PDB ligand accession: GH4
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: WKKCNOKGPKWFJS-FOKLQQMPSA-N
SMILES: c1ccc(cc1)OCCN(Cc2ccc3c(c2)OCO3)c4c(cnc(n4)C=N)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzodioxoles
- Subclass: None
- Class: Benzodioxoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5MQY | Download | Experimental | e5mqyA1 | Cysteine proteinases-like | LigPlot |