- ALA2041752
Name:
N-(3-(5-m-tolyl-1,3,4-oxadiazol-2-yl)phenyl)furan-2-carboxamideMol. Formula:
C20H15N3O3M.W.:
345.36Type:
Small moleculeAlogP:
4.56Polar Surface Area:
81.16HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA2041751
Name:
3-(4-(dimethylamino)phenyl)-1-(furan-2-yl)prop-2-en-1-oneMol. Formula:
C15H15NO2M.W.:
241.29Type:
Small moleculeAlogP:
3.24Polar Surface Area:
33.45HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.61DETAILS - ALA2041532
Name:
2-(2-(4-bromobenzylidene)hydrazinyl)-4,6-diphenylpyrimidineMol. Formula:
C23H17BrN4M.W.:
429.32Type:
Small moleculeAlogP:
6.02Polar Surface Area:
50.17HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.31DETAILS - ALA2041531
Name:
2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,6-diphenylpyrimidineMol. Formula:
C21H18N4M.W.:
326.40Type:
Small moleculeAlogP:
4.61Polar Surface Area:
43.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA230346
Name:
2-allyl-4-(4-(3-allyl-4-hydroxyphenyl)hex-3-en-3-yl)phenolMol. Formula:
C24H28O2M.W.:
348.49Type:
Small moleculeAlogP:
6.29Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.43DETAILS - ALA230345
Name:
2-allyl-4-((3-allyl-4-hydroxyphenyl)(pyridin-2-yl)methyl)phenolMol. Formula:
C24H23NO2M.W.:
357.45Type:
Small moleculeAlogP:
5.13Polar Surface Area:
53.35HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA230242
Name:
2-allyl-4-(1-(3-allyl-4-hydroxyphenyl)-2,2-dichlorovinyl)phenolMol. Formula:
C20H18Cl2O2M.W.:
361.27Type:
Small moleculeAlogP:
5.75Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA230241
Name:
2-allyl-4-(1-(3-allyl-4-hydroxyphenyl)cyclohexyl)phenolMol. Formula:
C24H28O2M.W.:
348.49Type:
Small moleculeAlogP:
5.81Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS - 2,2′-Diallylbisphenol A
Name:
2-allyl-4-[1-(3-allyl-4-hydroxyphenyl)-1-methylethyl]phenolMol. Formula:
C21H24O2M.W.:
308.42Type:
Small moleculeAlogP:
4.88Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.75DETAILS Type:
Small moleculeAlogP:
4.15Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.78DETAILSType:
Small moleculeAlogP:
4.22Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.80DETAILSType:
Small moleculeAlogP:
2.28Polar Surface Area:
66.24HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.79DETAILSType:
Small moleculeAlogP:
4.22Polar Surface Area:
40.46HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.80DETAILS