Type:
UnknownAlogP:
4.25Polar Surface Area:
34.59HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.68DETAILS
ALA4537153Name:
4-(4-methoxyphenyl)-5-n-butyl-thiazol-2-ylamineCas Number:
406723-22-6Mol. Formula:
C14H18N2OSM.W.:
262.38Type:
UnknownAlogP:
3.74Polar Surface Area:
48.14HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.89DETAILS
Type:
UnknownAlogP:
4.52Polar Surface Area:
102.68HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS
Type:
UnknownAlogP:
4.23Polar Surface Area:
122.91HBA:
7HBD:
5#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.39DETAILS
Type:
UnknownAlogP:
4.96Polar Surface Area:
102.68HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.32DETAILS-
Type:
UnknownAlogP:
3.82Polar Surface Area:
37.39HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILS -
Type:
UnknownAlogP:
3.49Polar Surface Area:
102.68HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
UnknownAlogP:
3.19Polar Surface Area:
122.91HBA:
7HBD:
5#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
UnknownAlogP:
5.01Polar Surface Area:
122.91HBA:
7HBD:
5#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
UnknownAlogP:
4.68Polar Surface Area:
145.82HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.18DETAILS - ALA4437327
Name:
4-(4-methoxyphenyl)-5-phenylethylthiazol-2-ylamineMol. Formula:
C18H18N2OSM.W.:
310.42Type:
UnknownAlogP:
4.19Polar Surface Area:
48.14HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
Small moleculeAlogP:
8.20Polar Surface Area:
59.08HBA:
4HBD:
---#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.32DETAILS
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