ALA2338805Name:
6-(3,5-dimethoxyphenethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C14H16N2O4M.W.:
276.29Type:
Small moleculeAlogP:
1.28Polar Surface Area:
84.44HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.86DETAILS
ALA2338804Name:
6-(3,5-bis(trifluoromethyl)phenethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C14H10F6N2O2M.W.:
352.23Type:
Small moleculeAlogP:
3.30Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.83DETAILS
ALA2338802Name:
4-hydroxy-6-(4-methoxyphenethyl)pyridazin-3(2H)-oneMol. Formula:
C13H14N2O3M.W.:
246.27Type:
Small moleculeAlogP:
1.27Polar Surface Area:
75.21HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.85DETAILS
ALA2338801Name:
4-hydroxy-6-(4-(trifluoromethyl)phenethyl)pyridazin-3(2H)-oneMol. Formula:
C13H11F3N2O2M.W.:
284.24Type:
Small moleculeAlogP:
2.28Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS
ALA2338800Name:
6-(4-fluorophenethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C12H11FN2O2M.W.:
234.23Type:
Small moleculeAlogP:
1.40Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.84DETAILS- ALA2338799
Name:
4-hydroxy-6-(3-methoxyphenethyl)pyridazin-3(2H)-oneMol. Formula:
C13H14N2O3M.W.:
246.27Type:
Small moleculeAlogP:
1.27Polar Surface Area:
75.21HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.85DETAILS - ALA2338798
Name:
4-hydroxy-6-(3-(trifluoromethyl)phenethyl)pyridazin-3(2H)-oneMol. Formula:
C13H11F3N2O2M.W.:
284.24Type:
Small moleculeAlogP:
2.28Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA2338797
Name:
6-(3-fluorophenethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C12H11FN2O2M.W.:
234.23Type:
Small moleculeAlogP:
1.40Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.84DETAILS - ALA2338796
Name:
4-hydroxy-6-(2-(trifluoromethyl)phenethyl)pyridazin-3(2H)-oneMol. Formula:
C13H11F3N2O2M.W.:
284.24Type:
Small moleculeAlogP:
2.28Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA2338795
Name:
6-(2-fluorophenethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C12H11FN2O2M.W.:
234.23Type:
Small moleculeAlogP:
1.40Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.84DETAILS -
Type:
Small moleculeAlogP:
1.05Polar Surface Area:
75.21HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.81DETAILS - ALA2338793
Name:
6-(3,3-dimethylbutyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C10H16N2O2M.W.:
196.25Type:
Small moleculeAlogP:
1.45Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.75DETAILS -
Type:
Small moleculeAlogP:
1.52Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA2338791
Name:
(E)-6-(4-chlorostyryl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C12H9ClN2O2M.W.:
248.67Type:
Small moleculeAlogP:
2.30Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA2338790
Name:
6-(4-chlorophenethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C12H11ClN2O2M.W.:
250.69Type:
Small moleculeAlogP:
1.91Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.87DETAILS - ALA2338789
Name:
6-(2-cyclohexylethyl)-4-hydroxypyridazin-3(2H)-oneMol. Formula:
C12H18N2O2M.W.:
222.29Type:
Small moleculeAlogP:
1.99Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS - ALA2338788
Name:
4-hydroxy-6-(3-phenylpropyl)pyridazin-3(2H)-oneMol. Formula:
C13H14N2O2M.W.:
230.27Type:
Small moleculeAlogP:
1.65Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.84DETAILS -
Type:
Small moleculeAlogP:
1.63Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.80DETAILS -
Type:
Small moleculeAlogP:
1.26Polar Surface Area:
65.98HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.81DETAILS -
Type:
Small moleculeAlogP:
1.54Polar Surface Area:
53.09HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.64DETAILS
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