BioLiP

PDB

BioLiP

PDB CCD ID:

KFH

Number of entries in BioLiP:

Chemical formula:

C6 H3 F4 N O2 S

InChI:

InChI=1S/C6H3F4NO2S/c7-2-1-3(8)5(10)6(4(2)9)14(11,12)13/h1H,(H2,11,12,13)

InChIKey:

MYYBXTFMTDFNCM-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1c(c(c(c(c1F)F)S(=O)(=O)N)F)F
CACTVS 3.385	N[S](=O)(=O)c1c(F)c(F)cc(F)c1F

Name:

2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide

ChEMBL:

CHEMBL2333412

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).