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BioLiP Library

PDB CCD ID: BOT
Number of entries in BioLiP: 0
Chemical formula: C7 H5 N S
InChI: InChI=1/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H
InChIKey: IOJUPLGTWVMSFF-UHFFFAOYAC
SMILES:
SoftwareSMILES
ACDLabs 10.04n1c2ccccc2sc1
CACTVS 3.341s1cnc2ccccc12
OpenEye OEToolkits 1.5.0c1ccc2c(c1)ncs2
Name:BENZOTHIAZOLE
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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