Type:
---AlogP:
7.31Polar Surface Area:
81.56HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.13DETAILS
Type:
---AlogP:
-0.95Polar Surface Area:
149.45HBA:
11HBD:
3#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
---AlogP:
-0.38Polar Surface Area:
155.52HBA:
12HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.54DETAILS
Type:
---AlogP:
-0.66Polar Surface Area:
149.31HBA:
10HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
---AlogP:
-0.66Polar Surface Area:
149.31HBA:
10HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS-
Type:
---AlogP:
-0.39Polar Surface Area:
166.38HBA:
11HBD:
3#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
---AlogP:
-0.39Polar Surface Area:
166.38HBA:
11HBD:
3#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
---AlogP:
-0.09Polar Surface Area:
155.38HBA:
11HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.53DETAILS -
Type:
---AlogP:
4.96Polar Surface Area:
99.35HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
---AlogP:
2.29Polar Surface Area:
46.53HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.67DETAILS - ALA4785288
Name:
N1-(2-methoxyphenyl)-N4-(2-oxo-1,2,3,4-tetrahydroquinolin-3-yl)fumaramideMol. Formula:
C20H19N3O4M.W.:
365.39Type:
UnknownAlogP:
1.87Polar Surface Area:
96.53HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA4784429
Name:
N1-(2-oxo-1,2,3,4-tetrahydroquinolin-3-yl)-N4-(m-tolyl)fumaramideMol. Formula:
C20H19N3O3M.W.:
349.39Type:
UnknownAlogP:
2.17Polar Surface Area:
87.30HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
UnknownAlogP:
3.75Polar Surface Area:
94.40HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
UnknownAlogP:
0.87Polar Surface Area:
127.27HBA:
11HBD:
---#RO5 Violations:
1#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA4569478
Name:
5-(1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl)-1H-tetrazoleMol. Formula:
C10H9N7OM.W.:
243.23Type:
UnknownAlogP:
0.46Polar Surface Area:
94.40HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
UnknownAlogP:
4.41Polar Surface Area:
94.40HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
4.41Polar Surface Area:
94.40HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
4.06Polar Surface Area:
94.40HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
UnknownAlogP:
3.66Polar Surface Area:
137.54HBA:
9HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.28DETAILS - ALA4466402
Name:
5-(1-(4-chlorophenyl)-1H-1,2,3-triazol-4-yl)-1H-tetrazoleMol. Formula:
C9H6ClN7M.W.:
247.65Type:
UnknownAlogP:
1.10Polar Surface Area:
85.17HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS
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