N-(4-hydroxy-3-methoxybenzylidene)-2-(4-hydroxyphenyl)ethanamine

Details

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Internal ID 7186bb03-f21a-4acf-aa18-206ce62bf18e
Taxonomy Benzenoids > Phenols > Methoxyphenols
IUPAC Name 4-[2-(4-hydroxyphenyl)ethyliminomethyl]-2-methoxyphenol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H17NO3/c1-20-16-10-13(4-7-15(16)19)11-17-9-8-12-2-5-14(18)6-3-12/h2-7,10-11,18-19H,8-9H2,1H3
InChI Key VHUINYRVPRWTFR-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C16H17NO3
Molecular Weight 271.31 g/mol
Exact Mass 271.12084340 g/mol
Topological Polar Surface Area (TPSA) 62.10 Ų
XlogP 2.90

Synonyms

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N-(4-hydroxy-3-methoxybenzylidene)-2-(4-hydroxyphenyl)ethanamine

2D Structure

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2D Structure of N-(4-hydroxy-3-methoxybenzylidene)-2-(4-hydroxyphenyl)ethanamine

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 98.82% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 95.78% 96.09%
CHEMBL1293249 Q13887 Kruppel-like factor 5 94.67% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 91.88% 99.17%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 91.37% 94.45%
CHEMBL2535 P11166 Glucose transporter 90.66% 98.75%
CHEMBL1255126 O15151 Protein Mdm4 90.53% 90.20%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.39% 95.56%
CHEMBL3194 P02766 Transthyretin 88.18% 90.71%
CHEMBL242 Q92731 Estrogen receptor beta 87.81% 98.35%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 87.45% 91.71%
CHEMBL4208 P20618 Proteasome component C5 87.15% 90.00%
CHEMBL3492 P49721 Proteasome Macropain subunit 86.36% 90.24%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 84.68% 96.95%
CHEMBL2581 P07339 Cathepsin D 84.10% 98.95%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 83.49% 96.00%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 82.31% 95.50%

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.
Crinum asiaticum

Cross-Links

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PubChem 137185677
LOTUS LTS0155479
wikiData Q105286620