PDB ligand accession: PKB
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FXUBIYKZSFWJQZ-UHFFFAOYSA-N
SMILES: CCOc1ccc2c(cnn2n1)c3ccnc(n3)Nc4cc(cc(c4)OC)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Trifluoromethylbenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6ZLN | Download | Experimental | e6zlnA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |