flurbiprofen   Click here for help

GtoPdb Ligand ID: 4194

Synonyms: Ansaid® | Froben®
Approved drug Immunopharmacology Ligand
flurbiprofen is an approved drug (FDA (1986))
Compound class: Synthetic organic
Comment: Flurbiprofen is member of the nonsteroidal anti-inflammatory drug (NSAID) family. It has antipyretic and analgesic activity.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 37.3
Molecular weight 244.09
XLogP 3.76
No. Lipinski's rules broken 0
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Canonical SMILES OC(=O)C(c1ccc(c(c1)F)c1ccccc1)C
Isomeric SMILES OC(=O)C(c1ccc(c(c1)F)c1ccccc1)C
InChI InChI=1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)
Classification Click here for help
Compound class Synthetic organic
Ligand families/groups Non-steroidal anti-inflammatory ligands
Approved drug? Yes (FDA (1986))
IUPAC Name Click here for help
2-(3-fluoro-4-phenylphenyl)propanoic acid
International Nonproprietary Names Click here for help
INN number INN
3220 flurbiprofen
Synonyms Click here for help
Ansaid® | Froben®
Database Links Click here for help
CAS Registry No. 5104-49-4 (source: Scifinder)
DrugBank Ligand DB00712
DrugCentral Ligand 1219
GtoPdb PubChem SID 178101011
PubChem CID 3394
Search Google for chemical match using the InChIKey SYTBZMRGLBWNTM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SYTBZMRGLBWNTM
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UniChem Compound Search for chemical match using the InChIKey SYTBZMRGLBWNTM-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey SYTBZMRGLBWNTM-UHFFFAOYSA-N
Wikipedia Flurbiprofen

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Flurbiprofen (links to external site)
Cat. No. 1769