N-[3-[2-(2,4-dibromo-5-methoxyphenyl)ethyl-methylamino]propyl]-4-methyl-2-(methylamino)pentanamide
| Internal ID | a371dbc9-b346-43d4-a8e7-18a58767cea1 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Leucine and derivatives |
| IUPAC Name | N-[3-[2-(2,4-dibromo-5-methoxyphenyl)ethyl-methylamino]propyl]-4-methyl-2-(methylamino)pentanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H33Br2N3O2/c1-14(2)11-18(23-3)20(26)24-8-6-9-25(4)10-7-15-12-19(27-5)17(22)13-16(15)21/h12-14,18,23H,6-11H2,1-5H3,(H,24,26) |
| InChI Key | RAOGBVNYAFRJSR-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C20H33Br2N3O2 |
| Molecular Weight | 507.30 g/mol |
| Exact Mass | 507.09190 g/mol |
| Topological Polar Surface Area (TPSA) | 53.60 Ų |
| XlogP | 4.60 |
| There are no found synonyms. |
![2D Structure of N-[3-[2-(2,4-dibromo-5-methoxyphenyl)ethyl-methylamino]propyl]-4-methyl-2-(methylamino)pentanamide](https://plantaedb.com/storage/docs/compounds/2023/11/n-3-2-24-dibromo-5-methoxyphenylethyl-methylaminopropyl-4-methyl-2-methylaminopentanamide.jpg "2D Structure of N-[3-[2-(2,4-dibromo-5-methoxyphenyl)ethyl-methylamino]propyl]-4-methyl-2-(methylamino)pentanamide")
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 99.58% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 99.46% | 96.09% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 97.12% | 99.17% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.69% | 91.11% |
| CHEMBL2885 | P07451 | Carbonic anhydrase III | 93.44% | 87.45% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 93.21% | 83.82% |
| CHEMBL2179 | P04062 | Beta-glucocerebrosidase | 92.25% | 85.31% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 92.01% | 96.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 90.83% | 90.71% |
| CHEMBL202 | P00374 | Dihydrofolate reductase | 89.98% | 89.92% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 89.65% | 89.62% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 89.53% | 90.20% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 89.27% | 96.95% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 89.01% | 90.00% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 88.54% | 95.89% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 87.32% | 97.21% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 87.15% | 95.56% |
| CHEMBL1744525 | P43490 | Nicotinamide phosphoribosyltransferase | 87.02% | 96.25% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 86.92% | 95.17% |
| CHEMBL2535 | P11166 | Glucose transporter | 86.17% | 98.75% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 83.45% | 100.00% |
| CHEMBL5028 | O14672 | ADAM10 | 83.42% | 97.50% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 83.42% | 91.19% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 82.90% | 86.33% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 81.93% | 94.73% |
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.
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| There are no matching plants. |
| PubChem | 10720385 |
| LOTUS | LTS0201542 |
| wikiData | Q105232760 |