PDB ligand accession: 1FL
DrugBank: DB00861
PubChem:
ChEMBL:
InChI Key: HUPFGZXOMWLGNK-UHFFFAOYSA-N
SMILES: c1cc(c(cc1c2ccc(cc2F)F)C(=O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7K12 | Download | Experimental | e7k12A1 e7k12B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |