PDB ligand accession: NKX
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: RFISBOUXKIOATP-QXEWZRGKSA-N
SMILES: CCN(C1CC(S(=O)(=O)c2c1cc(s2)S(=O)(=O)N)C)C(=O)OCC(CO[N+](=O)[O-])O[N+](=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Thiophenes
- Subclass: 2,3,5-trisubstituted thiophenes
- Class: Thiophenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3K2F | Download | Experimental | e3k2fA1 | Carbonic anhydrase | LigPlot |