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BioLiP

PDB CCD ID: Y8D
Number of entries in BioLiP: 1
Chemical formula: C6 H4 F I
InChI: InChI=1S/C6H4FI/c7-5-1-3-6(8)4-2-5/h1-4H
InChIKey: KGNQDBQYEBMPFZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Fc1ccc(I)cc1
OpenEye OEToolkits 2.0.7c1cc(ccc1F)I
Name:1-fluoranyl-4-iodanyl-benzene
ZINC: ZINC000000407030
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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