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BioLiP

PDB CCD ID: WMO
Number of entries in BioLiP: 2
Chemical formula: C10 H14 N2 O4 S
InChI: InChI=1S/C10H14N2O4S/c1-16-7-6-12-10(13)8-2-4-9(5-3-8)17(11,14)15/h2-5H,6-7H2,1H3,(H,12,13)(H2,11,14,15)
InChIKey: SZLZBDNEVKHWNT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7COCCNC(=O)c1ccc(cc1)S(=O)(=O)N
CACTVS 3.385COCCNC(=O)c1ccc(cc1)[S](N)(=O)=O
ACDLabs 12.01O=S(N)(=O)c1ccc(cc1)C(=O)NCCOC
Name:N-(2-methoxyethyl)-4-sulfamoylbenzamide
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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