Nitraminoacetic acid

Details

• Internal ID: 8a317cf3-6ba1-4ef9-ac32-e78af11ba649
• Taxonomy: Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives
• IUPAC Name: 2-nitramidoacetic acid
• InChI: InChI=1S/C2H4N2O4/c5-2(6)1-3-4(7)8/h3H,1H2,(H,5,6)
• InChI Key: MJHPFRRMGOFOJL-UHFFFAOYSA-N
• Popularity: 8 references in papers

Physical and Chemical Properties

• Molecular Formula: C₂H₄N₂O₄
• Molecular Weight: 120.06 g/mol
• Exact Mass: 120.01710661 g/mol
• Topological Polar Surface Area (TPSA): 95.20 Ų
• XlogP: 0.10

Synonyms

• 2-(nitroamino)acetic acid
• 10339-31-8
• 2-nitramidoacetic acid
• N-Nitroglycine
• N-Nitroglicin
• GLYCINE, N-NITRO-
• BRN 1812131
• Nitroglycin
• Nitraminoacetate
• SCHEMBL4375056
• DTXSID00145809
• AKOS006375173
• CS-0224555
• EN300-119926
• Z1198158238

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL221	P23219	Cyclooxygenase-1	92.84%	90.17%
CHEMBL4040	P28482	MAP kinase ERK2	90.49%	83.82%
CHEMBL3060	Q9Y345	Glycine transporter 2	87.46%	99.17%
CHEMBL2581	P07339	Cathepsin D	83.96%	98.95%
CHEMBL1255126	O15151	Protein Mdm4	83.26%	90.20%
CHEMBL340	P08684	Cytochrome P450 3A4	80.87%	91.19%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	80.29%	96.09%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 25184
• LOTUS: LTS0068177
• wikiData: Q83010456