Type:
---AlogP:
2.23Polar Surface Area:
112.04HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.33DETAILS
Type:
---AlogP:
2.42Polar Surface Area:
112.28HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.46DETAILS
Type:
---AlogP:
0.33Polar Surface Area:
77.57HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.64DETAILS
ALA5278205Name:
3-(2-(4-chlorophenyl)acetamido)isonicotinic acidMol. Formula:
C14H11ClN2O3M.W.:
290.71Type:
---AlogP:
2.61Polar Surface Area:
79.29HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.91DETAILS
Type:
---AlogP:
2.37Polar Surface Area:
112.28HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS-
Type:
---AlogP:
3.91Polar Surface Area:
83.28HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
UnknownAlogP:
4.03Polar Surface Area:
59.39HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
3.14Polar Surface Area:
73.22HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
UnknownAlogP:
2.00Polar Surface Area:
72.28HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.71DETAILS -
Type:
UnknownAlogP:
-0.22Polar Surface Area:
70.25HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
UnknownAlogP:
2.60Polar Surface Area:
59.39HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
UnknownAlogP:
3.16Polar Surface Area:
59.39HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
UnknownAlogP:
3.39Polar Surface Area:
44.61HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
---AlogP:
1.24Polar Surface Area:
120.87HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
---AlogP:
2.30Polar Surface Area:
108.80HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
---AlogP:
1.51Polar Surface Area:
96.77HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
---AlogP:
2.36Polar Surface Area:
108.80HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
---AlogP:
2.99Polar Surface Area:
70.25HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.81DETAILS -
Type:
---AlogP:
0.28Polar Surface Area:
68.78HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
---AlogP:
2.28Polar Surface Area:
112.08HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS
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