PDB ligand accession: VRA
DrugBank: DB06309
PubChem:
ChEMBL:
InChI Key: RDSACQWTXKSHJT-NSHDSACASA-N
SMILES: COc1cc(c(c(c1NS(=O)(=O)C2(CC2)CC(CO)O)Nc3ccc(cc3F)I)F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Sulfanilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3E8N | Download | Experimental | e3e8nA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |