Bioactive Compound Details

BioIDbio200340
NameNone
ChEMBL IDCHEMBL260501
Molecular FormulaC10H11N3O6
Molecular Weight269.21
Molecular Weight (Monoisotopic)269.0648
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(2,4-Dinitrophenylamino)Butanoic Acid
SmilesCCC(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O
InchiInChI=1S/C10H11N3O6/c1-2-7(10(14)15)11-8-4-3-6(12(16)17)5-9(8)13(18)19/h3-5,7,11H,2H2,1H3,(H,14,15)
Inchi KeyMPWLEWUMPDWNFL-UHFFFAOYSA-N
Molecular SpeciesACID
Targets1.0
Bioactivities1.0
Np Likeness Score-1.18
Records Key['5114733']
Records Name['2-(2,4-dinitrophenylamino)butanoic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure