PDB ligand accession: 81Y
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BGTSLFFCVKEYPT-UHFFFAOYSA-N
SMILES: CC(C)Oc1ccc2c(c1)c(n[nH]2)c3ccnc(c3)N4CCOCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5U6I | Download | Experimental | e5u6iA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |