ALA4879097Name:
3-Butyl-2-methyl-1-octyl-1H-benzo[d]imidazol-3-ium bromideMol. Formula:
C20H33BrN2M.W.:
381.40Type:
UnknownAlogP:
5.40Polar Surface Area:
8.81HBA:
1HBD:
---#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.41DETAILS
Type:
UnknownAlogP:
3.17Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.70DETAILS
Type:
UnknownAlogP:
4.24Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS
Type:
UnknownAlogP:
2.85Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.70DETAILS
Type:
UnknownAlogP:
4.42Polar Surface Area:
55.84HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.39DETAILS-
Type:
UnknownAlogP:
6.27Polar Surface Area:
17.82HBA:
2HBD:
---#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
UnknownAlogP:
6.76Polar Surface Area:
55.84HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
UnknownAlogP:
5.02Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.37DETAILS -
Type:
UnknownAlogP:
9.70Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
2#Rotatable Bonds:
22Passes Ro3:
NQED Weighted:
0.09DETAILS - ALA4872279
Name:
2-Methyl-1-octyl-1H-naphtho[2,3-d]imidazole-4,9-dioneMol. Formula:
C20H24N2O2M.W.:
324.42Type:
UnknownAlogP:
4.33Polar Surface Area:
51.96HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
UnknownAlogP:
5.41Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
UnknownAlogP:
3.14Polar Surface Area:
17.82HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
UnknownAlogP:
5.80Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
UnknownAlogP:
3.63Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
UnknownAlogP:
4.94Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
UnknownAlogP:
4.41Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
5.19Polar Surface Area:
42.95HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.38DETAILS - ALA4863695
Name:
2-Methyl-1-hexyl-1H-naphtho[2,3-d]imidazole-4,9-dioneMol. Formula:
C18H20N2O2M.W.:
296.37Type:
UnknownAlogP:
3.55Polar Surface Area:
51.96HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
UnknownAlogP:
2.85Polar Surface Area:
55.84HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
UnknownAlogP:
4.42Polar Surface Area:
55.84HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.39DETAILS
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