PDB ligand accession: W09
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: HXHWGNOIRHNHBC-JTQLQIEISA-N
SMILES: c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)NC(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organohalogen compounds
- Class: Alkyl halides
- Subclass: Alkyl fluorides
- Class: Alkyl halides
- Superclass: Organohalogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3WSP | Download | Experimental | e3wspA1 e3wspB1 | Cytochrome P450 Cytochrome P450 | LigPlot |