2-(7,8-Dimethoxy-4-methyldibenzofuran-1-yl)-5-methylphenol

Details

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Internal ID c2bdd120-9a69-42fa-bedd-2a36c34a1261
Taxonomy Organoheterocyclic compounds > Benzofurans > Phenylbenzofurans
IUPAC Name 2-(7,8-dimethoxy-4-methyldibenzofuran-1-yl)-5-methylphenol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C22H20O4/c1-12-5-7-14(17(23)9-12)15-8-6-13(2)22-21(15)16-10-19(24-3)20(25-4)11-18(16)26-22/h5-11,23H,1-4H3
InChI Key GFPWLVMNIMBPFW-UHFFFAOYSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C22H20O4
Molecular Weight 348.40 g/mol
Exact Mass 348.13615911 g/mol
Topological Polar Surface Area (TPSA) 51.80 Ų
XlogP 5.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2-(7,8-Dimethoxy-4-methyldibenzofuran-1-yl)-5-methylphenol

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 98.49% 91.11%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 94.62% 89.62%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 94.10% 94.00%
CHEMBL1913 P09619 Platelet-derived growth factor receptor beta 92.44% 95.70%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.11% 95.56%
CHEMBL241 Q14432 Phosphodiesterase 3A 90.90% 92.94%
CHEMBL2581 P07339 Cathepsin D 90.88% 98.95%
CHEMBL1806 P11388 DNA topoisomerase II alpha 90.28% 89.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.86% 86.33%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 88.67% 96.21%
CHEMBL1951 P21397 Monoamine oxidase A 88.26% 91.49%
CHEMBL2535 P11166 Glucose transporter 85.94% 98.75%
CHEMBL3194 P02766 Transthyretin 85.68% 90.71%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 85.13% 96.95%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 84.67% 96.00%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 84.46% 91.79%
CHEMBL4581 P52732 Kinesin-like protein 1 83.50% 93.18%
CHEMBL3401 O75469 Pregnane X receptor 83.32% 94.73%
CHEMBL5966 P55899 IgG receptor FcRn large subunit p51 81.48% 90.93%
CHEMBL3492 P49721 Proteasome Macropain subunit 81.11% 90.24%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.62% 99.17%
CHEMBL1868 P17948 Vascular endothelial growth factor receptor 1 80.44% 96.47%

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.
Calea prunifolia

Cross-Links

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PubChem 162866309
LOTUS LTS0057071
wikiData Q105007709