pemirolast   Click here for help

GtoPdb Ligand ID: 7329

Synonyms: Alamast® | Alegysal® | BMY-26517
Approved drug
pemirolast is an approved drug (FDA (1999))
Compound class: Synthetic organic
Comment: Pemirolast is an antihistamine.
Marketed formulations may contain pemirolast potassium salt (PubChem CID 443866).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 88.83
Molecular weight 228.08
XLogP 1.81
No. Lipinski's rules broken 0
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Canonical SMILES Cc1cccn2c1ncc(c2=O)c1n[nH]nn1
Isomeric SMILES Cc1cccn2c1ncc(c2=O)c1n[nH]nn1
InChI InChI=1S/C10H8N6O/c1-6-3-2-4-16-9(6)11-5-7(10(16)17)8-12-14-15-13-8/h2-5H,1H3,(H,12,13,14,15)
Bioactivity Comments
We have been unable to find publicly available affinity data for this drug at its proposed molecular target to substantiate its MMOA, and have therefore not tagged a primary drug target.