Type:
Small moleculeAlogP:
3.71Polar Surface Area:
73.66HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.75DETAILS
ALA4167395Name:
4-Fluoro-N-[6-(2-fluoro-3-hydroxyphenyl)pyridin-2-yl]-3-hydroxybenzamideMol. Formula:
C18H12F2N2O3M.W.:
342.30Type:
Small moleculeAlogP:
3.69Polar Surface Area:
82.45HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.68DETAILS
ALA4163706Name:
(4-Fluoro-3-methoxyphenyl)(quinolin-2-yl)methanoneMol. Formula:
C17H12FNO2M.W.:
281.29Type:
Small moleculeAlogP:
3.61Polar Surface Area:
39.19HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.69DETAILS
Type:
Small moleculeAlogP:
3.69Polar Surface Area:
82.45HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.68DETAILS
ALA3983947Name:
(4-Fluoro-3-hydroxyphenyl)[6-(piperidin-1-yl)pyridin-2-yl]methanoneMol. Formula:
C17H17FN2O2M.W.:
300.33Type:
Small moleculeAlogP:
3.15Polar Surface Area:
53.43HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.88DETAILS- ALA3975921
Name:
(4-Fluoro-3-hydroxyphenyl)(pyridin-2-yl)methanoneMol. Formula:
C12H8FNO2M.W.:
217.20Type:
Small moleculeAlogP:
2.16Polar Surface Area:
50.19HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.78DETAILS - ALA3975350
Name:
(4-Fluoro-3-hydroxyphenyl)[6-(4-fluorophenyl)pyridin-2-yl]methanoneMol. Formula:
C18H11F2NO2M.W.:
311.29Type:
Small moleculeAlogP:
3.96Polar Surface Area:
50.19HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3974385
Name:
(4-Fluoro-3-hydroxyphenyl)[6-phenylpyridin-2-yl]methanoneMol. Formula:
C18H12FNO2M.W.:
293.30Type:
Small moleculeAlogP:
3.82Polar Surface Area:
50.19HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.75DETAILS -
Type:
Small moleculeAlogP:
3.16Polar Surface Area:
90.65HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA3965905
Name:
(4-Fluoro-3-hydroxyphenyl)[6-(3-hydroxylphenyl)pyridin-2-yl]methanoneMol. Formula:
C18H12FNO3M.W.:
309.30Type:
Small moleculeAlogP:
3.53Polar Surface Area:
70.42HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA3964826
Name:
(4-Fluoro-3-hydroxyphenyl)[6-(thiophen-3-yl)pyridin-2-yl]methanoneMol. Formula:
C16H10FNO2SM.W.:
299.33Type:
Small moleculeAlogP:
3.89Polar Surface Area:
50.19HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA3962753
Name:
(2,3-Dihydroxyphenyl)[6-(3-hydroxyphenyl)pyridin-2-yl]methanoneMol. Formula:
C18H13NO4M.W.:
307.31Type:
Small moleculeAlogP:
3.10Polar Surface Area:
90.65HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
3.84Polar Surface Area:
70.42HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
Small moleculeAlogP:
4.62Polar Surface Area:
50.19HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
Small moleculeAlogP:
3.81Polar Surface Area:
70.42HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.71DETAILS -
Type:
Small moleculeAlogP:
5.35Polar Surface Area:
90.65HBA:
5HBD:
3#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.38DETAILS - ALA3932242
Name:
[6-(2-Fluoro-3-hydroxyphenyl)pyridin-2-yl](2-hydroxyphenyl)methanoneMol. Formula:
C18H12FNO3M.W.:
309.30Type:
Small moleculeAlogP:
3.53Polar Surface Area:
70.42HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
5.52Polar Surface Area:
90.65HBA:
5HBD:
3#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.37DETAILS - ALA3924502
Name:
[6-(2-Fluoro-3-hydroxyphenyl)pyridin-2-yl](2,3,4-trihydroxyphenyl)methanoneMol. Formula:
C18H12FNO5M.W.:
341.29Type:
Small moleculeAlogP:
2.94Polar Surface Area:
110.88HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.43DETAILS - ALA3923295
Name:
[6-(2-Fluoro-3-hydroxyphenyl)pyridin-2-yl](2,3,6-trihydroxyphenyl)methanoneMol. Formula:
C18H12FNO5M.W.:
341.29Type:
Small moleculeAlogP:
2.94Polar Surface Area:
110.88HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.33DETAILS
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