BioLiP

PDB

BioLiP

PDB CCD ID:

L8N

Number of entries in BioLiP:

Chemical formula:

C12 H12 N O5 P S

InChI:

InChI=1S/C12H12NO5PS/c13-20(16,17)12-8-6-10(7-9-12)18-19(14,15)11-4-2-1-3-5-11/h1-9H,(H,14,15)(H2,13,16,17)

InChIKey:

HADGOFIYAKWMTA-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc(cc1)P(=O)(O)Oc2ccc(cc2)S(=O)(=O)N
CACTVS 3.385	N[S](=O)(=O)c1ccc(O[P](O)(=O)c2ccccc2)cc1

Name:

phenyl-(4-sulfamoylphenoxy)phosphinic acid

ChEMBL:

CHEMBL4474178

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).