Responsive image

Common name


Ketoprofen

IUPAC name


2-(3-benzoylphenyl)propanoic acid

SMILES


CC(C(O)=O)C1=CC(=CC=C1)C(=O)C1=CC=CC=C1

Compound class


Anti-Inflammatory Agents, Non-Steroidal; Cyclooxygenase Inhibitors; Musculo-Skeletal System; Antiinflammatory and Antirheumatic Products, Non-Steroids; Antiinflammatory and Antirheumatic Products; Antiinflammatory Preparations, Non-Steroids for Topical Use; Topical Products for Joint and Muscular Pain; Propionic Acid Derivatives; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C8 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C8 Inducers;

Therapeutic area


For symptomatic treatment of acute and chronic rheumatoid arthritis, osteoarthritis, ankylosing spondylitis, primary dysmenorrhea and mild to moderate pain associated with musculotendinous trauma (sprains and strains), postoperative (including dental surgery) or postpartum pain.

Common name


Ketoprofen

IUPAC name


2-(3-benzoylphenyl)propanoic acid

SMILES


CC(C(O)=O)C1=CC(=CC=C1)C(=O)C1=CC=CC=C1

INCHI


InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)

FORMULA


C16H14O3

Responsive image

Common name


Ketoprofen

IUPAC name


2-(3-benzoylphenyl)propanoic acid

Molecular weight


254.281

clogP


3.366

clogS


-3.315

HBond Acceptor


3

HBond Donor


1

Total Polar
Surface Area


54.37

Number of Rings


2

Rotatable Bond


4

Drug ID Common name Structure CAS SMILE Frequency
FDBF00005 benzene Responsive image c1ccccc1 0.2824
FDBF00047 propionic acid Responsive image CCC(=O)O 0.0395
FDBF01007 benzaldehyde Responsive image c1(ccccc1)C=O 0.0086
FDBF01292 (2R)-2-phenylpropanoic acid Responsive image c1(ccccc1)C(C)C(=O)O 0.0014
FDBF02264 (2R)-2-(3-formylphenyl)propanoic acid Responsive image O=Cc1cc(ccc1)C(C)C(=O)O 0.0003
5 , 1