Type:
Small moleculeAlogP:
-1.82Polar Surface Area:
177.14HBA:
10HBD:
7#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS
Type:
UnknownAlogP:
2.34Polar Surface Area:
166.64HBA:
11HBD:
2#RO5 Violations:
2#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.45DETAILS
Type:
Small moleculeAlogP:
-3.46Polar Surface Area:
207.63HBA:
12HBD:
8#RO5 Violations:
2#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.22DETAILS
Type:
Small moleculeAlogP:
3.33Polar Surface Area:
79.90HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.53DETAILS
ALA2270741Name:
1-hexyl-1H-benzo[d]imidazol-2-amineCas Number:
141211-32-7Mol. Formula:
C13H19N3M.W.:
217.32Type:
Small moleculeAlogP:
3.20Polar Surface Area:
43.84HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.78DETAILS-
Type:
Small moleculeAlogP:
3.84Polar Surface Area:
17.82HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
Small moleculeAlogP:
5.61Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.24DETAILS -
Type:
Small moleculeAlogP:
4.64Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
Small moleculeAlogP:
4.99Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
4.99Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
4.87Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
Small moleculeAlogP:
4.09Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.39DETAILS -
Type:
Small moleculeAlogP:
3.31Polar Surface Area:
86.46HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA1623904
Name:
1-butyl-1H-benzo[d]imidazol-2-amineCas Number:
91337-45-0Mol. Formula:
C11H15N3M.W.:
189.26Type:
Small moleculeAlogP:
2.42Polar Surface Area:
43.84HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.81DETAILS -
Type:
Small moleculeAlogP:
5.75Polar Surface Area:
32.59HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
Small moleculeAlogP:
5.15Polar Surface Area:
49.77HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
5.10Polar Surface Area:
64.99HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
Small moleculeAlogP:
5.09Polar Surface Area:
55.76HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
Small moleculeAlogP:
4.79Polar Surface Area:
66.76HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
5.22Polar Surface Area:
46.53HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.51DETAILS
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