PDB ligand accession: 318
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: HZWNNIVRFLRAQW-CHQNGUEUSA-N
SMILES: CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)NC(Cc2cc(cc(c2)F)F)C(C3C(=O)N(CN3)Cc4ccccc4)O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Toluenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3CID | Download | Experimental | e3cidA2 e3cidA3 e3cidB2 e3cidB3 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |