Bioactive Compound Details

BioIDbio198858
NameNone
ChEMBL IDCHEMBL143309
Molecular FormulaC5H9NO3
Molecular Weight131.13
Molecular Weight (Monoisotopic)131.0582
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Acetylamino-Propionic Acid|Acetyl-D-Alanine
SmilesCC(=O)N[C@H](C)C(=O)O
InchiInChI=1S/C5H9NO3/c1-3(5(8)9)6-4(2)7/h3H,1-2H3,(H,6,7)(H,8,9)/t3-/m1/s1
Inchi KeyKTHDTJVBEPMMGL-GSVOUGTGSA-N
Molecular SpeciesACID
Targets3.0
Bioactivities5.0
Np Likeness Score-0.2
Records Key['N-acetyl-D-alanine', '7', '51']
Records Name['(R)-2-Acetylamino-propionic acid', '2-Acetylamino-propionic acid', 'Acetyl-D-alanine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure