KNZFQMIKJZQZJD-UHFFFAOYSA-N

URI: https://gptkb.org/entity/KNZFQMIKJZQZJD-UHFFFAOYSA-N
GPTKB entity
Statements (51)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
gptkbp:ATCCode M01AE01
gptkbp:bioavailability 80–100%
gptkbp:boilingPoint 157 °C (decomposes)
gptkbp:brand gptkb:Nurofen
gptkb:Motrin
gptkb:Advil
gptkb:Brufen
gptkbp:CASNumber 15687-27-1
gptkbp:category gptkb:NSAID
analgesic
antipyretic
propionic acid derivative
gptkbp:commonName gptkb:Ibuprofen
gptkbp:contraindication asthma
peptic ulcer
pregnancy (third trimester)
gptkbp:discoveredBy gptkb:Stewart_Adams
gptkbp:discoveredIn 1961
gptkbp:eliminationHalfLife 1.8–2 hours
gptkbp:excretion urine
gptkbp:hasInChIKey gptkb:KNZFQMIKJZQZJD-UHFFFAOYSA-N
gptkbp:hasMolecularFormula C13H18O2
gptkbp:hasSMILES CC(C)Cc1ccc(cc1)C(C)C(=O)O
gptkbp:hasTherapeuticUse analgesic
anti-inflammatory
antipyretic
https://www.w3.org/2000/01/rdf-schema#label KNZFQMIKJZQZJD-UHFFFAOYSA-N
gptkbp:IUPACName gptkb:2-(4-isobutylphenyl)propanoic_acid
gptkbp:legalStatus gptkb:OTC
gptkbp:mechanismOfAction non-selective COX inhibitor
gptkbp:meltingPoint 75-78 °C
gptkbp:metabolism liver
gptkbp:molecularWeight 206.28 g/mol
gptkbp:pregnancyCategory C (US)
D (third trimester, US)
gptkbp:proteinBinding 99%
gptkbp:PubChem_CID gptkb:DB01050
gptkb:CHEMBL521
3672
gptkbp:routeOfAdministration oral
topical
intravenous
gptkbp:sideEffect nausea
dizziness
gastrointestinal irritation
gptkbp:solubility 21 mg/L (20 °C)
gptkbp:UNII WK2XYI10QM
gptkbp:WHOModelListOfEssentialMedicines yes
gptkbp:bfsParent gptkb:1,1,1,2-Tetrafluoroethane
gptkbp:bfsLayer 7