naproxen   

GtoPdb Ligand ID: 5230

Synonyms: (S)-naproxen | Aleve® | Naprosy®
naproxen is an approved drug (FDA (1976))
Compound class: Synthetic organic
Comment: Naproxen is one of the 2-arylpropionic acid ('profen') family of nonsteroidal anti-inflammatory drugs (NSAIDs), like ibuprofen.
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2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 46.53
Molecular weight 230.09
XLogP 2.84
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES COc1ccc2c(c1)ccc(c2)C(C(=O)O)C
Isomeric SMILES COc1ccc2c(c1)ccc(c2)[C@@H](C(=O)O)C
InChI InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
InChI Key CMWTZPSULFXXJA-VIFPVBQESA-N
Classification
Compound class Synthetic organic
Ligand families/groups Non-steroidal anti-inflammatory ligands
Approved drug? Yes (FDA (1976))
Prodrug naproxcinod
IUPAC Name
(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid
International Nonproprietary Names
INN number INN
2979 naproxen
Synonyms
(S)-naproxen | Aleve® | Naprosy®
Database Links
CAS Registry No. 22204-53-1
ChEBI CHEBI:7476
ChEMBL Ligand CHEMBL154
DrugBank Ligand DB00788
DrugCentral Ligand 1883
GtoPdb PubChem SID 178101914
PubChem CID 156391
RCSB PDB Ligand NPS
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Wikipedia Naproxen