ALA4165543Name:
4-Chloro-2-(cyclohexylamino)-N-(3-hydroxypropyl)-5-sulfamoyl-benzamideMol. Formula:
C16H24ClN3O4SM.W.:
389.91Type:
Small moleculeAlogP:
1.84Polar Surface Area:
121.52HBA:
5HBD:
4#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.53DETAILS
ALA3628210Name:
(E)-3-hydroxyphenethyl 3-(4'-hydroxy-3'-methoxyphenyl)acrylateMol. Formula:
C18H18O5M.W.:
314.34Type:
Small moleculeAlogP:
2.91Polar Surface Area:
75.99HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS
ALA3628132Name:
(E)-3-(3-hydroxyphenethoxy)phenethyl 3-(3',4'-dihydroxyphenyl)acrylateMol. Formula:
C25H24O6M.W.:
420.46Type:
Small moleculeAlogP:
4.22Polar Surface Area:
96.22HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.27DETAILS
ALA3628131Name:
(E)-4-(4-hydroxyphenethoxy)phenethyl 3-(3',4'-dihydroxyphenyl)acrylateMol. Formula:
C25H24O6M.W.:
420.46Type:
Small moleculeAlogP:
4.22Polar Surface Area:
96.22HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.27DETAILS
ALA3360588Name:
4-(3-benzylureido)-N-(4-sulfamoylbenzyl)-butanamideMol. Formula:
C19H24N4O4SM.W.:
404.49Type:
Small moleculeAlogP:
1.23Polar Surface Area:
130.39HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.47DETAILS- ALA3360587
Name:
4-(3-phenylureido)-N-(4-sulfamoylphenethyl)-butanamideMol. Formula:
C19H24N4O4SM.W.:
404.49Type:
Small moleculeAlogP:
1.59Polar Surface Area:
130.39HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA3360586
Name:
4-(3-phenylureido)-N-(4-sulfamoylbenzyl)-butanamideMol. Formula:
C18H22N4O4SM.W.:
390.47Type:
Small moleculeAlogP:
1.55Polar Surface Area:
130.39HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
2.06Polar Surface Area:
242.95HBA:
10HBD:
5#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.22DETAILS
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