Methylselenic acid

Details

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Internal ID f4c6f9ef-a88d-42db-bf22-70250979918d
Taxonomy Organic acids and derivatives > Seleninic acids and derivatives
IUPAC Name methaneseleninic acid
SMILES (Canonical) C[Se](=O)O
SMILES (Isomeric) C[Se](=O)O
InChI InChI=1S/CH4O2Se/c1-4(2)3/h1H3,(H,2,3)
InChI Key UEQANLFPOFICBH-UHFFFAOYSA-N
Popularity 297 references in papers

Physical and Chemical Properties

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Molecular Formula CH4O2Se
Molecular Weight 127.01 g/mol
Exact Mass 127.93765 g/mol
Topological Polar Surface Area (TPSA) 37.30 Ų
XlogP 0.00

Synonyms

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Methylselenic acid
Methylseleninic acid
28274-57-9
methylseleninate
CHEBI:77012
UNII-9900C6V162
9900C6V162
Methaneseleninic acid(6CI,8CI,9CI)
Methyl seleninic acid
NSC-243621
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Methylselenic 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 81.90% 96.09%

Plants that contains it

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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.
Allium sativum

Cross-Links

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PubChem 161597
NPASS NPC74400
ChEMBL CHEMBL399906