BioLiP

PDB

BioLiP

PDB CCD ID:

TZO

Number of entries in BioLiP:

Chemical formula:

C4 H3 N O2 S

InChI:

InChI=1S/C4H3NO2S/c6-4(7)3-1-8-2-5-3/h1-2H,(H,6,7)

InChIKey:

HMVYYTRDXNKRBQ-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.370	OC(=O)c1cscn1
OpenEye OEToolkits 1.7.2	c1c(ncs1)C(=O)O
ACDLabs 12.01	O=C(O)c1ncsc1

Name:

1,3-THIAZOLE-4-CARBOXYLIC ACID

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).