Type:
Small moleculeAlogP:
6.00Polar Surface Area:
96.80HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.31DETAILS
Type:
Small moleculeAlogP:
4.59Polar Surface Area:
118.39HBA:
8HBD:
1#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.37DETAILS
Type:
Small moleculeAlogP:
5.08Polar Surface Area:
113.96HBA:
8HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.34DETAILS
Type:
Small moleculeAlogP:
5.64Polar Surface Area:
97.05HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.42DETAILS
Type:
Small moleculeAlogP:
5.14Polar Surface Area:
96.80HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.45DETAILS-
Type:
Small moleculeAlogP:
5.51Polar Surface Area:
97.05HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
Small moleculeAlogP:
5.07Polar Surface Area:
96.80HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
Small moleculeAlogP:
4.71Polar Surface Area:
113.96HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
5.53Polar Surface Area:
96.80HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
5.60Polar Surface Area:
97.05HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.36DETAILS - Benzoic acid, 4-(((2,3-dihydro-6-((2-methylpropyl)(2-thiazolylsulfonyl)amino)-1H-inden-5-yl)oxy)methyl)-3-methyl-
Name:
US9181187, Compound AMol. Formula:
C25H28N2O5S2M.W.:
500.64Type:
Small moleculeAlogP:
5.07Polar Surface Area:
96.80HBA:
6HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
Small moleculeAlogP:
5.33Polar Surface Area:
97.05HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
7.12Polar Surface Area:
85.36HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.23DETAILS -
Type:
Small moleculeAlogP:
5.17Polar Surface Area:
85.36HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.43DETAILS - ALA2315057
Name:
6-(5-chloro-2-(4-chloro-2-fluorobenzyloxy)benzyl)-N-tosylpicolinamideMol. Formula:
C27H21Cl2FN2O4SM.W.:
559.45Type:
Small moleculeAlogP:
6.12Polar Surface Area:
85.36HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
7.12Polar Surface Area:
85.36HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.23DETAILS -
Type:
Small moleculeAlogP:
6.47Polar Surface Area:
85.36HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.26DETAILS - ALA2315054
Name:
6-(5-chloro-2-(4-chloro-2-fluorobenzyloxy)benzyl)picolinamideMol. Formula:
C20H15Cl2FN2O2M.W.:
405.26Type:
Small moleculeAlogP:
4.80Polar Surface Area:
65.21HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
6.62Polar Surface Area:
51.22HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.40DETAILS - ALA2315052
Name:
6-(5-chloro-2-(4-chloro-2-fluorobenzyloxy)benzyl)-N,N-diethylpicolinamideMol. Formula:
C24H23Cl2FN2O2M.W.:
461.36Type:
Small moleculeAlogP:
6.18Polar Surface Area:
42.43HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.40DETAILS
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