Bioactive Compound Details

BioIDbio198654
NameNone
ChEMBL IDCHEMBL391982
Molecular FormulaC8H8ClN3S
Molecular Weight213.69
Molecular Weight (Monoisotopic)213.0127
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(4-Chlorobenzylidene)Hydrazinecarbothioamide
SmilesNC(=S)N/N=C/c1ccc(Cl)cc1
InchiInChI=1S/C8H8ClN3S/c9-7-3-1-6(2-4-7)5-11-12-8(10)13/h1-5H,(H3,10,12,13)/b11-5+
Inchi KeyFABQYDLGFZXBIK-VZUCSPMQSA-N
Molecular SpeciesNEUTRAL
Targets16.0
Bioactivities32.0
Np Likeness Score-2.36
Records Key['4-Cl-btsz', '2e', 'Thio-7', '3c', 'SB8', '16', '2d', '7', 'MMV1534748']
Records Name[1-(4'-chloro benzyl)-thiosemicarbazone", '2-(4-chlorobenzylidene)hydrazinecarbothioamide', '2-(4-chlorobenzylidene)hydrazinecarbothioamide', '(E)-1-(4-chlorobenzylidene)thiosemicarbazide', '(2E)-2-[(4-Chlorophenyl)methylidene]hydrazine-1-carbothioamide', '4-chlorobenzaldehyde thiosemicarbazone', '(E)-2-(4-chlorobenzylidene)hydrazinecarbothioamide', '4-Chlorobenzaldehyde thiosemicarbazone', 'MMV1534748']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure