LOXOPROFEN

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: Parent
UNII: 3583H0GZAP

Structure
InChI Key YMBXTVYHTMGZDW-UHFFFAOYSA-N
Smile CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1
InChI
InChI=1S/C15H18O3/c1-10(15(17)18)12-7-5-11(6-8-12)9-13-3-2-4-14(13)16/h5-8,10,13H,2-4,9H2,1H3,(H,17,18)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H18O3
Molecular Weight 246.31
AlogP 2.79
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 54.37
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 18.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Cyclooxygenase inhibitor PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Oxidoreductase
- 13500 - - 35-88

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Pain 3 D010146 ClinicalTrials
Low Back Pain 3 D017116 ClinicalTrials
Muscular Diseases 2 D009135 ClinicalTrials
Arthritis, Rheumatoid 2 D001172 ClinicalTrials
Neck Pain 2 D019547 ClinicalTrials

Related Entries

Salt

Cross References

Resources Reference
CAS NUMBER 68767-14-6
ChEBI 76172
ChEMBL CHEMBL19299
DrugBank DB09212
DrugCentral 1615
EPA CompTox DTXSID1045164
FDA SRS 3583H0GZAP
Human Metabolome Database HMDB0041920
PharmGKB PA166049180
PubChem 3965
SureChEMBL SCHEMBL24423
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