:
8HBD:
4#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
UnknownAlogP:
3.28Polar Surface Area:
88.17HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
UnknownAlogP:
6.23Polar Surface Area:
57.26HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.33DETAILS -
Type:
UnknownAlogP:
3.52Polar Surface Area:
105.50HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
UnknownAlogP:
5.20Polar Surface Area:
75.28HBA:
7HBD:
3#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
UnknownAlogP:
4.31Polar Surface Area:
97.40HBA:
9HBD:
3#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.27DETAILS -
Type:
UnknownAlogP:
2.83Polar Surface Area:
66.05HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
UnknownAlogP:
4.31Polar Surface Area:
97.40HBA:
9HBD:
3#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.27DETAILS -
Type:
UnknownAlogP:
4.18Polar Surface Area:
99.48HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.33DETAILS -
Type:
UnknownAlogP:
3.81Polar Surface Area:
121.45HBA:
9HBD:
4#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
UnknownAlogP:
6.53Polar Surface Area:
57.26HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
UnknownAlogP:
3.96Polar Surface Area:
42.23HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.90DETAILS -
Type:
UnknownAlogP:
2.03Polar Surface Area:
101.06HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.48DETAILS
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