PDB ligand accession: 4DT
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WTARZSVAAGFJEN-UHFFFAOYSA-N
SMILES: CCN(c1cccc2c1cn[nH]2)c3c(cnc(n3)NC4=CCC5=CNN(C5=C4)CCCO)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Amines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YJV | Download | Experimental | e4yjvA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |