PDB ligand accession: BWE
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: YOJMBDUWFJVSKK-JOCHJYFZSA-N
SMILES: CCS(=O)(=O)c1ccc(cc1)C(C(=O)Nc2cc(cs2)c3cc(cc(c3OC)F)C#N)NC(=O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6ESN | Download | Experimental | e6esnA1 | Nuclear receptor ligand-binding domain | LigPlot |