PDB ligand accession: K5I
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ABUKUMWSIDVZJQ-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C(C(=O)O)Sc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organosulfur compounds
- Class: Thioethers
- Subclass: Aryl thioethers
- Class: Thioethers
- Superclass: Organosulfur compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7ZWS | Download | Experimental | e7zwsA1 | POZ domain | LigPlot |