Bioactive Compound Details

BioIDbio198613
NameNone
ChEMBL IDCHEMBL1096480
Molecular FormulaC10H13N3S
Molecular Weight207.3
Molecular Weight (Monoisotopic)207.083
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(4-Ethylbenzylidene)Hydrazinecarbothioamide
SmilesCCc1ccc(/C=N/NC(N)=S)cc1
InchiInChI=1S/C10H13N3S/c1-2-8-3-5-9(6-4-8)7-12-13-10(11)14/h3-7H,2H2,1H3,(H3,11,13,14)/b12-7+
Inchi KeyGHYBFTMRZWJKKV-KPKJPENVSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities12.0
Np Likeness Score-2.02
Records Key['1t', '2c', 'SB6']
Records Name['(E)-2-(4-ethylbenzylidene)hydrazinecarbothioamide', '2-(4-ethylbenzylidene)hydrazinecarbothioamide', '(2E)-2-[(4-Ethylphenyl)methylidene]hydrazine-1-carbothioamide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure