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BioLiP

PDB CCD ID: A5H
Number of entries in BioLiP: 2
Chemical formula: C11 H9 Cl N2 S
InChI: InChI=1S/C11H9ClN2S/c12-9-3-1-8(2-4-9)10-7-15-11-13-5-6-14(10)11/h1-4,7H,5-6H2
InChIKey: DFKOPKKSCIVOAK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Clc1ccc(cc1)C2=CSC3=NCCN23
OpenEye OEToolkits 2.0.6c1cc(ccc1C2=CSC3=NCCN23)Cl
Name:3-(4-chlorophenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
ZINC: ZINC000000040277
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).
  • 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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