Type:
---AlogP:
2.57Polar Surface Area:
80.17HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.41DETAILS
Type:
---AlogP:
2.11Polar Surface Area:
90.07HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.43DETAILS
ALA5219876Name:
1-(4-methylquinazolin-2-yl)-3-(3-phenylpropyl)guanidineMol. Formula:
C19H21N5M.W.:
319.41Type:
---AlogP:
3.51Polar Surface Area:
73.69HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.38DETAILS
ALA5219861Name:
1-(3-(dimethylamino)propyl)-3-(7-fluoro-4-methylquinazolin-2-yl)guanidineMol. Formula:
C15H21FN6M.W.:
304.37Type:
---AlogP:
1.97Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.45DETAILS
ALA5219854Name:
1-(3-(dimethylamino)propyl)-3-(4-ethyl-6-methylpyrimidin-2-yl)guanidineMol. Formula:
C13H24N6M.W.:
264.38Type:
---AlogP:
1.24Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.41DETAILS-
Type:
---AlogP:
3.14Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS -
Type:
---AlogP:
3.96Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.33DETAILS - ALA5219680
Name:
1-(3-(dimethylamino)propyl)-3-(4,7-dimethylquinazolin-2-yl)guanidineMol. Formula:
C16H24N6M.W.:
300.41Type:
---AlogP:
2.13Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA5219664
Name:
1-(4-(dimethylamino)butyl)-3-(7-fluoro-4-methylquinazolin-2-yl)guanidineMol. Formula:
C16H23FN6M.W.:
318.40Type:
---AlogP:
2.36Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
---AlogP:
2.50Polar Surface Area:
90.07HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
---AlogP:
2.16Polar Surface Area:
74.79HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
---AlogP:
3.12Polar Surface Area:
90.07HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA5219600
Name:
N-methyl-N-(3-(3-(4-methylquinazolin-2-yl)guanidino)propyl)glycineMol. Formula:
C16H22N6O2M.W.:
330.39Type:
---AlogP:
1.28Polar Surface Area:
114.23HBA:
5HBD:
4#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
---AlogP:
2.26Polar Surface Area:
90.07HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS -
Type:
---AlogP:
1.65Polar Surface Area:
99.30HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA5219564
Name:
1-(3-aminopropyl)-3-(7-fluoro-4-methylquinazolin-2-yl)guanidineMol. Formula:
C13H17FN6M.W.:
276.32Type:
---AlogP:
1.36Polar Surface Area:
99.71HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
---AlogP:
2.26Polar Surface Area:
90.07HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS -
Type:
---AlogP:
3.96Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.33DETAILS - ALA5219414
Name:
1-(3-(dimethylamino)propyl)-3-(4-phenylquinazolin-2-yl)guanidineMol. Formula:
C20H24N6M.W.:
348.45Type:
---AlogP:
3.18Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.36DETAILS - ALA5219335
Name:
1-(3-(dimethylamino)propyl)-3-(quinazolin-2-yl)guanidineMol. Formula:
C14H20N6M.W.:
272.36Type:
---AlogP:
1.52Polar Surface Area:
76.93HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.44DETAILS
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