ALA294267Name:
3-Hydroxy-naphthalene-2-carboxylic acid (4-nitro-phenyl)-amideMol. Formula:
C17H12N2O4M.W.:
308.29Type:
Small moleculeAlogP:
3.71Polar Surface Area:
92.47HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS
NaphtholASName:
3-Hydroxy-naphthalene-2-carboxylic acid phenylamideMol. Formula:
C17H13NO2M.W.:
263.30Type:
Small moleculeAlogP:
3.80Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.74DETAILS
ALA63883Name:
3-Hydroxy-naphthalene-2-carboxylic acid (4-methoxy-phenyl)-amideMol. Formula:
C18H15NO3M.W.:
293.32Type:
Small moleculeAlogP:
3.81Polar Surface Area:
58.56HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS
ALA65742Name:
3-Hydroxy-naphthalene-2-carboxylic acid (4-cyano-phenyl)-amideMol. Formula:
C18H12N2O2M.W.:
288.31Type:
Small moleculeAlogP:
3.67Polar Surface Area:
73.12HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.76DETAILS
Type:
Small moleculeAlogP:
5.07Polar Surface Area:
71.45HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS-
Type:
Small moleculeAlogP:
3.92Polar Surface Area:
71.45HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
Small moleculeAlogP:
4.84Polar Surface Area:
114.59HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.35DETAILS - ALA65408
Name:
3-Hydroxy-naphthalene-2-carboxylic acid [2-(4-chloro-phenyl)-ethyl]-amideMol. Formula:
C19H16ClNO2M.W.:
325.80Type:
Small moleculeAlogP:
4.17Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
Small moleculeAlogP:
5.58Polar Surface Area:
71.45HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA63149
Name:
3-Methoxy-naphthalene-2-carboxylic acid (4-nitro-phenyl)-amideMol. Formula:
C18H14N2O4M.W.:
322.32Type:
Small moleculeAlogP:
4.01Polar Surface Area:
81.47HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA292775
Name:
3,5-Dihydroxy-naphthalene-2-carboxylic acid 4-chloro-benzylamideMol. Formula:
C18H14ClNO3M.W.:
327.77Type:
Small moleculeAlogP:
3.83Polar Surface Area:
69.56HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA442562
Name:
3,7-Dihydroxy-naphthalene-2-carboxylic acid 4-nitro-benzylamideMol. Formula:
C18H14N2O5M.W.:
338.32Type:
Small moleculeAlogP:
3.09Polar Surface Area:
112.70HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA63275
Name:
3-Hydroxy-naphthalene-2-carboxylic acid (4-bromo-phenyl)-amideMol. Formula:
C17H12BrNO2M.W.:
342.19Type:
Small moleculeAlogP:
4.56Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.72DETAILS - 4'-Chloro-3-hydroxy-2-naphthanilide
Name:
3-Hydroxy-naphthalene-2-carboxylic acid (4-chloro-phenyl)-amideMol. Formula:
C17H12ClNO2M.W.:
297.74Type:
Small moleculeAlogP:
4.45Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA65652
Name:
3-Hydroxy-naphthalene-2-carboxylic acid pyridin-2-ylamideMol. Formula:
C16H12N2O2M.W.:
264.28Type:
Small moleculeAlogP:
3.19Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA63411
Name:
3-Hydroxy-naphthalene-2-carboxylic acid (3-amino-phenyl)-amideMol. Formula:
C17H14N2O2M.W.:
278.31Type:
Small moleculeAlogP:
3.38Polar Surface Area:
75.35HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.63DETAILS - ALA304651
Name:
3-Hydroxy-naphthalene-2-carboxylic acid pyridin-3-ylamideMol. Formula:
C16H12N2O2M.W.:
264.28Type:
Small moleculeAlogP:
3.19Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA293187
Name:
3-Hydroxy-naphthalene-2-carboxylic acid 4-chloro-benzylamideMol. Formula:
C18H14ClNO2M.W.:
311.77Type:
Small moleculeAlogP:
4.13Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA62396
Name:
3-Hydroxy-naphthalene-2-carboxylic acid [2-(4-nitro-phenyl)-ethyl]-amideMol. Formula:
C19H16N2O4M.W.:
336.35Type:
Small moleculeAlogP:
3.43Polar Surface Area:
92.47HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA65973
Name:
3-Hydroxy-naphthalene-2-carboxylic acid 4-nitro-benzylamideMol. Formula:
C18H14N2O4M.W.:
322.32Type:
Small moleculeAlogP:
3.38Polar Surface Area:
92.47HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.57DETAILS
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