PDB ligand accession: S57
DrugBank: DB08509
PubChem:
ChEMBL:
InChI Key: UKVVEWLDHJDSNJ-UHFFFAOYSA-N
SMILES: COc1ccc(c(c1)Cl)OCCCCCCn2ccnc2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: Anisoles
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1HRI | Download | Experimental | e1hri11 e1hri31 | jelly-roll jelly-roll | LigPlot |