ZAFIRLUKAST Next Previous

ChEMBL ID CHEMBL603
PubChem CID 5717
DrugBank Accession Number DB00549
ClinicalTrials ZAFIRLUKAST
Molecular Formula C31H33N3O6S
Inchikey YEEZWCHGZNKEEK-UHFFFAOYSA-N

Smiles
COc1cc(ccc1Cc2cn(C)c3ccc(NC(=O)OC4CCCC4)cc23)C(=O)NS(=O)(=O)c5ccccc5C

Synonyms
ACCOLATE, ICI 204,219, ZAFIRLUKAST, Zarfirlukast

Libraries
O'Brien

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 2
Molecular Species ACID
Molecular Properties
Molecular Weight 575.69
Rotatable Bonds 8
Acidic pKa (ACD) 4.94
Basic pKa (ACD) 0.73
LogP (ACD) 5.04
LogD (ACD) 3.17
ALogP 5.7
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