PDB ligand accession: ZY4
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: LMEDJLLRHRUTJN-SANMLTNESA-N
SMILES: CCn1cc2c3c1cc(cc3N(S(=O)(=O)CC2)C)C(=O)NC(Cc4ccccc4)C(CNC5CCOCC5)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolecarboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2WF4 | Download | Experimental | e2wf4A2 e2wf4A3 | cradle loop barrel cradle loop barrel | LigPlot |