PDB ligand accession: VWN
DrugBank: n/a
PubChem: 49853823;135566644;
ChEMBL:
InChI Key: XLESLWHDVUIEMT-UHFFFAOYSA-N
SMILES: Cn1c2ccccc2nc1CC3=NC(=CC(=O)N3)N4CCOCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzimidazoles
- Subclass: None
- Class: Benzimidazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4AJW | Download | Experimental | e4ajwA1 e4ajwB1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |