PDB ligand accession: T5N
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: KYRLGFWGXVFTSV-UHFFFAOYSA-N
SMILES: CC(C)(C(=O)NCCS)Oc1ccc(cc1)Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7BA3 | Download | Experimental | e7ba3A1 | Repetitive alpha hairpins | LigPlot |