PDB ligand accession: QMV
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VZZBCNXVZFAIQX-UHFFFAOYSA-N
SMILES: c1cc(c(cc1c2c(n(cn2)CCO)c3ccc4ncc(n4n3)C#N)Cl)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5QU0 | Download | Experimental | e5qu0A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |