PDB ligand accession: 9EL
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: OGGAKUIGELBYAA-GHTZIAJQSA-N
SMILES: COc1cc2c(ccc3c2CC(C(O3)c4cc(c(cc4F)F)F)N)cc1C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Flavonoids
- Subclass: Flavans
- Class: Flavonoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5ZID | Download | Experimental | e5zidA1 e5zidA2 e5zidB1 e5zidB2 | alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases beta-propeller-like | LigPlot |