ALA2289350Name:
2-acetyl-6-(4,6-dimethoxypyrimidin-2-yloxy)benzoic acidMol. Formula:
C15H14N2O6M.W.:
318.29Type:
Small moleculeAlogP:
2.19Polar Surface Area:
107.84HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.81DETAILS
ALA2289348Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-6-propylbenzoic acidMol. Formula:
C16H18N2O5M.W.:
318.33Type:
Small moleculeAlogP:
2.94Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.84DETAILS
ALA2289341Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-(trifluoromethyl)benzoic acidMol. Formula:
C14H11F3N2O5M.W.:
344.25Type:
Small moleculeAlogP:
3.00Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.89DETAILS
ALA2289340Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-(methylamino)benzoic acidMol. Formula:
C14H15N3O5M.W.:
305.29Type:
Small moleculeAlogP:
2.03Polar Surface Area:
102.80HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.84DETAILS
ALA2289339Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-(1H-pyrrol-1-yl)benzoic acidMol. Formula:
C17H15N3O5M.W.:
341.32Type:
Small moleculeAlogP:
2.78Polar Surface Area:
95.70HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.74DETAILS- ALA2289338
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-iodobenzoic acidMol. Formula:
C13H11IN2O5M.W.:
402.14Type:
Small moleculeAlogP:
2.59Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA2289337
Name:
5-bromo-2-(4,6-dimethoxypyrimidin-2-yloxy)benzoic acidMol. Formula:
C13H11BrN2O5M.W.:
355.14Type:
Small moleculeAlogP:
2.75Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA2289336
Name:
5-chloro-2-(4,6-dimethoxypyrimidin-2-yloxy)benzoic acidMol. Formula:
C13H11ClN2O5M.W.:
310.69Type:
Small moleculeAlogP:
2.64Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA2289335
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-fluorobenzoic acidMol. Formula:
C13H11FN2O5M.W.:
294.24Type:
Small moleculeAlogP:
2.12Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA2289334
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-isopropoxybenzoic acidMol. Formula:
C16H18N2O6M.W.:
334.33Type:
Small moleculeAlogP:
2.77Polar Surface Area:
100.00HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.82DETAILS - ALA2289333
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-methoxybenzoic acidMol. Formula:
C14H14N2O6M.W.:
306.27Type:
Small moleculeAlogP:
1.99Polar Surface Area:
100.00HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA2289332
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-5-methylbenzoic acidMol. Formula:
C14H14N2O5M.W.:
290.28Type:
Small moleculeAlogP:
2.29Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA2289331
Name:
4-amino-2-(4,6-dimethoxypyrimidin-2-yloxy)benzoic acidMol. Formula:
C13H13N3O5M.W.:
291.26Type:
Small moleculeAlogP:
1.57Polar Surface Area:
116.79HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA2289330
Name:
3-chloro-2-(4,6-dimethoxypyrimidin-2-yloxy)benzoic acidMol. Formula:
C13H11ClN2O5M.W.:
310.69Type:
Small moleculeAlogP:
2.64Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA2289329
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-3-fluorobenzoic acidMol. Formula:
C13H11FN2O5M.W.:
294.24Type:
Small moleculeAlogP:
2.12Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA2289328
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-3-methylbenzoic acidMol. Formula:
C14H14N2O5M.W.:
290.27Type:
Small moleculeAlogP:
2.29Polar Surface Area:
90.77HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA2289312
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-6-(2-ethoxyethoxy)benzoic acidMol. Formula:
C17H20N2O7M.W.:
364.35Type:
Small moleculeAlogP:
2.40Polar Surface Area:
109.23HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA2289311
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-6-(1H-pyrrol-1-yl)benzoic acidMol. Formula:
C17H15N3O5M.W.:
341.32Type:
Small moleculeAlogP:
2.78Polar Surface Area:
95.70HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA2289309
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-6-(propylthio)benzoic acidMol. Formula:
C16H18N2O5SM.W.:
350.40Type:
Small moleculeAlogP:
3.49Polar Surface Area:
90.77HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA2289308
Name:
2-(4,6-dimethoxypyrimidin-2-yloxy)-6-(ethylthio)benzoic acidMol. Formula:
C15H16N2O5SM.W.:
336.37Type:
Small moleculeAlogP:
3.10Polar Surface Area:
90.77HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.77DETAILS
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