PDB ligand accession: O5C
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NSDJNMWFQYNAQU-UHFFFAOYSA-N
SMILES: Cc1c(c2ccccn2c1C(=O)c3ccc(cc3)F)C(=O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7GF9 | Download | Experimental | e7gf9A1 e7gf9A2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel | LigPlot |