PDB ligand accession: HZY
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NINGXBBUHSHWQA-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1OC)OC)C[n+]2ccc3cc(ccc3c2)OS(=O)(=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: Benzylisoquinolines
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6E92 | Download | Experimental | e6e92A1 | Carbonic anhydrase | LigPlot |