PDB ligand accession: N3R
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: HLMOMNRZAYBAJZ-UHFFFAOYSA-N
SMILES: COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3c2c(ccc3)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Quinoline carboxamides
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7GE0 | Download | Experimental | e7ge0A1 e7ge0A2 | cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |