PDB ligand accession: 1JT
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BBFOREFQNPCWBB-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1OC)Cn2cnc3c2cc4c(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 |
---|---|---|---|---|---|
4NZ9 | Download | Experimental | e4nz9A1 e4nz9B1 | Rossmann-like Rossmann-like | LigPlot |