SEQ2FUN

BioLiP

PDB CCD ID: OOI
Number of entries in BioLiP: 2
Chemical formula: C7 H5 F O3
InChI: InChI=1S/C7H5FO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,(H,10,11)
InChIKey: TTZOLDXHOCCNMF-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385OC(=O)c1ccc(F)cc1O
OpenEye OEToolkits 3.1.0.0c1cc(c(cc1F)O)C(=O)O
Name:4-fluorosalicyclic acid;
4-fluoranyl-2-oxidanyl-benzoic acid;
4-Fluoro-2-hydroxybenzoic Acid
ChEMBL: CHEMBL1650626
ZINC: ZINC000000404178
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).