Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII ML56O2Z92I
EPA CompTox DTXSID70169754
Parent Compound: OXAPROZIN

Structure

InChI Key QTAQWNSMRSLSCG-UHFFFAOYSA-M
Smiles O=C([O-])CCc1nc(-c2ccccc2)c(-c2ccccc2)o1.[K+]
InChI
InChI=1S/C18H15NO3.K/c20-16(21)12-11-15-19-17(13-7-3-1-4-8-13)18(22-15)14-9-5-2-6-10-14;/h1-10H,11-12H2,(H,20,21);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H14KNO3
Molecular Weight 331.41
AlogP 4.03
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 63.33
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 22.0

Metabolites Network

visNetwork

Pharmacology

Mechanism of Action Action Reference
Cyclooxygenase inhibitor INHIBITOR PubMed PubMed PubMed PubMed PubMed DailyMed

Target Conservation

Protein: Cyclooxygenase

Description: Prostaglandin G/H synthase 1

Organism : Homo sapiens

P23219 ENSG00000095303
Protein: Cyclooxygenase

Description: Prostaglandin G/H synthase 2

Organism : Homo sapiens

P35354 ENSG00000073756

Cross References

Resources Reference
ChEMBL CHEMBL1200463
FDA SRS ML56O2Z92I
PubChem 23694685
SureChEMBL SCHEMBL8190699