ALA4104163Name:
6-Oxo-5-n-pentyl-5,6-dihydrophenanthridine-3-carboxamideMol. Formula:
C19H20N2O2M.W.:
308.38Type:
Small moleculeAlogP:
3.44Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.58DETAILS
ALA4104106Name:
10-Butyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-7-carboxamideMol. Formula:
C18H18N2O3M.W.:
310.35Type:
Small moleculeAlogP:
3.34Polar Surface Area:
72.63HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.94DETAILS
Type:
Small moleculeAlogP:
2.98Polar Surface Area:
72.19HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.80DETAILS
Type:
Small moleculeAlogP:
3.54Polar Surface Area:
48.02HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.58DETAILS
ALA4103092Name:
5-butyl-2-(pyrrolidine-1-carbonyl)phenanthridin-6(5H)-oneMol. Formula:
C22H24N2O2M.W.:
348.45Type:
Small moleculeAlogP:
4.19Polar Surface Area:
42.31HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.66DETAILS- ALA4098889
Name:
6-Oxo-5-n-pentyl-5,6-dihydrophenanthridine-1-carboxamideMol. Formula:
C19H20N2O2M.W.:
308.38Type:
Small moleculeAlogP:
3.44Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA4092121
Name:
5-(Cyclohexylmethyl)-6-oxo-5,6-dihydrophenanthridine-2-carboxamideMol. Formula:
C21H22N2O2M.W.:
334.42Type:
Small moleculeAlogP:
3.83Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA4091833
Name:
5-Ethyl-6-oxo-5,6-dihydrophenanthridine-2-carboxamideMol. Formula:
C16H14N2O2M.W.:
266.30Type:
Small moleculeAlogP:
2.27Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA4090983
Name:
5-butyl-6-oxo-5,6-dihydrophenanthridine-2-carboxylic acidMol. Formula:
C18H17NO3M.W.:
295.34Type:
Small moleculeAlogP:
3.65Polar Surface Area:
59.30HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA4088731
Name:
5-Allyl-6-oxo-5,6-dihydrophenanthridine-2-carboxamideMol. Formula:
C17H14N2O2M.W.:
278.31Type:
Small moleculeAlogP:
2.44Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA4087738
Name:
5-Butyl-6-oxo-5,6,7,8,9,10-hexahydrophenanthridine-2-carboxamideMol. Formula:
C18H22N2O2M.W.:
298.39Type:
Small moleculeAlogP:
2.78Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.94DETAILS - ALA4086245
Name:
N-(5-Butyl-6-oxo-5,6-dihydrophenanthridin-2-yl)-N-methylacetamideMol. Formula:
C20H22N2O2M.W.:
322.41Type:
Small moleculeAlogP:
3.94Polar Surface Area:
42.31HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA4085267
Name:
N-(5-Butyl-6-oxo-5,6-dihydrophenanthridin-2-yl)-methanesulfonamideMol. Formula:
C18H20N2O3SM.W.:
344.44Type:
Small moleculeAlogP:
3.33Polar Surface Area:
68.17HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA4084071
Name:
5-Butyryl-5,6,7,8,9,10-hexahydrophenanthridine-2-carboxamideMol. Formula:
C18H22N2O2M.W.:
298.39Type:
Small moleculeAlogP:
3.26Polar Surface Area:
63.40HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.93DETAILS - ALA4081569
Name:
5-n-Hexyl-6-oxo-5,6-dihydrophenanthridine-2-carboxamideMol. Formula:
C20H22N2O2M.W.:
322.41Type:
Small moleculeAlogP:
3.83Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA4080856
Name:
5-(2-Methoxyethyl)-6-oxo-5,6-dihydrophenanthridine-2-carboxamideMol. Formula:
C17H16N2O3M.W.:
296.33Type:
Small moleculeAlogP:
1.90Polar Surface Area:
74.32HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA4077612
Name:
5-butyl-6-oxo-5,6-dihydrophenanthridin-2-yl morpholine-4-carboxylateMol. Formula:
C22H24N2O4M.W.:
380.44Type:
Small moleculeAlogP:
3.79Polar Surface Area:
60.77HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.65DETAILS - ALA4076151
Name:
5-n-Pentyl-6-oxo-5,6-dihydrophenanthridine-2-carboxamideMol. Formula:
C19H20N2O2M.W.:
308.38Type:
Small moleculeAlogP:
3.44Polar Surface Area:
65.09HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA4075732
Name:
1-(5-Butyl-6-oxo-5,6-dihydrophenanthridin-2-yl)ureaMol. Formula:
C18H19N3O2M.W.:
309.37Type:
Small moleculeAlogP:
3.45Polar Surface Area:
77.12HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS
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