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BioLiP

PDB CCD ID: EZL
Number of entries in BioLiP: 18
Chemical formula: C9 H10 N2 O3 S2
InChI: InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13)
InChIKey: OUZWUKMCLIBBOG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341CCOc1ccc2nc(sc2c1)[S](N)(=O)=O
ACDLabs 10.04O=S(=O)(c1nc2ccc(OCC)cc2s1)N
OpenEye OEToolkits 1.5.0CCOc1ccc2c(c1)sc(n2)S(=O)(=O)N
Name:6-ethoxy-1,3-benzothiazole-2-sulfonamide;
Ethoxzolamide
ChEMBL: CHEMBL18
DrugBank: DB00311
ZINC: ZINC000000056721
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).
  • 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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