PDB ligand accession: VR7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZGSXCSMJOZJLKM-UHFFFAOYSA-N
SMILES: c1cc(c(cc1c2ccsc2)C(=O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7K13 | Download | Experimental | e7k13B1 e7k13C1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |