2-(6-Aminocyclohexen-1-yl)acetic acid

Details

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Internal ID 25740f26-394e-48d7-ab4f-4500c868bb80
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Amino acids and derivatives > Amino acids
IUPAC Name 2-(6-aminocyclohexen-1-yl)acetic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C8H13NO2/c9-7-4-2-1-3-6(7)5-8(10)11/h3,7H,1-2,4-5,9H2,(H,10,11)
InChI Key VQAMJDZPHVOGBL-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C8H13NO2
Molecular Weight 155.19 g/mol
Exact Mass 155.094628657 g/mol
Topological Polar Surface Area (TPSA) 63.30 Ų
XlogP -2.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2-(6-Aminocyclohexen-1-yl)acetic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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

Targets

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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 94.66% 96.09%
CHEMBL221 P23219 Cyclooxygenase-1 94.21% 90.17%
CHEMBL3137262 O60341 LSD1/CoREST complex 93.85% 97.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 92.96% 91.11%
CHEMBL2581 P07339 Cathepsin D 88.82% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.24% 95.56%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 129927431
LOTUS LTS0071470
wikiData Q105291144