6-Methyl-[1]benzofuro[2,3-b]quinolin-11-one

Details

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Internal ID 478606de-de6d-4418-8bab-454ac0cebb9b
Taxonomy Organoheterocyclic compounds > Quinolines and derivatives > Furanoquinolines
IUPAC Name 6-methyl-[1]benzofuro[2,3-b]quinolin-11-one
SMILES (Canonical) CN1C2=CC=CC=C2C(=O)C3=C1OC4=CC=CC=C43
SMILES (Isomeric) CN1C2=CC=CC=C2C(=O)C3=C1OC4=CC=CC=C43
InChI InChI=1S/C16H11NO2/c1-17-12-8-4-2-6-10(12)15(18)14-11-7-3-5-9-13(11)19-16(14)17/h2-9H,1H3
InChI Key SUNXSUVIYFWRHI-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C16H11NO2
Molecular Weight 249.26 g/mol
Exact Mass 249.078978594 g/mol
Topological Polar Surface Area (TPSA) 33.40 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 6-Methyl-[1]benzofuro[2,3-b]quinolin-11-one

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
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 97.68% 95.56%
CHEMBL2581 P07339 Cathepsin D 95.73% 98.95%
CHEMBL1806 P11388 DNA topoisomerase II alpha 92.66% 89.00%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 92.61% 93.65%
CHEMBL3401 O75469 Pregnane X receptor 91.56% 94.73%
CHEMBL3192 Q9BY41 Histone deacetylase 8 90.99% 93.99%
CHEMBL1899 P46098 Serotonin 3a (5-HT3a) receptor 89.34% 100.00%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 89.00% 99.23%
CHEMBL262 P49841 Glycogen synthase kinase-3 beta 86.80% 95.72%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 85.68% 85.14%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 84.24% 94.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 83.39% 86.33%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 83.18% 85.94%
CHEMBL2378 P30307 Dual specificity phosphatase Cdc25C 81.71% 96.67%

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.
Raputiarana heptaphylla

Cross-Links

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PubChem 12621905
LOTUS LTS0085552
wikiData Q105261159