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BioLiP

PDB CCD ID: T63
Number of entries in BioLiP: 2
Chemical formula: C10 H8 N2 O
InChI: InChI=1S/C10H8N2O/c13-9-6-11-10(12-7-9)8-4-2-1-3-5-8/h1-7,13H
InChIKey: VXOJYMHSOARYSV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)c2ncc(cn2)O
CACTVS 3.385Oc1cnc(nc1)c2ccccc2
ACDLabs 12.01Oc1cnc(nc1)c1ccccc1
Name:2-phenylpyrimidin-5-ol
ZINC: ZINC000020283025
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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