PDB ligand accession: AQ2
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: QBYYCHRRPPTEBG-UHFFFAOYSA-N
SMILES: CC(C)c1cc2c(ccnc2[nH]1)c3ccc(cc3)S(=O)(=O)NC4CCS(=O)(=O)CC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4AWI | Download | Experimental | e4awiA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |