ALA77245Name:
Sodium salt [2-(2,4-difluoro-phenylamino)-phenyl]-acetateMol. Formula:
C14H10F2NNaO2M.W.:
285.23Type:
Small moleculeAlogP:
3.34Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS
ALA75976Name:
[2-(2,6-Dichloro-4-hydroxy-3-methoxy-phenylamino)-phenyl]-acetic acidMol. Formula:
C15H13Cl2NO4M.W.:
342.18Type:
Small moleculeAlogP:
4.08Polar Surface Area:
78.79HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS
ALA309569Name:
[2-(3,5-Dichloro-phenylamino)-phenyl]-acetic acidMol. Formula:
C14H11Cl2NO2M.W.:
296.15Type:
Small moleculeAlogP:
4.36Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS
ALA310696Name:
[2-(2,4-Dichloro-phenylamino)-phenyl]-acetic acidMol. Formula:
C14H11Cl2NO2M.W.:
296.15Type:
Small moleculeAlogP:
4.36Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS
Type:
Small moleculeAlogP:
4.18Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.84DETAILS- ALA449952
Name:
[2-(2-Chloro-3-methyl-phenylamino)-phenyl]-acetic acidMol. Formula:
C15H14ClNO2M.W.:
275.74Type:
Small moleculeAlogP:
4.02Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS -
Type:
Small moleculeAlogP:
3.67Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA306994
Name:
[2-(2,3-Dichloro-phenylamino)-phenyl]-acetic acidMol. Formula:
C14H11Cl2NO2M.W.:
296.15Type:
Small moleculeAlogP:
4.36Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA1035
Name:
[2-(2,6-Dichloro-3-hydroxy-phenylamino)-phenyl]-acetic acidMol. Formula:
C14H11Cl2NO3M.W.:
312.15Type:
Small moleculeAlogP:
4.07Polar Surface Area:
69.56HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA77576
Name:
[2-(3-Chloro-2-methyl-phenylamino)-phenyl]-acetic acidMol. Formula:
C15H14ClNO2M.W.:
275.74Type:
Small moleculeAlogP:
4.02Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS - ALA77731
Name:
[2-Bromo-6-(2,6-dichloro-phenylamino)-phenyl]-acetic acidMol. Formula:
C14H10BrCl2NO2M.W.:
375.05Type:
Small moleculeAlogP:
5.13Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.78DETAILS - Diclofenac Sodium
Name:
Sodium salt {2-[(2,6-dichloro-phenyl)-methyl-amino]-phenyl}-acetateMol. Formula:
C14H10Cl2NNaO2M.W.:
318.14Type:
Small moleculeAlogP:
4.36Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA76084
Name:
[2-(2-Chloro-6-methyl-phenylamino)-phenyl]-acetic acidMol. Formula:
C15H14ClNO2M.W.:
275.74Type:
Small moleculeAlogP:
4.02Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS - ALA308266
Name:
Sodium salt [2-(2-bromo-6-chloro-phenylamino)-phenyl]-acetateMol. Formula:
C14H10BrClNNaO2M.W.:
362.59Type:
Small moleculeAlogP:
4.47Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA76372
Name:
[2-(2-Chloro-6-iodo-phenylamino)-phenyl]-acetic acidMol. Formula:
C14H11ClINO2M.W.:
387.60Type:
Small moleculeAlogP:
4.32Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.77DETAILS - 3′-Hydroxy-4′-methoxydiclofenac
Name:
[2-(2,6-Dichloro-3-hydroxy-4-methoxy-phenylamino)-phenyl]-acetic acidMol. Formula:
C15H13Cl2NO4M.W.:
342.18Type:
Small moleculeAlogP:
4.08Polar Surface Area:
78.79HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA1032
Name:
[2-(2,6-Dichloro-4-hydroxy-phenylamino)-5-hydroxy-phenyl]-acetic acidMol. Formula:
C14H11Cl2NO4M.W.:
328.15Type:
Small moleculeAlogP:
3.78Polar Surface Area:
89.79HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS - 2-(2-((2，6-Dichlorophenyl)amino)-5-hydroxyphenyl)acetic acid
Name:
[2-(2,6-Dichloro-phenylamino)-5-hydroxy-phenyl]-acetic acidMol. Formula:
C14H11Cl2NO3M.W.:
312.15Type:
Small moleculeAlogP:
4.07Polar Surface Area:
69.56HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA308821
Name:
[2-(2,3-Dimethyl-phenylamino)-phenyl]-acetic acidMol. Formula:
C16H17NO2M.W.:
255.32Type:
Small moleculeAlogP:
3.67Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA308378
Name:
[2-(2,3,5,6-Tetramethyl-phenylamino)-phenyl]-acetic acidMol. Formula:
C18H21NO2M.W.:
283.37Type:
Small moleculeAlogP:
4.29Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.88DETAILS
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