Bioactive Compound Details

BioIDbio200125
NameNone
ChEMBL IDCHEMBL242113
Molecular FormulaC8H9N3OS
Molecular Weight195.25
Molecular Weight (Monoisotopic)195.0466
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(4-Hydroxybenzylidene)Hydrazinecarbothioamide
SmilesNC(=S)N/N=C/c1ccc(O)cc1
InchiInChI=1S/C8H9N3OS/c9-8(13)11-10-5-6-1-3-7(12)4-2-6/h1-5,12H,(H3,9,11,13)/b10-5+
Inchi KeyIKDRFCOUGSBGNI-BJMVGYQFSA-N
Molecular SpeciesNEUTRAL
Targets27.0
Bioactivities46.0
Np Likeness Score-1.44
Records Key['4', 'N4', '2g', '3o', 'Thio-1', 'SB2', '4', 'A15']
Records Name['4-Hydroxybenzaldehyde thiosemicarbazone', '(E)-1-(4-hydroxybenzylidene)thiosemicarbazide', '2-(4-hydroxybenzylidene)hydrazinecarbothioamide', '(E)-2-(4-hydroxybenzylidene)hydrazinecarbothioamide', 'p-hydroxybenzaldehyde-thiosemicarbazone', '(2E)-2-[(4-Hydroxyphenyl)methylidene]hydrazine-1-carbothioamide', '2-(4-hydroxybenzylidene)hydrazinecarbothioamide', '(E)-2-(4-hydroxybenzylidene)hydrazinecarbothioamide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure