BENZALKONIUM CHLORIDE Next Previous

ChEMBL ID CHEMBL502109
PubChem CID 3014024
DrugBank Accession Number
ClinicalTrials BENZALKONIUM CHLORIDE
Molecular Formula C22H40ClN
Inchikey XIWFQDBQMCDYJT-UHFFFAOYSA-M

Smiles
[Cl-].CCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1

Synonyms
Alkylbenzyldimethylammonium Cl, Ark Klens, BENZALKONIUM CHLORIDE, Hyamine 3500, Myosan, ROCCAL, Roccal, ZEPHIRAN CHLORIDE, Zephiran

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts
Passes of Rule of 3
Rule of 5 Violations 1
Molecular Species NEUTRAL
Molecular Properties
Molecular Weight 354.01
Rotatable Bonds 14
Acidic pKa (ACD) 12.77
Basic pKa (ACD) 7.52
LogP (ACD) 8.09
LogD (ACD) 7.7
ALogP 5.98
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