BioLiP

PDB

BioLiP

PDB CCD ID:

QAU

Number of entries in BioLiP:

Chemical formula:

C6 H7 N O3 S

InChI:

InChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-2-5(8)4-6/h1-4,8H,(H2,7,9,10)

InChIKey:

OQPPWRYNXRWUAQ-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 3.1.0.0	c1cc(cc(c1)S(=O)(=O)N)O
CACTVS 3.385	N[S](=O)(=O)c1cccc(O)c1

Name:

3-oxidanylbenzenesulfonamide

ZINC:

ZINC000032296855

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).