ALA4879267Name:
N-butyl-N-(3,4,5-trimethoxyphenyl)quinolin-5-amineMol. Formula:
C22H26N2O3M.W.:
366.46Type:
UnknownAlogP:
5.20Polar Surface Area:
43.82HBA:
5HBD:
---#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.55DETAILS
ALA4879075Name:
N-methyl-N-(3,4,5-trimethoxyphenyl)acridin-9-amineMol. Formula:
C23H22N2O3M.W.:
374.44Type:
UnknownAlogP:
5.18Polar Surface Area:
43.82HBA:
5HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.45DETAILS
Type:
UnknownAlogP:
2.55Polar Surface Area:
65.50HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.90DETAILS
Type:
UnknownAlogP:
7.97Polar Surface Area:
149.10HBA:
7HBD:
5#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.09DETAILS
Type:
UnknownAlogP:
3.18Polar Surface Area:
43.82HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.85DETAILS-
Type:
UnknownAlogP:
0.17Polar Surface Area:
61.85HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
UnknownAlogP:
2.35Polar Surface Area:
78.92HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
UnknownAlogP:
5.04Polar Surface Area:
39.92HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
UnknownAlogP:
7.01Polar Surface Area:
53.05HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.24DETAILS -
Type:
UnknownAlogP:
4.30Polar Surface Area:
78.92HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA4874505
Name:
N-(4-methoxyphenyl)-N,2-dimethylpyridin-4-amineMol. Formula:
C14H16N2OM.W.:
228.29Type:
UnknownAlogP:
3.17Polar Surface Area:
25.36HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.81DETAILS -
Type:
UnknownAlogP:
5.85Polar Surface Area:
43.82HBA:
5HBD:
---#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
3.75Polar Surface Area:
56.71HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
UnknownAlogP:
4.01Polar Surface Area:
25.36HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.71DETAILS -
Type:
UnknownAlogP:
5.83Polar Surface Area:
34.59HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
UnknownAlogP:
9.89Polar Surface Area:
128.87HBA:
6HBD:
4#RO5 Violations:
2#Rotatable Bonds:
13Passes Ro3:
NQED Weighted:
0.09DETAILS -
Type:
UnknownAlogP:
5.97Polar Surface Area:
16.13HBA:
2HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
UnknownAlogP:
5.84Polar Surface Area:
25.36HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA4872202
Name:
7-chloro-N-(4-methoxyphenyl)quinolin-4-amineCas Number:
6059-31-0Mol. Formula:
C16H13ClN2OM.W.:
284.75Type:
UnknownAlogP:
4.64Polar Surface Area:
34.15HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
UnknownAlogP:
5.16Polar Surface Area:
25.36HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.49DETAILS
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