Type:
UnknownAlogP:
4.84Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.30DETAILS
Type:
UnknownAlogP:
3.24Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS
ALA4590072Name:
(2-(4-amino-6-(4-methoxybenzylamino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C18H19N5O2M.W.:
337.38Type:
UnknownAlogP:
2.23Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS
ALA4589969Name:
(2-(4-Amino-6-(benzylamino)-1,3,5-triazin-2-yl)-5-chlorophenyl)methanolMol. Formula:
C17H16ClN5OM.W.:
341.80Type:
UnknownAlogP:
2.88Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS
Type:
UnknownAlogP:
4.20Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.38DETAILS- ALA4576886
Name:
(2-(4-Amino-6-(benzylamino)-1,3,5-triazin-2-yl)-4-methoxyphenyl)methanolMol. Formula:
C18H19N5O2M.W.:
337.38Type:
UnknownAlogP:
2.23Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
4.45Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.34DETAILS - ALA4568595
Name:
(2-(4-(Benzylamino)-6-(ethylamino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C19H21N5OM.W.:
335.41Type:
UnknownAlogP:
3.07Polar Surface Area:
82.96HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA4567802
Name:
(2-(4-Amino-6-(phenethylamino)-1,3,5-triazin-2-yl)-3-fluorophenyl)methanolMol. Formula:
C18H18FN5OM.W.:
339.37Type:
UnknownAlogP:
2.41Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA4564311
Name:
(2-(4-Amino-6-((2-methoxybenzyl)amino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C18H19N5O2M.W.:
337.38Type:
UnknownAlogP:
2.23Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS - ALA4564182
Name:
(2-(4-Amino-6-((3-fluorobenzyl)amino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C17H16FN5OM.W.:
325.35Type:
UnknownAlogP:
2.36Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA4561905
Name:
(2-(4-Amino-6-((2-chlorobenzyl)amino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C17H16ClN5OM.W.:
341.80Type:
UnknownAlogP:
2.88Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA4557804
Name:
(2-(4-Amino-6-(benzylamino)-1,3,5-triazin-2-yl)-4-chlorophenyl)methanolMol. Formula:
C17H16ClN5OM.W.:
341.80Type:
UnknownAlogP:
2.88Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA4555012
Name:
(2-(4-Amino-6-((3-methoxybenzyl)amino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C18H19N5O2M.W.:
337.38Type:
UnknownAlogP:
2.23Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
4.67Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.39DETAILS -
Type:
UnknownAlogP:
4.71Polar Surface Area:
106.18HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.36DETAILS - ALA4551453
Name:
(2-(4-Amino-6-(benzylamino)-1,3,5-triazin-2-yl)-5-fluorophenyl)methanolMol. Formula:
C17H16FN5OM.W.:
325.35Type:
UnknownAlogP:
2.36Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA4547273
Name:
6-(2-(Aminomethyl)phenyl)-N2-benzyl-1,3,5-triazine-2,4-diamineMol. Formula:
C17H18N6M.W.:
306.37Type:
UnknownAlogP:
2.19Polar Surface Area:
102.74HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA4541461
Name:
(2-(4-amino-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C19H21N5OM.W.:
335.41Type:
UnknownAlogP:
2.66Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4535429
Name:
(2-(4-Amino-6-((3-methylbenzyl)amino)-1,3,5-triazin-2-yl)phenyl)methanolMol. Formula:
C18H19N5OM.W.:
321.38Type:
UnknownAlogP:
2.53Polar Surface Area:
96.95HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS
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