Bioactive Compound Details

BioIDbio199824
NameNone
ChEMBL IDCHEMBL2338296
Molecular FormulaC13H13N3OS
Molecular Weight259.33
Molecular Weight (Monoisotopic)259.0779
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Benzylsulfanyl-Nicotinic Acid Hydrazide
SmilesNNC(=O)c1cccnc1SCc1ccccc1
InchiInChI=1S/C13H13N3OS/c14-16-12(17)11-7-4-8-15-13(11)18-9-10-5-2-1-3-6-10/h1-8H,9,14H2,(H,16,17)
Inchi KeyPCXHZMKTQZIFRJ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets8.0
Bioactivities9.0
Np Likeness Score-1.9
Records Key['4']
Records Name['2-Benzylsulfanyl-nicotinic acid hydrazide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure