ALA5209199Name:
2-(1-amino-3-methyl-butyl)-N-methyl-6-oxazol-5-yl-quinazolin-4-amineMol. Formula:
C17H21N5OM.W.:
311.39Type:
---AlogP:
3.37Polar Surface Area:
89.86HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILS
ALA5208680Name:
1-(5-methoxy-6-oxazol-5-yl-quinazolin-2-yl)-3-methyl-butan-1-amineMol. Formula:
C17H20N4O2M.W.:
312.37Type:
---AlogP:
3.34Polar Surface Area:
87.06HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.78DETAILS
ALA5208293Name:
(1S)-1-(4-ethyl-6-oxazol-5-yl-quinazolin-2-yl)-3-methyl-butan-1-amineMol. Formula:
C18H22N4OM.W.:
310.40Type:
---AlogP:
3.89Polar Surface Area:
77.83HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.77DETAILS
ALA5207636Name:
3-methyl-1-[6-(4-pyridyl)-2-quinolyl]butan-1-amineMol. Formula:
C19H21N3M.W.:
291.40Type:
---AlogP:
4.34Polar Surface Area:
51.80HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.78DETAILS
ALA5205801Name:
2-(1-amino-3-methyl-butyl)-6-(4-pyridyl)quinazoline-4-carbonitrileMol. Formula:
C19H19N5M.W.:
317.40Type:
---AlogP:
3.61Polar Surface Area:
88.48HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.79DETAILS-
Type:
---AlogP:
4.12Polar Surface Area:
99.36HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
---AlogP:
3.82Polar Surface Area:
86.47HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA5204563
Name:
2-[(1R)-1-amino-3-methyl-butyl]-6-oxazol-5-yl-quinoline-4-carbonitrileMol. Formula:
C18H18N4OM.W.:
306.37Type:
---AlogP:
3.81Polar Surface Area:
88.73HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
---AlogP:
4.25Polar Surface Area:
61.03HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
---AlogP:
3.90Polar Surface Area:
87.06HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
---AlogP:
4.79Polar Surface Area:
77.24HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
---AlogP:
4.40Polar Surface Area:
99.36HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
---AlogP:
4.97Polar Surface Area:
95.70HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
---AlogP:
5.01Polar Surface Area:
86.47HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA5202351
Name:
2-[(1S)-1-amino-3-methyl-butyl]-6-(4-pyridyl)quinoline-4-carbonitrileMol. Formula:
C20H20N4M.W.:
316.41Type:
---AlogP:
4.21Polar Surface Area:
75.59HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.78DETAILS -
Type:
---AlogP:
4.40Polar Surface Area:
99.36HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
---AlogP:
3.90Polar Surface Area:
87.06HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
---AlogP:
3.49Polar Surface Area:
62.97HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA5200458
Name:
1-[4-ethyl-6-(4-pyridyl)quinazolin-2-yl]-3-methyl-butan-1-amineMol. Formula:
C20H24N4M.W.:
320.44Type:
---AlogP:
4.30Polar Surface Area:
64.69HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
---AlogP:
4.38Polar Surface Area:
86.47HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.75DETAILS
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