PDB ligand accession: V1F
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: IMGFYVAVEMQCNT-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CCS(=O)(=O)c2c(c(c(c(c2F)F)S(=O)(=O)N)F)NCc3ccccc3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylmethylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4QJM | Download | Experimental | e4qjmA1 | Carbonic anhydrase | LigPlot |