PDB ligand accession: 6E8
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: UHVUUCAAVHIPKM-UHFFFAOYSA-N
SMILES: CC1=C(C(=O)n2c(c(cn2)C#N)N1)C(C)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 |
---|---|---|---|---|---|
5IVE | Download | Experimental | e5iveA1 | jelly-roll | LigPlot |