PDB ligand accession: B68
DrugBank: DB07423
PubChem:
ChEMBL:
InChI Key: YVXVTLGIDOACBJ-SFHVURJKSA-N
SMILES: CC(=O)Nc1ccc(cc1)OCC(C)(C(=O)Nc2ccc(c(c2)C(F)(F)F)[N+](=O)[O-])O
Drug action: agonist
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3B68 | Download | Experimental | e3b68A1 | Nuclear receptor ligand-binding domain | LigPlot |