ALA4790898Name:
6-Bromo-N-ethyl-1H-benzo[d]imidazol-2-amineCas Number:
1534576-80-1Mol. Formula:
C9H10BrN3M.W.:
240.10Type:
UnknownAlogP:
2.76Polar Surface Area:
40.71HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.85DETAILS
Type:
UnknownAlogP:
4.45Polar Surface Area:
49.94HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.66DETAILS
Type:
UnknownAlogP:
2.56Polar Surface Area:
67.01HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS
Type:
UnknownAlogP:
3.42Polar Surface Area:
68.06HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS
Type:
UnknownAlogP:
3.57Polar Surface Area:
83.85HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.57DETAILS- ALA4789725
Name:
N-Cyclohexyl-6-methyl-1H-benzo[d]imidazol-2-amineMol. Formula:
C14H19N3M.W.:
229.33Type:
UnknownAlogP:
3.62Polar Surface Area:
40.71HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA4782322
Name:
Ethyl (6-nitro-1H-benzo[d]imidazol-2-yl)glycinateMol. Formula:
C11H12N4O4M.W.:
264.24Type:
UnknownAlogP:
1.45Polar Surface Area:
110.15HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
UnknownAlogP:
2.72Polar Surface Area:
100.92HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
UnknownAlogP:
2.07Polar Surface Area:
83.85HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
2.49Polar Surface Area:
79.01HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.85DETAILS -
Type:
UnknownAlogP:
2.89Polar Surface Area:
65.87HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.84DETAILS -
Type:
UnknownAlogP:
3.12Polar Surface Area:
126.99HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
UnknownAlogP:
3.09Polar Surface Area:
107.64HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4776698
Name:
N-Butyl-6-nitro-1H-benzo[d]imidazol-2-amineCas Number:
233605-81-7Mol. Formula:
C11H14N4O2M.W.:
234.26Type:
UnknownAlogP:
2.68Polar Surface Area:
83.85HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA4776373
Name:
6-Bromo-N-cyclohexyl-1H-benzo[d]imidazol-2-amineMol. Formula:
C13H16BrN3M.W.:
294.20Type:
UnknownAlogP:
4.07Polar Surface Area:
40.71HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.88DETAILS -
Type:
UnknownAlogP:
3.54Polar Surface Area:
40.71HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
UnknownAlogP:
3.65Polar Surface Area:
32.67HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
UnknownAlogP:
2.55Polar Surface Area:
23.55HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.77DETAILS -
Type:
---AlogP:
6.92Polar Surface Area:
80.32HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
---AlogP:
3.99Polar Surface Area:
40.62HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.80DETAILS
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