- ALA5219902
Name:
2-(neopentyl(quinolin-7-ylmethyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C20H21N5M.W.:
331.42Type:
---AlogP:
3.95Polar Surface Area:
65.70HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA5219648
Name:
2-((4-bromobenzyl)(cyclohexyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C18H19BrN4M.W.:
371.28Type:
---AlogP:
4.45Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA5219432
Name:
2-(neopentyl(quinolin-2-ylmethyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C20H21N5M.W.:
331.42Type:
---AlogP:
3.95Polar Surface Area:
65.70HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA5219428
Name:
2-(((4-bromothiophen-2-yl)methyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C15H17BrN4SM.W.:
365.30Type:
---AlogP:
4.22Polar Surface Area:
52.81HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.81DETAILS - ALA5219348
Name:
2-(([1,1'-biphenyl]-4-ylmethyl)(neopentyl)amino)pyrimidine-4-carboniirileMol. Formula:
C23H24N4M.W.:
356.47Type:
---AlogP:
5.07Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA5220975
Name:
2-((naphthalen-2-ylmethyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C21H22N4M.W.:
330.44Type:
---AlogP:
4.55Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA5220796
Name:
2-(([1,1'-biphenyl]-3-ylmethyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C23H24N4M.W.:
356.47Type:
---AlogP:
5.07Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA5220736
Name:
2-(benzyl(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C17H20N4M.W.:
280.38Type:
---AlogP:
3.40Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA5220669
Name:
2-((4-bromobenzyl)(cyclohexylmethyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C19H21BrN4M.W.:
385.31Type:
---AlogP:
4.70Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA5220424
Name:
2-((4-bromobenzyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C17H19BrN4M.W.:
359.27Type:
---AlogP:
4.16Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.82DETAILS - ALA5220195
Name:
2-((5-bromopyridin-2-yl)methyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C16H18BrN5M.W.:
360.26Type:
---AlogP:
3.56Polar Surface Area:
65.70HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA5220016
Name:
2-((4-fluorobenzyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C17H19FN4M.W.:
298.37Type:
---AlogP:
3.54Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS - ALA5218839
Name:
2-(((2-methylthiazol-5-yl)methyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C15H19N5SM.W.:
301.42Type:
---AlogP:
3.17Polar Surface Area:
65.70HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS - ALA5218499
Name:
2-((4-chlorobenzyl)(neopentyl)amino)pyrimidine-4-carbonitrileMol. Formula:
C17H19ClN4M.W.:
314.82Type:
---AlogP:
4.05Polar Surface Area:
52.81HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.85DETAILS Type:
---AlogP:
3.79Polar Surface Area:
108.09HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.59DETAILSType:
---AlogP:
4.36Polar Surface Area:
108.09HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILSType:
---AlogP:
4.81Polar Surface Area:
100.25HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILSType:
---AlogP:
4.60Polar Surface Area:
108.09HBA:
7HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS