pyrazinamide   Click here for help

GtoPdb Ligand ID: 7287

Synonyms: aldinamide | Zinamide®
Approved drug PDB Ligand
pyrazinamide is an approved drug (FDA (no history prior to 1971))
Compound class: Synthetic organic
Comment: This drug is often contained in fixed-mixture formulations with other antibacterial drugs beneficial in the treatment of tuberculosis (eg isoniazid and rifampicin).
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 69.86
Molecular weight 123.04
XLogP -0.37
No. Lipinski's rules broken 0
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Canonical SMILES OC(=N)c1cnccn1
Isomeric SMILES OC(=N)c1cnccn1
InChI InChI=1S/C5H5N3O/c6-5(9)4-3-7-1-2-8-4/h1-3H,(H2,6,9)
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Molecular structure representations generated using Open Babel