Cyclo(D-Tyr-L-Leu)

Details

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Internal ID 961f57bf-fa69-4e24-96e9-a064d02e17b1
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives
IUPAC Name (3R,6S)-3-[(4-hydroxyphenyl)methyl]-6-(2-methylpropyl)piperazine-2,5-dione
SMILES (Canonical) CC(C)CC1C(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O
SMILES (Isomeric) CC(C)C[C@H]1C(=O)N[C@@H](C(=O)N1)CC2=CC=C(C=C2)O
InChI InChI=1S/C15H20N2O3/c1-9(2)7-12-14(19)17-13(15(20)16-12)8-10-3-5-11(18)6-4-10/h3-6,9,12-13,18H,7-8H2,1-2H3,(H,16,20)(H,17,19)/t12-,13+/m0/s1
InChI Key GENSLUDVKWKQMX-QWHCGFSZSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H20N2O3
Molecular Weight 276.33 g/mol
Exact Mass 276.14739250 g/mol
Topological Polar Surface Area (TPSA) 78.40 Ų
XlogP 2.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Cyclo(D-Tyr-L-Leu)

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
CHEMBL2581 P07339 Cathepsin D 98.78% 98.95%
CHEMBL4040 P28482 MAP kinase ERK2 96.12% 83.82%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 95.35% 94.45%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.31% 96.09%
CHEMBL5966 P55899 IgG receptor FcRn large subunit p51 92.57% 90.93%
CHEMBL5103 Q969S8 Histone deacetylase 10 90.58% 90.08%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 90.24% 91.11%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 88.39% 97.23%
CHEMBL2563 Q9UQL6 Histone deacetylase 5 88.27% 89.67%
CHEMBL1937 Q92769 Histone deacetylase 2 88.18% 94.75%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.79% 95.56%
CHEMBL253 P34972 Cannabinoid CB2 receptor 86.55% 97.25%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 85.31% 95.89%
CHEMBL3830 Q2M2I8 Adaptor-associated kinase 85.08% 83.10%
CHEMBL5852 Q96P65 Pyroglutamylated RFamide peptide receptor 84.61% 85.00%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 82.11% 90.71%
CHEMBL3401 O75469 Pregnane X receptor 80.28% 94.73%

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 124350923
LOTUS LTS0086163
wikiData Q77564463