Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA3770220Name:
N-(4-(Methylsulfinyl)phenyl)-2-(pyridin-4-yl)quinazolin-4-amineMol. Formula:
C20H16N4OSM.W.:
360.44Type:
Small moleculeAlogP:
4.17Polar Surface Area:
73.76HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.55DETAILS
ALA3771220Name:
N-(4-(Methylsulfonyl)phenyl)-2-(pyridin-4-yl)quinazolin-4-amineMol. Formula:
C20H16N4O2SM.W.:
376.44Type:
Small moleculeAlogP:
3.84Polar Surface Area:
84.84HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS
ALA3770941Name:
N-(3-(Ethoxycarbonyl)phenyl)-2-(pyridin-4-yl)quinazolin-4-amineMol. Formula:
C22H18N4O2M.W.:
370.41Type:
Small moleculeAlogP:
4.61Polar Surface Area:
77.00HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS- ALA3770162
Name:
N-(2-(Ethoxycarbonyl)phenyl)-2-(pyridin-4-yl)quinazolin-4-amineMol. Formula:
C22H18N4O2M.W.:
370.41Type:
Small moleculeAlogP:
4.61Polar Surface Area:
77.00HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3769666
Name:
4-[[2-(Pyridin-4-yl)-quinazolin-4-yl]amino]-benzonitrileMol. Formula:
C20H13N5M.W.:
323.36Type:
Small moleculeAlogP:
4.31Polar Surface Area:
74.49HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.61DETAILS - ALA3770181
Name:
4-[[2-(Pyridin-4-yl)-quinazolin-4-yl]amino]-benzamideMol. Formula:
C20H15N5OM.W.:
341.37Type:
Small moleculeAlogP:
3.53Polar Surface Area:
93.79HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA3770841
Name:
4-[[2-(Pyridin-4-yl)-quinazolin-4-yl]amino]-benzoic AcidMol. Formula:
C20H14N4O2M.W.:
342.36Type:
Small moleculeAlogP:
4.13Polar Surface Area:
88.00HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA3770712
Name:
N-(4-Acetylphenyl)-2-(pyridin-4-yl)quinazolin-4-amineMol. Formula:
C21H16N4OM.W.:
340.39Type:
Small moleculeAlogP:
4.64Polar Surface Area:
67.77HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA3771171
Name:
N-Ethyl 4-[[2-(Pyridin-3-yl)-quinazolin-4-yl]amino]-benzenesulfonamideMol. Formula:
C21H19N5O2SM.W.:
405.48Type:
Small moleculeAlogP:
3.73Polar Surface Area:
96.87HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA3770103
Name:
4-[[2-(Pyridin-3-yl)-quinazolin-4-yl]amino]-benzenesulfonamideMol. Formula:
C19H15N5O2SM.W.:
377.43Type:
Small moleculeAlogP:
3.08Polar Surface Area:
110.86HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA3770739
Name:
N-Methoxy-N-methyl-4-[[2-(pyridin-3-yl)-quinazolin-4-yl]amino]-benzamideMol. Formula:
C22H19N5O2M.W.:
385.43Type:
Small moleculeAlogP:
4.07Polar Surface Area:
80.24HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3769466
Name:
N-Methoxy-4-[[2-(pyridin-3-yl)-quinazolin-4-yl]amino]-benzamideMol. Formula:
C21H17N5O2M.W.:
371.40Type:
Small moleculeAlogP:
3.73Polar Surface Area:
89.03HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3770536
Name:
N-(2-Fluoroethyl)-4-[[2-(pyridin-3-yl)-quinazolin-4-yl]amino]-benzamideMol. Formula:
C22H18FN5OM.W.:
387.42Type:
Small moleculeAlogP:
4.13Polar Surface Area:
79.80HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3769718
Name:
N-(2-Hydroxyethyl)-4-[[2-(pyridin-3-yl)-quinazolin-4-yl]amino]-benzamideMol. Formula:
C22H19N5O2M.W.:
385.43Type:
Small moleculeAlogP:
3.16Polar Surface Area:
100.03HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA3769471
Name:
N-Ethyl-4-[[2-(pyridin-3-yl)-quinazolin-4-yl]amino]-benzamideMol. Formula:
C22H19N5OM.W.:
369.43Type:
Small moleculeAlogP:
4.19Polar Surface Area:
79.80HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA3769554
Name:
Ethyl 4-[[2-(Pyridin-3-yl)-quinazolin-4-yl]amino]-phenylacetateMol. Formula:
C23H20N4O2M.W.:
384.44Type:
Small moleculeAlogP:
4.54Polar Surface Area:
77.00HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS - ALA3770260
Name:
N-(4-(Ethoxycarbonyl)phenyl)-2-(2-methylpyridin-3-yl)-quinazolin-4-amineMol. Formula:
C23H20N4O2M.W.:
384.44Type:
Small moleculeAlogP:
4.92Polar Surface Area:
77.00HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
5.75Polar Surface Area:
70.93HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.38DETAILS
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