PDB ligand accession: M9K
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LJYRIWUQISYYHA-UHFFFAOYSA-N
SMILES: c1nc2c(c(sc2c(n1)SCC(=O)O)Cl)C3CC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Thienopyrimidines
- Subclass: None
- Class: Thienopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6T2K | Download | Experimental | e6t2kA1 | alpha/beta-Hydrolases | LigPlot |