PDB ligand accession: TIH
DrugBank: DB03673
PubChem: 146719;7111748;
ChEMBL:
InChI Key: WTOFYLAWDLQMBZ-LURJTMIESA-N
SMILES: c1cc(sc1)CC(C(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5LHT | Download | Experimental | e5lhtA1 | Alpha-beta plaits | LigPlot |