Type:
UnknownAlogP:
2.84Polar Surface Area:
130.75HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILSType:
UnknownAlogP:
4.21Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.44DETAILSType:
UnknownAlogP:
2.92Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.56DETAILSType:
UnknownAlogP:
4.61Polar Surface Area:
46.17HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS- ALA4520442
Name:
3-hexyl-4-methyl-2-oxo-2H-chromen-7-yl sulfamateMol. Formula:
C16H21NO5SM.W.:
339.41Type:
UnknownAlogP:
2.81Polar Surface Area:
99.60HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.62DETAILS Type:
UnknownAlogP:
3.70Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.46DETAILSType:
UnknownAlogP:
3.43Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.54DETAILSType:
UnknownAlogP:
2.78Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.58DETAILSType:
UnknownAlogP:
6.21Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
2#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.22DETAILSType:
UnknownAlogP:
2.92Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.56DETAILS- ALA4529949
Name:
4-(2-tridecanamidoethyl)phenyl sulfamateCas Number:
183560-60-3Mol. Formula:
C21H36N2O4SM.W.:
412.60Type:
UnknownAlogP:
4.24Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.40DETAILS Type:
UnknownAlogP:
2.11Polar Surface Area:
158.44HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.43DETAILSType:
UnknownAlogP:
2.30Polar Surface Area:
119.66HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.71DETAILSType:
UnknownAlogP:
2.38Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.79DETAILSType:
UnknownAlogP:
3.43Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.54DETAILSType:
UnknownAlogP:
2.08Polar Surface Area:
130.75HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.60DETAILSType:
UnknownAlogP:
2.93Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.75DETAILSType:
UnknownAlogP:
2.39Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.62DETAILSType:
UnknownAlogP:
3.70Polar Surface Area:
104.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.46DETAILS