Type:
UnknownAlogP:
5.58Polar Surface Area:
83.83HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.53DETAILS
Type:
UnknownAlogP:
3.08Polar Surface Area:
66.48HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILS
Type:
UnknownAlogP:
5.17Polar Surface Area:
100.90HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.54DETAILS
Type:
UnknownAlogP:
6.10Polar Surface Area:
43.37HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS
Type:
UnknownAlogP:
5.55Polar Surface Area:
108.36HBA:
7HBD:
1#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.45DETAILS-
Type:
UnknownAlogP:
4.95Polar Surface Area:
81.78HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
4.23Polar Surface Area:
80.67HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
UnknownAlogP:
5.34Polar Surface Area:
102.29HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS - ALA4870394
Name:
Methyl ent-16-oxobeyeran-19-oateCas Number:
30217-41-5Mol. Formula:
C21H32O3M.W.:
332.48Type:
UnknownAlogP:
4.53Polar Surface Area:
43.37HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
UnknownAlogP:
1.38Polar Surface Area:
79.23HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
UnknownAlogP:
5.38Polar Surface Area:
97.74HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
UnknownAlogP:
5.33Polar Surface Area:
93.06HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
UnknownAlogP:
1.38Polar Surface Area:
79.23HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
UnknownAlogP:
5.54Polar Surface Area:
99.13HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
UnknownAlogP:
5.18Polar Surface Area:
97.08HBA:
7HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
UnknownAlogP:
5.26Polar Surface Area:
93.06HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
UnknownAlogP:
4.97Polar Surface Area:
100.24HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
UnknownAlogP:
1.38Polar Surface Area:
79.23HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
UnknownAlogP:
4.97Polar Surface Area:
100.24HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
UnknownAlogP:
5.54Polar Surface Area:
99.13HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.50DETAILS
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