Type:
---AlogP:
6.58Polar Surface Area:
58.45HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.31DETAILS
Type:
---AlogP:
6.04Polar Surface Area:
58.45HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.33DETAILS
Type:
---AlogP:
5.93Polar Surface Area:
58.45HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.37DETAILS
Type:
---AlogP:
5.18Polar Surface Area:
101.59HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.24DETAILS
Type:
---AlogP:
5.18Polar Surface Area:
101.59HBA:
6HBD:
---#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.24DETAILS-
Type:
UnknownAlogP:
3.07Polar Surface Area:
82.41HBA:
8HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
UnknownAlogP:
3.14Polar Surface Area:
79.17HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
UnknownAlogP:
2.91Polar Surface Area:
122.31HBA:
9HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.29DETAILS - ALA4468640
Name:
4-(4-(4-chlorophenylthio)-6-methoxy-1,3,5-triazin-2-yl)benzonitrileMol. Formula:
C17H11ClN4OSM.W.:
354.82Type:
UnknownAlogP:
4.22Polar Surface Area:
71.69HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
Small moleculeAlogP:
5.82Polar Surface Area:
120.86HBA:
6HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.21DETAILS -
Type:
Small moleculeAlogP:
6.57Polar Surface Area:
77.72HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.33DETAILS -
Type:
Small moleculeAlogP:
4.10Polar Surface Area:
111.61HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA2430491
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-(4-methoxyphenyl)nicotinonitrileMol. Formula:
C20H15N5OM.W.:
341.37Type:
Small moleculeAlogP:
3.75Polar Surface Area:
100.61HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA2430490
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-(3-methoxyphenyl)nicotinonitrileMol. Formula:
C20H15N5OM.W.:
341.37Type:
Small moleculeAlogP:
3.75Polar Surface Area:
100.61HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA2430489
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-p-tolylnicotinonitrileMol. Formula:
C20H15N5M.W.:
325.38Type:
Small moleculeAlogP:
4.05Polar Surface Area:
91.38HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA2430488
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-m-tolylnicotinonitrileMol. Formula:
C20H15N5M.W.:
325.38Type:
Small moleculeAlogP:
4.05Polar Surface Area:
91.38HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA2430487
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-o-tolylnicotinonitrileMol. Formula:
C20H15N5M.W.:
325.38Type:
Small moleculeAlogP:
4.05Polar Surface Area:
91.38HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA2430485
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-(3-nitrophenyl)nicotinonitrileMol. Formula:
C19H12N6O2M.W.:
356.35Type:
Small moleculeAlogP:
3.65Polar Surface Area:
134.52HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA2430484
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-(4-hydroxyphenyl)nicotinonitrileMol. Formula:
C19H13N5OM.W.:
327.35Type:
Small moleculeAlogP:
3.45Polar Surface Area:
111.61HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA2430483
Name:
2-Amino-6-(1H-benzo[d]imidazol-2-yl)-4-(3-hydroxyphenyl)nicotinonitrileMol. Formula:
C19H13N5OM.W.:
327.35Type:
Small moleculeAlogP:
3.45Polar Surface Area:
111.61HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.52DETAILS
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