Streptopyrazinone B

Details

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Internal ID e2dd23fc-84cd-43d0-8baa-8034d7bc2216
Taxonomy Organoheterocyclic compounds > Diazines > Pyrazines
IUPAC Name N-[4-[5-(2-methylpropyl)-6-oxo-1H-pyrazin-2-yl]butyl]acetamide
SMILES (Canonical) CC(C)CC1=NC=C(NC1=O)CCCCNC(=O)C
SMILES (Isomeric) CC(C)CC1=NC=C(NC1=O)CCCCNC(=O)C
InChI InChI=1S/C14H23N3O2/c1-10(2)8-13-14(19)17-12(9-16-13)6-4-5-7-15-11(3)18/h9-10H,4-8H2,1-3H3,(H,15,18)(H,17,19)
InChI Key PLJRJPNBIDCWND-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C14H23N3O2
Molecular Weight 265.35 g/mol
Exact Mass 265.17902698 g/mol
Topological Polar Surface Area (TPSA) 70.60 Ų
XlogP 0.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Streptopyrazinone B

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 97.34% 98.95%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 97.30% 85.14%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.07% 96.09%
CHEMBL4040 P28482 MAP kinase ERK2 95.27% 83.82%
CHEMBL255 P29275 Adenosine A2b receptor 94.21% 98.59%
CHEMBL1937 Q92769 Histone deacetylase 2 93.98% 94.75%
CHEMBL3401 O75469 Pregnane X receptor 93.75% 94.73%
CHEMBL2535 P11166 Glucose transporter 93.35% 98.75%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 92.51% 89.34%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 90.90% 91.11%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 89.87% 90.71%
CHEMBL3060 Q9Y345 Glycine transporter 2 89.48% 99.17%
CHEMBL1293277 O15118 Niemann-Pick C1 protein 84.60% 81.11%
CHEMBL5163 Q9NY46 Sodium channel protein type III alpha subunit 83.77% 96.90%
CHEMBL4296013 Q5VWK5 Interleukin-23 receptor 83.61% 88.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 83.49% 94.00%
CHEMBL3437 Q16853 Amine oxidase, copper containing 83.31% 94.00%
CHEMBL4208 P20618 Proteasome component C5 83.26% 90.00%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 82.41% 95.50%
CHEMBL3976 Q9UHL4 Dipeptidyl peptidase II 82.05% 92.29%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 81.36% 97.21%
CHEMBL5103 Q969S8 Histone deacetylase 10 80.78% 90.08%

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.
There are no matching plants.

Cross-Links

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PubChem 139590253
LOTUS LTS0214638
wikiData Q104194970