PDB ligand accession: 9TV
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YOAVNWPBYNWYQZ-UHFFFAOYSA-N
SMILES: c1cnc(nc1)CCC(=O)Nc2cc(n[nH]2)c3ccc4c(c3)CCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Tetralins
- Subclass: None
- Class: Tetralins
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5VZ6 | Download | Experimental | e5vz6A4 | Alpha-beta plaits | LigPlot |