PDB ligand accession: BQ3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: AGRBXKCSGCUXST-UHFFFAOYSA-N
SMILES: CC(C)(C)OC(=O)N1CCc2ccc(cc2C1)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Tetrahydroisoquinolines
- Subclass: None
- Class: Tetrahydroisoquinolines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6JIO | Download | Experimental | e6jioA1 e6jioD1 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |