CID 102362605

Details

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Internal ID 1807701a-6d05-4f9f-99e9-782bb6176ce4
Taxonomy Organic acids and derivatives > Organic phosphonic acids and derivatives > Organic phosphonic acids
IUPAC Name (2-acetamido-1-hydroxyethyl)phosphonic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C4H10NO5P/c1-3(6)5-2-4(7)11(8,9)10/h4,7H,2H2,1H3,(H,5,6)(H2,8,9,10)
InChI Key KYUPVSSKTOHMCL-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C4H10NO5P
Molecular Weight 183.10 g/mol
Exact Mass 183.02965942 g/mol
Topological Polar Surface Area (TPSA) 107.00 Ų
XlogP -2.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of CID 102362605

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
CHEMBL4040 P28482 MAP kinase ERK2 95.42% 83.82%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.65% 96.09%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 94.54% 97.29%
CHEMBL2581 P07339 Cathepsin D 91.84% 98.95%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 89.84% 85.14%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 85.10% 92.86%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 83.82% 94.33%
CHEMBL3437 Q16853 Amine oxidase, copper containing 81.72% 94.00%

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.
There are no matching plants.

Cross-Links

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PubChem 102362605
LOTUS LTS0073210
wikiData Q104170714