PDB ligand accession: VGK
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MWVUNZGIJWXHFJ-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1OC)OC)c2cc(c(nc2)N)c3ccc(cc3)C(=O)O
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 |
---|---|---|---|---|---|
2WQO | Download | Experimental | e2wqoA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |