(2S)-2-ammonio-4-(methylselanyl)butanoate

Details

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Internal ID 52ef969f-0260-4119-acca-94f8716195c7
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acids > L-alpha-amino acids
IUPAC Name (2S)-2-azaniumyl-4-methylselanylbutanoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C5H11NO2Se/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
InChI Key RJFAYQIBOAGBLC-BYPYZUCNSA-N
Popularity 27 references in papers

Physical and Chemical Properties

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Molecular Formula C5H11NO2Se
Molecular Weight 196.12 g/mol
Exact Mass 196.99550 g/mol
Topological Polar Surface Area (TPSA) 67.80 Ų
XlogP 0.00

Synonyms

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L-selenomethionine zwitterion
CHEBI:62621
(2S)-2-ammonio-4-(methylselanyl)butanoate
(2S)-2-azaniumyl-4-(methylselanyl)butanoate

2D Structure

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2D Structure of (2S)-2-ammonio-4-(methylselanyl)butanoate

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 93.40% 96.09%
CHEMBL2581 P07339 Cathepsin D 89.52% 98.95%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 82.42% 100.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.68% 99.17%

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 53262363
NPASS NPC291186
ChEMBL CHEMBL113178