Bioactive Compound Details

BioIDbio197698
NameNone
ChEMBL IDCHEMBL104315
Molecular FormulaC8H10ClN5O2
Molecular Weight243.65
Molecular Weight (Monoisotopic)207.0756
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsAmino(2-(4-Nitrobenzylidene)Hydrazinyl)Methaniminium Chloride
SmilesCl.N=C(N)N/N=C/c1ccc([N+](=O)[O-])cc1
InchiInChI=1S/C8H9N5O2.ClH/c9-8(10)12-11-5-6-1-3-7(4-2-6)13(14)15;/h1-5H,(H4,9,10,12);1H/b11-5+;
Inchi KeyXUPFWCWWOMZNMK-HMXKFKBXSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities11.0
Np Likeness Score-1.77
Records Key['14', '19, JR-121', '25']
Records Name['amino[(2E)-2-(4-nitrobenzylidene)hydrazino]methaniminium chloride', 'amino(2-(4-nitrobenzylidene)hydrazinyl)methaniminium chloride', '(E)-2-(4-Nitrobenzylidene)hydrazinecarboximidamide Hydrochloride']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure