Type:
---AlogP:
4.27Polar Surface Area:
50.19HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.28DETAILS
ALA5281282Name:
5-(4-((4-methylpiperidin-1-yl)sulfonyl)phenyl)isoxazoleMol. Formula:
C15H18N2O3SM.W.:
306.39Type:
---AlogP:
2.76Polar Surface Area:
63.41HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.87DETAILS
ALA5275527Name:
2-amino-4-(tetrazolo[1,5-a]quinolin-4-yl)-4H-chromene-3-carbonitrileMol. Formula:
C19H12N6OM.W.:
340.35Type:
---AlogP:
2.50Polar Surface Area:
102.12HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.57DETAILS
ALA5209304Name:
2-((3-chloro-2-methylphenyl)amino)-N-(4-sulfamoylphenyl)benzamideMol. Formula:
C20H18ClN3O3SM.W.:
415.90Type:
---AlogP:
4.29Polar Surface Area:
101.29HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.58DETAILS
ALA5209187Name:
diethyl 6-(4-methoxyphenyl)-7H-indeno[2,1-c]quinolin-2-ylphosphonateMol. Formula:
C27H26NO4PM.W.:
459.48Type:
---AlogP:
6.37Polar Surface Area:
57.65HBA:
5HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.26DETAILS- ALA5208731
Name:
2-((3-chloro-2-methylphenyl)amino)-N-(4-(2-methoxyethoxy)phenyl)benzamideMol. Formula:
C23H23ClN2O3M.W.:
410.90Type:
---AlogP:
5.67Polar Surface Area:
59.59HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA5208640
Name:
diethyl 6-(2,4-difluorophenyl)-7H-indeno[2,1-c]quinolin-2-ylphosphonateMol. Formula:
C26H22F2NO3PM.W.:
465.44Type:
---AlogP:
6.64Polar Surface Area:
48.42HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.26DETAILS - ALA5208490
Name:
2-(4-Trifluoromethoxyphenyl)-4-(phenyl)-5H-indeno[1,2-b]pyridin-5-olMol. Formula:
C25H16F3NO2M.W.:
419.40Type:
---AlogP:
6.38Polar Surface Area:
42.35HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA5208256
Name:
2-(2-Chlorophenyl)-4-(phenyl)-5H-indeno[1,2-b]pyridin-5-olMol. Formula:
C24H16ClNOM.W.:
369.85Type:
---AlogP:
6.13Polar Surface Area:
33.12HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
---AlogP:
5.75Polar Surface Area:
67.79HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA5207666
Name:
2-(3-Trifluoromethylphenyl)-4-(phenyl)-5H-indeno[1,2-b]pyridin-5-olMol. Formula:
C25H16F3NOM.W.:
403.40Type:
---AlogP:
6.50Polar Surface Area:
33.12HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
---AlogP:
7.20Polar Surface Area:
47.56HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
---AlogP:
6.06Polar Surface Area:
56.79HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
---AlogP:
6.70Polar Surface Area:
73.91HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.39DETAILS -
Type:
---AlogP:
5.05Polar Surface Area:
73.39HBA:
4HBD:
4#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA5206014
Name:
2-(3-Fluorophenyl)-4-(phenyl)-5H-indeno[1,2-b]pyridin-5-olMol. Formula:
C24H16FNOM.W.:
353.40Type:
---AlogP:
5.62Polar Surface Area:
33.12HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA5203701
Name:
diethyl 6-(4-methoxyphenyl)-7-oxo-7H-indeno[2,1-c]quinolin-4-ylphosphonateMol. Formula:
C27H24NO5PM.W.:
473.47Type:
---AlogP:
6.01Polar Surface Area:
74.72HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.27DETAILS -
Type:
---AlogP:
7.20Polar Surface Area:
47.56HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.29DETAILS - ALA5203187
Name:
diethyl 6-(4-fluorophenyl)-7H-indeno[2,1-c]quinolin-4-ylphosphonateMol. Formula:
C26H23FNO3PM.W.:
447.45Type:
---AlogP:
6.50Polar Surface Area:
48.42HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
---AlogP:
2.13Polar Surface Area:
83.24HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS
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