ALA3747337Name:
Butyl 7-(dipropylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C23H28N2O5M.W.:
412.49Type:
Small moleculeAlogP:
4.58Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.31DETAILS
ALA3747518Name:
Methyl 7-(dipropylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C20H22N2O5M.W.:
370.41Type:
Small moleculeAlogP:
3.41Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS
Type:
Small moleculeAlogP:
3.11Polar Surface Area:
95.80HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.22DETAILS
Type:
Small moleculeAlogP:
1.18Polar Surface Area:
105.03HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.24DETAILS
Type:
Small moleculeAlogP:
2.33Polar Surface Area:
95.80HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.24DETAILS-
Type:
Small moleculeAlogP:
1.55Polar Surface Area:
95.80HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.32DETAILS - ALA3746994
Name:
7-(Dimethylamino)-1-hydroxy-3H-phenoxazin-3-oneMol. Formula:
C14H12N2O3M.W.:
256.26Type:
Small moleculeAlogP:
2.06Polar Surface Area:
66.57HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA3747123
Name:
7-(Dimethylamino)-1-methyl-3H-phenoxazine-3-oneMol. Formula:
C15H14N2O2M.W.:
254.29Type:
Small moleculeAlogP:
2.67Polar Surface Area:
46.34HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.63DETAILS - ALA3746728
Name:
Hexyl 7-(dimethylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C21H24N2O5M.W.:
384.43Type:
Small moleculeAlogP:
3.80Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
Small moleculeAlogP:
1.87Polar Surface Area:
102.10HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA3746860
Name:
Benzyl 7-(dimethylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C22H18N2O5M.W.:
390.40Type:
Small moleculeAlogP:
3.42Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA3746396
Name:
Butyl 7-(dimethylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C19H20N2O5M.W.:
356.38Type:
Small moleculeAlogP:
3.02Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.43DETAILS - ALA3746859
Name:
Isopropyl 7-(dimethylamino)-4-hydroxy-3-oxo-3Hphenoxazine-1-carboxylateMol. Formula:
C18H18N2O5M.W.:
342.35Type:
Small moleculeAlogP:
2.63Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA3747033
Name:
Ethyl 7-(dimethylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C17H16N2O5M.W.:
328.32Type:
Small moleculeAlogP:
2.24Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA3746153
Name:
Methyl 7-(dimethylamino)-4-hydroxy-3-oxo-3H-phenoxazine-1-carboxylateMol. Formula:
C16H14N2O5M.W.:
314.30Type:
Small moleculeAlogP:
1.85Polar Surface Area:
92.87HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA3746831
Name:
7-(Dimethylamino)-4-hydroxy-3H-phenoxazin-3-oneMol. Formula:
C14H12N2O3M.W.:
256.26Type:
Small moleculeAlogP:
2.06Polar Surface Area:
66.57HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
1.76Polar Surface Area:
103.87HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS
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