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BioLiP

PDB CCD ID: O0L
Number of entries in BioLiP: 2
Chemical formula: C14 H12 N4 O2
InChI: InChI=1S/C14H12N4O2/c19-8-9-4-6-10(7-5-9)11-2-1-3-12(20)13(11)14-15-17-18-16-14/h1-7,19-20H,8H2,(H,15,16,17,18)
InChIKey: MHFBCDLPGNNTMV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(c(c(c1)O)c2[nH]nnn2)c3ccc(cc3)CO
ACDLabs 12.01OCc1ccc(cc1)c1cccc(O)c1c1nnn[NH]1
CACTVS 3.385OCc1ccc(cc1)c2cccc(O)c2c3[nH]nnn3
Name:(2M)-4'-(hydroxymethyl)-2-(1H-tetrazol-5-yl)[1,1'-biphenyl]-3-ol
ChEMBL: CHEMBL5285307
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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