Bioactive Compound Details

BioIDbio199170
NameNone
ChEMBL IDCHEMBL299420
Molecular FormulaC6H12N2O3
Molecular Weight160.17
Molecular Weight (Monoisotopic)160.0848
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-[(2-Ammoniopropanoyl)Amino]Propanoate
SmilesC[C@@H](N)C(=O)N[C@H](C)C(=O)O
InchiInChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4-/m1/s1
Inchi KeyDEFJQIDDEAULHB-QWWZWVQMSA-N
Molecular SpeciesACID
Targets3.0
Bioactivities5.0
Np Likeness Score-0.15
Records Key['79', 'D-alanyl-D-alanine', '75', 'HMDB03459']
Records Name['2-[(2-ammoniopropanoyl)amino]propanoate', 'D-Alanyl-D-Alanine', '(R)-2-((R)-2-Amino-propionylamino)-propionic acid', 'D-Alanyl-d-alanine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure