PDB ligand accession: X02
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NJWGWVLFRYCKGD-UHFFFAOYSA-N
SMILES: C=CCNc1nc(c(s1)C(=O)c2ccccc2)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3QQK | Download | Experimental | e3qqkA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |