PDB ligand accession: GKF
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QWWAONJINWEHJL-UHFFFAOYSA-N
SMILES: c1cc(c2c(c1)c(n[nH]2)I)C=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7CX9 | Download | Experimental | e7cx9A1 e7cx9A2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel | LigPlot |