PDB ligand accession: JS3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JUNYYPFCTFDDHR-UHFFFAOYSA-N
SMILES: Cc1c(sc(n1)Cl)C(=O)Nc2ccc3ccccc3c2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4JS3 | Download | Experimental | e4js3A1 | TIM beta/alpha-barrel | LigPlot |