PDB ligand accession: QJR
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: IOZNTHKFTJIBSE-UHFFFAOYSA-N
SMILES: c1cc(c(cc1CC(=O)Nc2cncc3c2ccnc3)Cl)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Naphthyridines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7GJ1 | Download | Experimental | e7gj1A1 e7gj1A2 e7gj1B1 e7gj1A1 e7gj1B1 e7gj1B2 | cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |