Tambjamine F

Details

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Internal ID 8bf9a245-4c8f-4baf-a56a-61d020e69fba
Taxonomy Organic oxygen compounds > Organooxygen compounds > Ethers > Alkyl aryl ethers
IUPAC Name 1-[3-methoxy-5-(1H-pyrrol-2-yl)-1H-pyrrol-2-yl]-N-(2-phenylethyl)methanimine
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H19N3O/c1-22-18-12-16(15-8-5-10-20-15)21-17(18)13-19-11-9-14-6-3-2-4-7-14/h2-8,10,12-13,20-21H,9,11H2,1H3
InChI Key LZCKYBGQIAFACG-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C18H19N3O
Molecular Weight 293.40 g/mol
Exact Mass 293.152812238 g/mol
Topological Polar Surface Area (TPSA) 53.20 Ų
XlogP 3.00

Synonyms

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NNX3NPN9FX
126584-09-6
Benzeneethanamine, N-[(Z)-[3-methoxy-5-(1H-pyrrol-2-yl)-2H-pyrrol-2-ylidene]methyl]-
N-[(Z)-[3-Methoxy-5-(1H-pyrrol-2-yl)-2H-pyrrol-2-ylidene]methyl]benzeneethanamine

2D Structure

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2D Structure of Tambjamine F

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.40% 96.09%
CHEMBL2581 P07339 Cathepsin D 96.03% 98.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 95.97% 91.11%
CHEMBL1293249 Q13887 Kruppel-like factor 5 93.68% 86.33%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.02% 95.56%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 91.59% 91.71%
CHEMBL1255126 O15151 Protein Mdm4 91.08% 90.20%
CHEMBL2535 P11166 Glucose transporter 90.26% 98.75%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 89.79% 94.62%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.94% 99.17%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 84.48% 94.45%
CHEMBL3192 Q9BY41 Histone deacetylase 8 84.04% 93.99%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 82.84% 96.00%
CHEMBL5939 Q9NZ08 Endoplasmic reticulum aminopeptidase 1 82.23% 100.00%

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 135846995
LOTUS LTS0224996
wikiData Q105159769