PDB ligand accession: UNE
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: OEICZFFUNDGUEF-UHFFFAOYSA-N
SMILES: COc1cc(cc2c1oc(c2)C(=O)O)Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzofurans
- Subclass: None
- Class: Benzofurans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3R01 | Download | Experimental | e3r01A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |