PDB ligand accession: X63
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: STRAQIMXXYJKPS-UHFFFAOYSA-N
SMILES: c1c(c(cc(c1[N+](=O)[O-])NCCO)NCc2cnc(nc2)N)C(=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3QX2 | Download | Experimental | e3qx2A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |