(Diaminomethylideneamino) acetate

Details

Top
Internal ID 927c7946-6e27-4afb-bf01-9e917b482b54
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Carboxylic acid derivatives > Carboxylic acid salts > Acetate salts
IUPAC Name (diaminomethylideneamino) acetate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C3H7N3O2/c1-2(7)8-6-3(4)5/h1H3,(H4,4,5,6)
InChI Key HRKLTCXWTZNGPE-UHFFFAOYSA-N
Popularity 570 references in papers

Physical and Chemical Properties

Top
Molecular Formula C3H7N3O2
Molecular Weight 117.11 g/mol
Exact Mass 117.053826475 g/mol
Topological Polar Surface Area (TPSA) 90.70 Ų
XlogP -1.10

Synonyms

Top
(diaminomethylideneamino) acetate
AKOS006360496

2D Structure

Top
2D Structure of (Diaminomethylideneamino) acetate

3D Structure

Top

ADMET Properties (via admetSAR 2)

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

Targets

Top

Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 95.07% 96.09%
CHEMBL3286 P00749 Urokinase-type plasminogen activator 90.43% 97.88%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 83.60% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 82.58% 94.45%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 81.88% 96.95%

Plants that contains it

Top
Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
There are no matching plants.

Cross-Links

Top
PubChem 17905336
LOTUS LTS0238065
wikiData Q105110077