Type:
---AlogP:
6.28Polar Surface Area:
85.30HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
13Passes Ro3:
NQED Weighted:
0.21DETAILS
Type:
---AlogP:
8.24Polar Surface Area:
101.66HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.21DETAILS
Type:
---AlogP:
4.00Polar Surface Area:
84.86HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.69DETAILS
Type:
---AlogP:
4.69Polar Surface Area:
75.63HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.48DETAILS
Type:
---AlogP:
7.59Polar Surface Area:
101.66HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.23DETAILS-
Type:
---AlogP:
4.39Polar Surface Area:
84.86HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
---AlogP:
7.40Polar Surface Area:
101.66HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
---AlogP:
3.61Polar Surface Area:
84.86HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA5283539
Name:
1-(3-(3-chlorophenethoxy)-4-methoxybenzamido)cycloheptane-1-carboxylic acidMol. Formula:
C24H28ClNO5M.W.:
445.94Type:
---AlogP:
4.88Polar Surface Area:
84.86HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
---AlogP:
5.02Polar Surface Area:
84.86HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
---AlogP:
5.34Polar Surface Area:
96.89HBA:
6HBD:
3#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
---AlogP:
4.65Polar Surface Area:
104.67HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
---AlogP:
4.05Polar Surface Area:
110.46HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
---AlogP:
4.92Polar Surface Area:
102.02HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA5205314
Name:
4-{4-(2,4-Dichlorophenoxy)-5-methyl-1H-pyrazol-3-yl}benzene-1,3-diolMol. Formula:
C16H12Cl2N2O3M.W.:
351.19Type:
---AlogP:
4.90Polar Surface Area:
78.37HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
---AlogP:
5.43Polar Surface Area:
104.67HBA:
5HBD:
3#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
---AlogP:
3.25Polar Surface Area:
121.83HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
---AlogP:
4.00Polar Surface Area:
104.67HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
---AlogP:
4.65Polar Surface Area:
104.67HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
---AlogP:
3.62Polar Surface Area:
104.67HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS
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