Bioactive Compound Details

BioIDbio199077
NameNone
ChEMBL IDCHEMBL386049
Molecular FormulaC13H12N2O3S2
Molecular Weight308.38
Molecular Weight (Monoisotopic)308.0289
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms4-(2-Mercaptophenylcarboxamido)Benzenesulfonamide
SmilesNS(=O)(=O)c1ccc(NC(=O)c2ccccc2S)cc1
InchiInChI=1S/C13H12N2O3S2/c14-20(17,18)10-7-5-9(6-8-10)15-13(16)11-3-1-2-4-12(11)19/h1-8,19H,(H,15,16)(H2,14,17,18)
Inchi KeyMRLVIVXGUGNENL-UHFFFAOYSA-N
Molecular SpeciesACID
Targets8.0
Bioactivities17.0
Np Likeness Score-1.89
Records Key['2HD6', '4', '10b', 'H5a']
Records Name['2-mercapto-N-(4-sulfamoylphenyl)benzamide', '2-Mercapto-N-(4-sulfamoyl-phenyl)-benzamide', '2-Mercapto-N-(4-sulfamoyl-phenyl)-benzamide', '4-(2-mercaptophenylcarboxamido)benzenesulfonamide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure