[(ammonioacetyl)amino]acetate
C₄H₈N₂O₃·132.120 g/mol·CID 1548897
IUPAC: 2-[(2-azaniumylacetyl)amino]acetate
Also known as: glycylglycine zwitterion, 2vl1, [(azaniumylacetyl)amino]acetate, CHEBI:356445, BDBM50137044
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
132.120g/mol
Exact Mass
132.053492Da
Monoisotopic Mass
132.053492Da
XLogP
-2.3
Polar Surface Area
96.9Ų
Complexity
117
Formal Charge
0
H-Bond Donors
2
H-Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
9
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 132.1 g/mol
MW ≤ 500
✓ -2.3
LogP ≤ 5
✓ 2
H-bond donors ≤ 5
✓ 3
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
Isomers8 compounds with formula C₄H₈N₂O₃
(2S)-2,4-diamino-4-oxobutanoic acid
CID 6267 · 132.1 g/mol
(Z)-acetyloxymethylimino-methyl-oxidoazanium
CID 5363199 · 132.1 g/mol
2-[(2-aminoacetyl)amino]acetic acid
CID 11163 · 132.1 g/mol
3-(carbamoylamino)propanoic acid
CID 111 · 132.1 g/mol
ethyl N-methyl-N-nitrosocarbamate
CID 12001 · 132.1 g/mol
[methyl(nitroso)amino]methyl acetate
CID 42016 · 132.1 g/mol
(2R)-2,4-diamino-4-oxobutanoic acid
CID 439600 · 132.1 g/mol
2,4-diamino-4-oxobutanoic acid
CID 236 · 132.1 g/mol