Type:
Small moleculeAlogP:
5.84Polar Surface Area:
78.43HBA:
3HBD:
3#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.35DETAILS
ALA3740613Name:
4-(Benzhydrylamino)-N-(naphthalen-2-yl)benzamideMol. Formula:
C30H24N2OM.W.:
428.54Type:
Small moleculeAlogP:
7.29Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.30DETAILS
ALA3739530Name:
4-((Bis(4-bromophenyl)methyl)amino)-N-phenylbenzamideMol. Formula:
C26H20Br2N2OM.W.:
536.27Type:
Small moleculeAlogP:
7.67Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.27DETAILS
ALA3739589Name:
4-(((4-Bromophenyl)(phenyl)methyl)amino)-N-phenylbenzamideMol. Formula:
C26H21BrN2OM.W.:
457.37Type:
Small moleculeAlogP:
6.90Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.33DETAILS
Type:
Small moleculeAlogP:
6.14Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.42DETAILS- ALA3742401
Name:
4-((bis(4-Bromophenyl)methyl)amino)benzoic acidMol. Formula:
C20H15Br2NO2M.W.:
461.15Type:
Small moleculeAlogP:
6.11Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA3740852
Name:
4-(((4-Bromophenyl)(phenyl)methyl)amino)benzoic acidMol. Formula:
C20H16BrNO2M.W.:
382.26Type:
Small moleculeAlogP:
5.35Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
Small moleculeAlogP:
4.59Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA3742344
Name:
Ethyl 4-((bis(4-bromophenyl)methyl)amino)benzoateMol. Formula:
C22H19Br2NO2M.W.:
489.21Type:
Small moleculeAlogP:
6.59Polar Surface Area:
38.33HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.40DETAILS - ALA3741914
Name:
Ethyl 4-(((4-bromophenyl)(phenyl)methyl)amino)benzoateMol. Formula:
C22H20BrNO2M.W.:
410.31Type:
Small moleculeAlogP:
5.83Polar Surface Area:
38.33HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
5.06Polar Surface Area:
38.33HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA3742099
Name:
1-((R)-Phenyl(((R)-1-phenylethyl)amino)methyl)-naphthalen-2-olMol. Formula:
C25H23NOM.W.:
353.47Type:
Small moleculeAlogP:
5.99Polar Surface Area:
32.26HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
Small moleculeAlogP:
6.49Polar Surface Area:
69.56HBA:
3HBD:
3#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.30DETAILS - ALA3740606
Name:
2-((4-Bromo-2,6-difluorophenyl)(phenylamino)methyl)-naphthalen-1-olMol. Formula:
C23H16BrF2NOM.W.:
440.29Type:
Small moleculeAlogP:
6.79Polar Surface Area:
32.26HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.37DETAILS -
Type:
Small moleculeAlogP:
6.04Polar Surface Area:
12.03HBA:
1HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
5.44Polar Surface Area:
24.92HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
6.30Polar Surface Area:
45.15HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.36DETAILS - ALA3741366
Name:
5-Bromo-7-(phenyl(phenylamino)methyl)quinolin-8-olMol. Formula:
C22H17BrN2OM.W.:
405.30Type:
Small moleculeAlogP:
5.90Polar Surface Area:
45.15HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA3740282
Name:
5-Chloro-7-(phenyl(phenylamino)methyl)quinolin-8-olMol. Formula:
C22H17ClN2OM.W.:
360.84Type:
Small moleculeAlogP:
5.80Polar Surface Area:
45.15HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA3740323
Name:
Benzyl 8-hydroxy-7-(phenyl(phenylamino)methyl)quinoline-2-carboxylateMol. Formula:
C30H24N2O3M.W.:
460.53Type:
Small moleculeAlogP:
6.50Polar Surface Area:
71.45HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.27DETAILS
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