ALA5204261Name:
N-((2-bromo-4-isopropyl-phenyl)carbamothioyl)adamantane-1-carboxamideMol. Formula:
C21H27BrN2OSM.W.:
435.43Type:
---AlogP:
5.60Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.61DETAILS
Type:
---AlogP:
4.79Polar Surface Area:
75.19HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS
Type:
---AlogP:
5.40Polar Surface Area:
88.33HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.44DETAILS
Type:
---AlogP:
4.88Polar Surface Area:
88.33HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.48DETAILS
Type:
---AlogP:
4.90Polar Surface Area:
79.60HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.47DETAILS-
Type:
---AlogP:
5.21Polar Surface Area:
75.19HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
---AlogP:
4.74Polar Surface Area:
88.33HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
UnknownAlogP:
5.18Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA4589444
Name:
2-(2-Chlorophenyl)-N-[4-(cyclobutylmethoxy)-3-sulfamoylphenyl]acetamideMol. Formula:
C19H21ClN2O4SM.W.:
408.91Type:
UnknownAlogP:
3.35Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA4579675
Name:
N-[4-(3-Acetamidophenoxy)-3-sulfamoylphenyl]-2-(2-chlorophenyl)acetamideMol. Formula:
C22H20ClN3O5SM.W.:
473.94Type:
UnknownAlogP:
3.92Polar Surface Area:
127.59HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA4579583
Name:
2-(2-Chlorophenyl)-N-[4-(3-methoxyphenoxy)-3-sulfamoylphenyl]acetamideMol. Formula:
C21H19ClN2O5SM.W.:
446.91Type:
UnknownAlogP:
3.97Polar Surface Area:
107.72HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
UnknownAlogP:
4.19Polar Surface Area:
118.72HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
4.98Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
UnknownAlogP:
3.32Polar Surface Area:
128.03HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA4563994
Name:
2-(2-Chlorophenyl)-N-[4-(2-phenylethoxy)-3-sulfamoylphenyl]-acetamideMol. Formula:
C22H21ClN2O4SM.W.:
444.94Type:
UnknownAlogP:
3.79Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
UnknownAlogP:
4.46Polar Surface Area:
107.72HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
UnknownAlogP:
5.44Polar Surface Area:
95.58HBA:
4HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.35DETAILS - ALA4556573
Name:
2-(2-Chlorophenyl)-N-(4-phenoxy-3-sulfamoylphenyl)acetamideMol. Formula:
C20H17ClN2O4SM.W.:
416.89Type:
UnknownAlogP:
3.96Polar Surface Area:
98.49HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
3.11Polar Surface Area:
107.72HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA4541425
Name:
2-(2-Chlorophenyl)-N-[4-(pyridin-3-yloxy)-3-sulfamoylphenyl]-acetamideMol. Formula:
C19H16ClN3O4SM.W.:
417.87Type:
UnknownAlogP:
3.36Polar Surface Area:
111.38HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS
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