ALA5282548Name:
Benzyl (S)-(2-(2-formylpyrrolidin-1-yl)-2-oxoethyl)carbamateMol. Formula:
C15H18N2O4M.W.:
290.32Type:
---AlogP:
1.10Polar Surface Area:
75.71HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
UnknownAlogP:
4.54Polar Surface Area:
64.59HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.44DETAILS
Type:
UnknownAlogP:
5.39Polar Surface Area:
40.80HBA:
5HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.30DETAILS
Type:
UnknownAlogP:
5.28Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.40DETAILS
Type:
UnknownAlogP:
4.68Polar Surface Area:
50.03HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS-
Type:
UnknownAlogP:
4.68Polar Surface Area:
50.03HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
UnknownAlogP:
5.43Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
UnknownAlogP:
4.57Polar Surface Area:
83.94HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
UnknownAlogP:
4.98Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
UnknownAlogP:
5.79Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
UnknownAlogP:
4.98Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
UnknownAlogP:
5.32Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
5.23Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA4752175
Name:
9-O-(4-trifluormethylbenzyl)berberine bromideMol. Formula:
C27H21BrF3NO4M.W.:
560.37Type:
UnknownAlogP:
5.69Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
UnknownAlogP:
5.32Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
4.45Polar Surface Area:
67.10HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
UnknownAlogP:
5.82Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
UnknownAlogP:
5.97Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
UnknownAlogP:
4.98Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
UnknownAlogP:
5.43Polar Surface Area:
40.80HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.36DETAILS
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