PDB ligand accession: UGM
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: DQOFNGNCBXHENB-UHFFFAOYSA-N
SMILES: c1cc(cnc1)NC(=O)Cc2cc(cnc2)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: N-arylamides
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5RGW | Download | Experimental | e5rgwA1 e5rgwA2 | cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |