PDB ligand accession: ACJ
DrugBank: DB07338
PubChem:
ChEMBL:
InChI Key: NUFNQYOELLVIPL-UHFFFAOYSA-N
SMILES: c1cc(c(cc1C(F)(F)F)Cl)Oc2ccc(c(c2)C(=O)O)[N+](=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylethers
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3I6D | Download | Experimental | e3i6dA1 e3i6dA2 e3i6dB3 e3i6dB1 | FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like | LigPlot |