BioLiP

PDB

BioLiP

PDB CCD ID:

QHX

Number of entries in BioLiP:

Chemical formula:

C7 H5 F2 N O2

InChI:

InChI=1S/C7H5F2NO2/c8-5-1-4(7(11)10-12)2-6(9)3-5/h1-3,12H,(H,10,11)

InChIKey:

HIJCVQNNEDULLG-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	ONC(=O)c1cc(F)cc(F)c1
OpenEye OEToolkits 2.0.7	c1c(cc(cc1F)F)C(=O)NO
ACDLabs 12.01	Fc1cc(cc(F)c1)C(=O)NO

Name:

3,5-difluoro-N-hydroxybenzamide

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).