PDB ligand accession: 2WH
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VYPWROGLWNYKDD-UHFFFAOYSA-N
SMILES: CCCn1cc(nc1)CCNC(=O)Nc2nc3ccc(cc3s2)c4cc(cnc4)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzothiazoles
- Subclass: None
- Class: Benzothiazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4PS3 | Download | Experimental | e4ps3A4 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |