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BioLiP Library

PDB CCD ID: WPY
Number of entries in BioLiP: 1
Chemical formula: C5 H6 N2 O S
InChI: InChI=1S/C5H6N2OS/c1-4(8)7-5-6-2-3-9-5/h2-3H,1H3,(H,6,7,8)
InChIKey: WXPLRSVMGRAIGW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01n1c(NC(=O)C)scc1
OpenEye OEToolkits 2.0.7CC(=O)Nc1nccs1
CACTVS 3.385CC(=O)Nc1sccn1
Name:N-(1,3-thiazol-2-yl)acetamide
ZINC: ZINC000000125033
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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