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BioLiP Library

PDB CCD ID: A1ANE
Number of entries in BioLiP: 1
Chemical formula: C8 H6 N2 O2
InChI: InChI=1S/C8H6N2O2/c11-8-10-9-7(12-8)6-4-2-1-3-5-6/h1-5H,(H,10,11)
InChIKey: RFJQGIYJJLWZJP-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)c2nnc(o2)O
ACDLabs 12.01Oc1nnc(o1)c1ccccc1
CACTVS 3.385Oc1oc(nn1)c2ccccc2
Name:5-phenyl-1,3,4-oxadiazol-2-ol
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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