PDB ligand accession: A80
DrugBank: DB04942
PubChem:
ChEMBL:
InChI Key: MUTNCGKQJGXKEM-UHFFFAOYSA-N
SMILES: CC1(CCC(c2c1ccc(c2)NC(=O)c3ccc(cc3)C(=O)O)(C)C)C
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 |
---|---|---|---|---|---|
7ER7 | Download | Experimental | e7er7A1 | Rossmann-like | LigPlot |