PDB ligand accession: 3YR
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DNXZIJKGPFJRAA-NSHDSACASA-N
SMILES: c1cc(c(c(c1)F)c2nc(cs2)C(=O)Nc3cnccc3OC4CCNC4)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Thiazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4XHK | Download | Experimental | e4xhkB1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |