PDB ligand accession: 8QK
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: UWXKHLVNEQUSFY-NUGSKGIGSA-N
SMILES: COc1ccc(cc1)N=Cc2c(ccc3c2oc4c3c(c(c(c4)Cl)O)Cl)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzofurans
- Subclass: Dibenzofurans
- Class: Benzofurans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5N9K | Download | Experimental | e5n9kA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |