PDB ligand accession: 965
DrugBank: DB03791
PubChem: 447905;72199895;
ChEMBL:
InChI Key: NAXSRXHZFIBFMI-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C(CN(CCCOc2cccc(c2)CC(=O)O)Cc3cccc(c3Cl)C(F)(F)F)c4ccccc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylmethanes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4NQA | Download | Experimental | e4nqaB1 e4nqaI2 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |