Aminozooanemonin

Details

Top
Internal ID c38e1af7-d49d-4c3c-8b9d-f145c5196ebc
Taxonomy Organoheterocyclic compounds > Azoles > Imidazoles > Trisubstituted imidazoles > 1,2,5-trisubstituted imidazoles
IUPAC Name 2-(2-amino-1,3-dimethylimidazol-1-ium-4-yl)acetate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C7H11N3O2/c1-9-4-5(3-6(11)12)10(2)7(9)8/h4,8H,3H2,1-2H3,(H,11,12)
InChI Key UZHLDXPPXNMSFH-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

Top
Molecular Formula C7H11N3O2
Molecular Weight 169.18 g/mol
Exact Mass 169.085126602 g/mol
Topological Polar Surface Area (TPSA) 75.00 Ų
XlogP -0.10

Synonyms

Top
CHEMBL442935

2D Structure

Top
2D Structure of Aminozooanemonin

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 97.89% 96.09%
CHEMBL4040 P28482 MAP kinase ERK2 96.11% 83.82%
CHEMBL2581 P07339 Cathepsin D 93.90% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.70% 95.56%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 82.77% 94.45%

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 10080783
LOTUS LTS0129738
wikiData Q105282207