PDB ligand accession: L5Y
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CNTAIQDCYAEVFL-UHFFFAOYSA-N
SMILES: c1cncc2c1c(n[nH]2)c3cc(cc(n3)C(F)(F)F)NCCO
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Aminopyridines and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4CC6 | Download | Experimental | e4cc6A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |