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BioLiP Library

PDB CCD ID: V7V
Number of entries in BioLiP: 2
Chemical formula: C14 H10 N4 O2
InChI: InChI=1S/C14H10N4O2/c19-14(20)12-6-2-4-10(8-12)9-3-1-5-11(7-9)13-15-17-18-16-13/h1-8H,(H,19,20)(H,15,16,17,18)
InChIKey: KEZGIRGXOUGLEM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc(cc(c1)c2[nH]nnn2)c3cccc(c3)C(=O)O
CACTVS 3.385OC(=O)c1cccc(c1)c2cccc(c2)c3[nH]nnn3
Name:3-[3-(1~{H}-1,2,3,4-tetrazol-5-yl)phenyl]benzoic acid
ChEMBL: CHEMBL4162700
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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