PDB ligand accession: 4O4
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MPHFQCQENHLINH-SBUREZEXSA-N
SMILES: CCC(=O)CN(C1C=CN(C1=O)C(C)C(=O)N2CCOCC2)S(=O)(=O)c3ccc4cc(ccc4c3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4ZH8 | Download | Experimental | e4zh8A1 | cradle loop barrel | LigPlot |