PDB ligand accession: J9D
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: OVFXXQZOTWTSJA-UHFFFAOYSA-N
SMILES: c1cc(ccc1C#N)Nc2nc(cc(n2)n3cc(nc3)CCO)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzonitriles
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6M9H | Download | Experimental | e6m9hA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |