PDB ligand accession: X9J
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KHIWVHWOVLFXIZ-UHFFFAOYSA-N
SMILES: CC(C)(C)c1nc(on1)C(=O)NCc2ccc(cc2F)c3ccnc4c3[nH]c(n4)c5cnn(c5)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7KXL | Download | Experimental | e7kxlA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |