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BioLiP

PDB CCD ID: DFB
Number of entries in BioLiP: 6
Chemical formula: C7 H6 F2 O
InChI: InChI=1S/C7H6F2O/c8-6-3-1-2-5(4-10)7(6)9/h1-3,10H,4H2
InChIKey: JSFGDUIJQWWBGY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04Fc1c(cccc1F)CO
OpenEye OEToolkits 1.5.0c1cc(c(c(c1)F)F)CO
CACTVS 3.341OCc1cccc(F)c1F
Name:2,3-DIFLUOROBENZYL ALCOHOL
ChEMBL: CHEMBL1232182
DrugBank: DB04312
ZINC: ZINC000000409277
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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