PDB ligand accession: ZES
DrugBank: DB02132
PubChem:
ChEMBL:
InChI Key: SXONDGSPUVNZLO-UHFFFAOYSA-N
SMILES: c1cc2c(cc1Cl)N(C(=O)N(C2=O)Cc3ccc(cc3F)Br)CC(=O)O
Drug action: inhibitor
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 |
---|---|---|---|---|---|
1IEI | Download | Experimental | e1ieiA1 | TIM beta/alpha-barrel | LigPlot |