Type:
---AlogP:
5.47Polar Surface Area:
91.29HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.28DETAILS
Type:
UnknownAlogP:
0.55Polar Surface Area:
73.22HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.50DETAILS
Type:
UnknownAlogP:
2.37Polar Surface Area:
59.06HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.49DETAILS
Type:
UnknownAlogP:
1.64Polar Surface Area:
60.69HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.65DETAILS
Type:
UnknownAlogP:
1.12Polar Surface Area:
79.29HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.46DETAILS-
Type:
UnknownAlogP:
1.97Polar Surface Area:
60.69HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
UnknownAlogP:
1.34Polar Surface Area:
79.29HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
2.05Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.84DETAILS -
Type:
UnknownAlogP:
0.98Polar Surface Area:
70.06HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
UnknownAlogP:
0.74Polar Surface Area:
77.76HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
1.64Polar Surface Area:
60.69HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
UnknownAlogP:
0.77Polar Surface Area:
73.22HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
7.31Polar Surface Area:
39.19HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
4.48Polar Surface Area:
50.19HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA4226012
Name:
ethyl 4-(5-methyl-4-phenylthiazol-2-yl)benzoateMol. Formula:
C19H17NO2SM.W.:
323.42Type:
Small moleculeAlogP:
4.96Polar Surface Area:
39.19HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
6.83Polar Surface Area:
50.19HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
5.27Polar Surface Area:
75.63HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
5.33Polar Surface Area:
70.00HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
Small moleculeAlogP:
7.07Polar Surface Area:
69.64HBA:
3HBD:
2#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
Small moleculeAlogP:
6.77Polar Surface Area:
70.00HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.33DETAILS
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