PDB ligand accession: 8YJ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SWPTTWQFPBNDMV-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)C(=O)O)SCC(=O)c2ccc(cc2)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8DGZ | Download | Experimental | e8dgzB1 e8dgzA1 | Caspase-like Caspase-like | LigPlot |
5V6Z | Download | Experimental | e5v6zB1 | Caspase-like | LigPlot |