PDB ligand accession: 8RN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NRRXSEFLOFZNSO-OAHLLOKOSA-N
SMILES: CC(CC(=O)N1CCC(CC1)(CN2C=Nc3c(csc3C2=O)Br)O)c4ccccc4
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 |
---|---|---|---|---|---|
5N9R | Download | Experimental | e5n9rA1 e5n9rB1 | Cysteine proteinases-like Cysteine proteinases-like | LigPlot |