5-(3-Methyloxiran-2-yl)-1-benzofuran

Details

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Internal ID 6d90bc92-3e3e-448e-9691-77e77e2a6dce
Taxonomy Organoheterocyclic compounds > Benzofurans
IUPAC Name 5-(3-methyloxiran-2-yl)-1-benzofuran
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C11H10O2/c1-7-11(13-7)9-2-3-10-8(6-9)4-5-12-10/h2-7,11H,1H3
InChI Key QNPBZDDBJFIHAB-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C11H10O2
Molecular Weight 174.20 g/mol
Exact Mass 174.068079557 g/mol
Topological Polar Surface Area (TPSA) 25.70 Ų
XlogP 2.20

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 5-(3-Methyloxiran-2-yl)-1-benzofuran

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
CHEMBL1951 P21397 Monoamine oxidase A 98.72% 91.49%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 89.85% 91.11%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.59% 86.33%
CHEMBL2581 P07339 Cathepsin D 85.82% 98.95%
CHEMBL3401 O75469 Pregnane X receptor 84.96% 94.73%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 83.50% 94.03%
CHEMBL3137262 O60341 LSD1/CoREST complex 81.33% 97.09%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 162952099
LOTUS LTS0128586
wikiData Q105224593