PDB ligand accession: PWS
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PBQNVDKEOYJSNU-UHFFFAOYSA-N
SMILES: CN1C(=O)C=C(N=C1SC)C(F)(F)F
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 |
---|---|---|---|---|---|
5QTS | Download | Experimental | e5qtsA1 e5qtsB1 e5qtsC1 e5qtsD1 | beta-Grasp beta-Grasp beta-Grasp beta-Grasp | LigPlot |