PDB ligand accession: 7GF
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: UEDYOLMWFOHHRV-BENRWUELSA-N
SMILES: COC(=O)C(=C1N(C(=O)CS1)c2ccc(cc2)Br)CN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Halobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5H2Z | Download | Experimental | e5h2zA1 | TIM beta/alpha-barrel | LigPlot |