Molecular Identity
Ketoprofen
2-(3-benzoylphenyl)propanoic acid
PubChem CID: 3825
Ketoprofen is an oxo monocarboxylic acid that consists of propionic acid substituted by a 3-benzoylphenyl group at position 2. It has a role as a non-steroidal anti-inflammatory drug, an antipyretic, an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor, a xenobiotic, an environmental contaminant and a drug allergen. It is a member of benzophenones and an oxo monocarboxylic acid. It is functionally related to a propionic acid.
2D Structure
Properties
C16H14O3
Molecular Formula
254.28
Molecular Weight
g/mol
254.0943
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
54.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
331
Complexity
SMILES
Canonical SMILES
SMILES: CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)OIsomeric SMILES
SMILES: CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)OSynonyms(20)
ketoprofen22071-15-42-(3-Benzoylphenyl)propanoic acid2-(3-Benzoylphenyl)propionic acidOrudisCapistenActronOruvailAlrheumatKetoprofeneAneolm-Benzoylhydratropic acid3-Benzoylhydratropic acidIso-KKetoprofeno
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Ketoprofen
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