PDB ligand accession: QDO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DQKNFTLRMZOAMG-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)[n+](c(c([n+]2[O-])CBr)CBr)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4KW6 | Download | Experimental | e4kw6A1 e4kw6B1 e4kw6C1 e4kw6D1 | Thioredoxin-like Thioredoxin-like Thioredoxin-like Thioredoxin-like | LigPlot |