PDB ligand accession: B9T
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LQEPRVHNDMBUPF-GTNSWQLSSA-N
SMILES: CC(C(c1cnc(nc1)C2CC2)Oc3ccc(cc3Br)C#N)NC(=O)C(C)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6EL7 | Download | Experimental | e6el7A1 | Nuclear receptor ligand-binding domain | LigPlot |