PDB ligand accession: EM6
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PJIRQIUNBLUWJK-UHFFFAOYSA-N
SMILES: CCC1=C(N=C2C(=CNN2C1=O)C#N)C
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 |
---|---|---|---|---|---|
5FJK | Download | Experimental | e5fjkA1 | jelly-roll | LigPlot |