PDB ligand accession: 5RC
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QXXZIVGTJXYLQO-CZUORRHYSA-N
SMILES: CCc1c(cc(s1)C(=O)NC2C(CCCC2(F)F)N)c3cnn4c3ncc(c4)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrazolopyrimidines
- Subclass: Pyrazolo[1,5-a]pyrimidines
- Class: Pyrazolopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5ES1 | Download | Experimental | e5es1A2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |