PDB ligand accession: N3I
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WXCJKPMYIYFEDR-UHFFFAOYSA-N
SMILES: Cc1ccncc1NC(=O)Cc2cc(cc(c2)Cl)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylacetamides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7GDZ | Download | Experimental | e7gdzA1 e7gdzA2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel | LigPlot |