PDB ligand accession: RS1
DrugBank: DB08490
PubChem:
ChEMBL:
InChI Key: ROSNVSQTEGHUKU-UHFFFAOYSA-N
SMILES: c1cc(ccc1Oc2ccc(cc2)Cl)S(=O)(=O)CC3(CCOCC3)C(=O)NO
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylethers
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
830C | Download | Experimental | e830cA1 e830cB1 | Zincin-like Zincin-like | LigPlot |