Bioactive Compound Details

BioIDbio198480
NameNone
ChEMBL IDCHEMBL2035310
Molecular FormulaC13H15N3O
Molecular Weight229.28
Molecular Weight (Monoisotopic)229.1215
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-[(1,1-Dimethylethyl)Oxidoimino]Methylquinoxaline
SmilesCC(C)(C)/[N+]([O-])=C/c1cnc2ccccc2n1
InchiInChI=1S/C13H15N3O/c1-13(2,3)16(17)9-10-8-14-11-6-4-5-7-12(11)15-10/h4-9H,1-3H3/b16-9-
Inchi KeyQGUXKOQDVGSPGU-SXGWCWSVSA-N
Molecular SpeciesACID
Targets3.0
Bioactivities4.0
Np Likeness Score-0.86
Records Key['19']
Records Name['2-[(1,1-Dimethylethyl)oxidoimino]methylquinoxaline']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure