PDB ligand accession: KI5
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: DSRGZRHOYJEVPF-UHFFFAOYSA-N
SMILES: Cc1cc(nc(n1)SCCO)C
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 |
---|---|---|---|---|---|
4UVE | Download | Experimental | e4uveA1 | Rossmann-like | LigPlot |