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BioLiP

PDB CCD ID: ZO6
Number of entries in BioLiP: 1
Chemical formula: C10 H6 N2 S
InChI: InChI=1S/C10H6N2S/c1-3-11-6-8-7(1)5-12-9-2-4-13-10(8)9/h1-6H
InChIKey: NKBQKUDYRMOAKU-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2c1cncc2c1cnc3c2scc3
CACTVS 3.385s1ccc2ncc3ccncc3c12
ACDLabs 12.01n2cc1ccncc1c3sccc23
Name:thieno[3,2-c][2,6]naphthyridine
ZINC: ZINC000000481000

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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