PDB ligand accession: 5H7
DrugBank: DB14943
PubChem:
ChEMBL:
InChI Key: VRQXRVAKPDCRCI-ZNMIVQPWSA-N
SMILES: CC1CC(CC(C1)N)c2ccncc2NC(=O)c3ccc(c(n3)c4c(cccc4F)F)F
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 |
---|---|---|---|---|---|
5DWR | Download | Experimental | e5dwrA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |