PDB ligand accession: 7PQ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LJXMOYXCVXIDDM-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)ccc(c2c3ccc(cc3)C(=O)NCCN4CCOCC4)CN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4EC0 | Download | Experimental | e4ec0A1 e4ec0A2 | Repetitive alpha hairpins Thioredoxin-like | LigPlot |