Type:
UnknownAlogP:
7.89Polar Surface Area:
170.11HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.14DETAILS
Type:
UnknownAlogP:
4.99Polar Surface Area:
59.04HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS
Type:
UnknownAlogP:
8.84Polar Surface Area:
93.73HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.25DETAILS
Type:
---AlogP:
3.28Polar Surface Area:
76.38HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS
Type:
---AlogP:
3.41Polar Surface Area:
67.15HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.44DETAILS-
Type:
UnknownAlogP:
8.66Polar Surface Area:
90.93HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
UnknownAlogP:
4.58Polar Surface Area:
82.83HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
8.21Polar Surface Area:
83.83HBA:
4HBD:
2#RO5 Violations:
2#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.27DETAILS -
Type:
UnknownAlogP:
8.80Polar Surface Area:
90.93HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
UnknownAlogP:
6.72Polar Surface Area:
59.04HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
UnknownAlogP:
9.23Polar Surface Area:
47.56HBA:
3HBD:
1#RO5 Violations:
2#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.35DETAILS - ALA4534526
Name:
2-O-acetyl-maslinic acidCas Number:
758718-51-3Mol. Formula:
C32H50O5M.W.:
514.75Type:
UnknownAlogP:
6.78Polar Surface Area:
83.83HBA:
4HBD:
2#RO5 Violations:
2#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.31DETAILS -
Type:
UnknownAlogP:
8.58Polar Surface Area:
81.70HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
Small moleculeAlogP:
1.02Polar Surface Area:
78.51HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
Small moleculeAlogP:
7.15Polar Surface Area:
58.64HBA:
4HBD:
1#RO5 Violations:
2#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
9.78Polar Surface Area:
17.07HBA:
2HBD:
---#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
UnknownAlogP:
8.48Polar Surface Area:
41.63HBA:
2HBD:
1#RO5 Violations:
2#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.31DETAILS -
Type:
UnknownAlogP:
3.93Polar Surface Area:
82.83HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
UnknownAlogP:
8.58Polar Surface Area:
81.70HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
UnknownAlogP:
8.10Polar Surface Area:
63.24HBA:
3HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.27DETAILS
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