CELECOXIB Next Previous

ChEMBL ID CHEMBL118
PubChem CID 2662
DrugBank Accession Number DB00482
ClinicalTrials CELECOXIB
Molecular Formula C17H14F3N3O2S
Inchikey RZEKVGVHFLEQIL-UHFFFAOYSA-N

Smiles
Cc1ccc(cc1)c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C(F)(F)F

Synonyms
CELEBREX, CELECOXIB, Celebra, Celebrex, Onsenal, SC-58635

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species NEUTRAL
Molecular Properties
Molecular Weight 381.37
Rotatable Bonds 4
Acidic pKa (ACD) 9.68
Basic pKa (ACD) -
LogP (ACD) 2.59
LogD (ACD) 2.59
ALogP 4.43
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