PDB ligand accession: EK2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: BLRDCIBLWJFEDC-UHFFFAOYSA-N
SMILES: c1c(cc(cc1Cl)Cl)c2cn[nH]c2c3cc([nH]c3)C(=O)N4CCOCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4FUY | Download | Experimental | e4fuyA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |