PDB ligand accession: 5GL
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: KUWKRQXLULNLGL-UHFFFAOYSA-N
SMILES: CCCN1C2=C(CCC2)C(=NC1=O)SC(C)C
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organosulfur compounds
- Class: Thioethers
- Subclass: Aryl thioethers
- Class: Thioethers
- Superclass: Organosulfur compounds
| # | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
|---|---|---|---|---|---|
| 1 | P11838_5GL | P11838 | Endothiapepsin (EC 3.4.23.22) | n/a |