- ALA2272433
Name:
3-(2-Chloropyridin-4-yl)-N-(4-hydroxyphenethyl)-3-p-tolylacrylamideMol. Formula:
C23H21ClN2O2M.W.:
392.89Type:
Small moleculeAlogP:
4.54Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILS Type:
Small moleculeAlogP:
5.84Polar Surface Area:
60.45HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.33DETAILSType:
Small moleculeAlogP:
5.16Polar Surface Area:
60.45HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.38DETAILSType:
Small moleculeAlogP:
5.16Polar Surface Area:
60.45HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.38DETAILS- ALA2272429
Name:
3-(2-Chloropyridin-4-yl)-N-(3,4-dimethoxyphenethyl)-3-p-tolylacrylamideMol. Formula:
C25H25ClN2O3M.W.:
436.94Type:
Small moleculeAlogP:
4.85Polar Surface Area:
60.45HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.40DETAILS - ALA2272428
Name:
3-(2-Chloropyridin-4-yl)-3-(4-methoxyphenyl)-N-phenethylacrylamideMol. Formula:
C23H21ClN2O2M.W.:
392.89Type:
Small moleculeAlogP:
4.53Polar Surface Area:
51.22HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA2272427
Name:
3-(2-chloropyridin-4-yl)-3-(2,4-dimethylphenyl)-N-phenethylacrylamideMol. Formula:
C24H23ClN2OM.W.:
390.91Type:
Small moleculeAlogP:
5.14Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA2272426
Name:
3-(2-Chloropyridin-4-yl)-3-(3,4-dimethylphenyl)-N-phenethylacrylamideMol. Formula:
C24H23ClN2OM.W.:
390.91Type:
Small moleculeAlogP:
5.14Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA2272425
Name:
(Z)-3-(2-Chloropyridin-4-yl)-3-(4-ethylphenyl)-N-phenethylacrylamideMol. Formula:
C24H23ClN2OM.W.:
390.91Type:
Small moleculeAlogP:
5.09Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA2272424
Name:
3-(2-Chloropyridin-4-yl)-N-phenethyl-3-p-tolylacrylamideMol. Formula:
C23H21ClN2OM.W.:
376.89Type:
Small moleculeAlogP:
4.83Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS Type:
Small moleculeAlogP:
3.83Polar Surface Area:
20.31HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.77DETAILS- ALA2272422
Name:
3-(3,4-Dimethylphenyl)-N-(4-hydroxyphenethyl)-3-(pyridin-4-yl)acrylamideMol. Formula:
C24H24N2O2M.W.:
372.47Type:
Small moleculeAlogP:
4.19Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA2272421
Name:
N-(4-Hydroxyphenethyl)-3-(pyridin-4-yl)-3-p-tolylacrylamideMol. Formula:
C23H22N2O2M.W.:
358.44Type:
Small moleculeAlogP:
3.89Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA2272419
Name:
3-(3,4-Dimethylphenyl)-N-phenethyl-3-(pyridin-4-yl)acrylamideMol. Formula:
C24H24N2OM.W.:
356.47Type:
Small moleculeAlogP:
4.49Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA2272418
Name:
3-(4-Ethylphenyl)-N-phenethyl-3-(pyridin-4-yl)acrylamideMol. Formula:
C24H24N2OM.W.:
356.47Type:
Small moleculeAlogP:
4.43Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA2272417
Name:
N-phenethyl-3-(pyridin-4-yl)-3-p-tolylacrylamideMol. Formula:
C23H22N2OM.W.:
342.44Type:
Small moleculeAlogP:
4.18Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.68DETAILS Type:
Small moleculeAlogP:
5.53Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.40DETAILSType:
Small moleculeAlogP:
4.85Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILSType:
Small moleculeAlogP:
4.85Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS