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BioLiP

PDB CCD ID: 43G
Number of entries in BioLiP: 1
Chemical formula: C17 H13 N O2
InChI: InChI=1S/C17H13NO2/c19-16-9-10-18(12-17(16)20)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-12,20H
InChIKey: IAMQYYMWXQPFDC-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2c1ccc(cc1)c2cccc(c2)N3C=CC(=O)C(=C3)O
ACDLabs 12.01O=C3C=CN(c2cccc(c1ccccc1)c2)C=C3O
CACTVS 3.385OC1=CN(C=CC1=O)c2cccc(c2)c3ccccc3
Name:1-(biphenyl-3-yl)-3-hydroxypyridin-4(1H)-one
ChEMBL: CHEMBL3425734
ZINC: ZINC000144182227
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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