SEQ2FUN

BioLiP

PDB CCD ID: Z79
Number of entries in BioLiP: 2
Chemical formula: C9 H12 N2 O5 S
InChI: InChI=1S/C9H12N2O5S/c1-16-7-2-4-8(5-3-7)17(14,15)10-6-9(12)11-13/h2-5,10,13H,6H2,1H3,(H,11,12)
InChIKey: WLZISXXOYYGJNT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.352COc1ccc(cc1)[S](=O)(=O)NCC(=O)NO
OpenEye OEToolkits 1.7.0COc1ccc(cc1)S(=O)(=O)NCC(=O)NO
Name:N-hydroxy-N~2~-[(4-methoxyphenyl)sulfonyl]glycinamide
ChEMBL: CHEMBL83508
ZINC: ZINC000010450351
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).