PDB ligand accession: 6BB
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GZSRUYQFWHDLJI-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)n2cc(cn2)c3ccncc3OCC4CCNCC4)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5IHC | Download | Experimental | e5ihcA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |