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BioLiP

PDB CCD ID: ZUL
Number of entries in BioLiP: 1
Chemical formula: C19 H14 F N O2
InChI: InChI=1S/C19H14FNO2/c20-15-9-10-17(19(22)23)18(12-15)21-16-8-4-7-14(11-16)13-5-2-1-3-6-13/h1-12,21H,(H,22,23)
InChIKey: JGUSPMKKPPHSQY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)c2cccc(c2)Nc3cc(ccc3C(=O)O)F
CACTVS 3.385OC(=O)c1ccc(F)cc1Nc2cccc(c2)c3ccccc3
Name:4-fluoranyl-2-[(3-phenylphenyl)amino]benzoic acid
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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