PDB ligand accession: FWY
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: JQYQEKDPLZLZII-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)[N+](=O)O)C(=O)N2CCN(CC2)S(=O)(=O)c3cccc4c3ccnc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: None
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6D4R | Download | Experimental | e6d4rA1 | TIM beta/alpha-barrel | LigPlot |