zafirlukast (accolate) Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

575.675

ALogP

5.7

Rule of 5

No

Rule of 3

No
Details
  • SMILES: COC1=CC(=CC=C1CC2=CN(C)C3=C2C=C(NC(=O)OC4CCCC4)C=C3)C(=O)NS(=O)(=O)C5=CC=CC=C5C
  • InChIKey: YEEZWCHGZNKEEK-UHFFFAOYSA-N
    1S/C31H33N3O6S/c1-20-8-4-7-11-29(20)41(37,38)33-30(35)22-13-12-21(28(17-22)39-3)16-23-19-34(2)27-15-14-24(18-26(23)27)32-31(36)40-25-9-5-6-10-25/h4,7-8,11-15,17-19,25H,5-6,9-10,16H2,1-3H3,(H,32,36)(H,33,35)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL603   ChEMBL
zafirlukast

XZ629S5L50   NCATS
zafirlukast *

Zafirlukast   Wikipedia

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