Bioactive Compound Details

BioIDbio199629
NameTHIOSALICYLIC ACID
ChEMBL IDCHEMBL119888
Molecular FormulaC7H6O2S
Molecular Weight154.19
Molecular Weight (Monoisotopic)154.0089
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Mercapto-Benzoic Acid
SmilesO=C(O)c1ccccc1S
InchiInChI=1S/C7H6O2S/c8-7(9)5-3-1-2-4-6(5)10/h1-4,10H,(H,8,9)
Inchi KeyNBOMNTLFRHMDEZ-UHFFFAOYSA-N
Molecular SpeciesACID
Targets15.0
Bioactivities40.0
Np Likeness Score-0.74
Records Key['14 (table III)', 'SID855771', 'SID144207109', '52', 'o-mercapto-benzoic-acid', '7', 'Thiosalicylic acid', 'AZ2', 'SID170465571', 'O-MERCAPTO-BENZOIC-ACID', 'o-mercapto-benzoic-acid', 'HA-16', 'Thiosalicylic acid', 'COVC-1214901512', 'o-mercapto-benzoic-acid']
Records Name['2-Mercapto-benzoic acid', 'SID855771', 'SID144207109', '2-mercaptobenzoic acid', 'o-mercapto-benzoic-acid', '2-mercaptobenzoic acid', 'Thiosalicylic acid', '2-mercaptobenzoic acid', 'SID170465571', 'O-MERCAPTO-BENZOIC-ACID', 'o-mercapto-benzoic-acid', '2-sulfanylbenzoic acid', 'Thiosalicylic acid', 'THIMEROSAL', 'o-mercapto-benzoic-acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure