PDB ligand accession: NM0
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: GRCPKASYWFJZEJ-UHFFFAOYSA-N
SMILES: c1ccn2c(c1)ncc2NC(=O)Cc3cccc(c3)Cl
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 |
---|---|---|---|---|---|
7GEI | Download | Experimental | e7geiA1 e7geiA2 | cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |
7GLQ | Download | Experimental | e7glqA1 e7glqA2 e7glqB1 e7glqA2 e7glqB1 e7glqB2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |