PDB ligand accession: BLL
DrugBank: DB02704
PubChem:
ChEMBL: n/a
InChI Key: GQKBYZPVKVXMJL-LAFNQVRVSA-N
SMILES: c1ccc(cc1)CCC(C(C(C(CCc2ccccc2)C(=O)NC3c4ccccc4CC3O)O)O)C(=O)NC5c6ccccc6CC5O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Indanes
- Subclass: None
- Class: Indanes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1WBM | Download | Experimental | e1wbmB1 e1wbmA1 | cradle loop barrel cradle loop barrel | LigPlot |