PDB ligand accession: 50R
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: QHMOZKVAGIEXJR-UHFFFAOYSA-N
SMILES: CNC(=O)c1cc2c(cncc2s1)Oc3ccc(cc3)I
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5CEI | Download | Experimental | e5ceiA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |