SEQ2FUN

BioLiP

PDB CCD ID: OD3
Number of entries in BioLiP: 1
Chemical formula: C3 H3 N O2 S
InChI: InChI=1S/C3H3NO2S/c5-2-1-7-3(6)4-2/h1H2,(H,4,5,6)
InChIKey: ZOBPZXTWZATXDG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C1C(=O)NC(=O)S1
CACTVS 3.385O=C1CSC(=O)N1
Name:1,3-thiazolidine-2,4-dione;
2,4-Thiazolidinedione
ChEMBL: CHEMBL85398
DrugBank: DB11898
ZINC: ZINC000008554292

Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).