1,7-Dibromo-2,6,8-trichloro-3,7-dimethyloct-3-ene

Details

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Internal ID cc1b814b-542b-4517-aec7-9a6d98c384cd
Taxonomy Organohalogen compounds > Organochlorides
IUPAC Name 1,7-dibromo-2,6,8-trichloro-3,7-dimethyloct-3-ene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C10H15Br2Cl3/c1-7(8(14)5-11)3-4-9(15)10(2,12)6-13/h3,8-9H,4-6H2,1-2H3
InChI Key HHJBRGGJADRQIH-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C10H15Br2Cl3
Molecular Weight 401.40 g/mol
Exact Mass 399.85856 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 5.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 1,7-Dibromo-2,6,8-trichloro-3,7-dimethyloct-3-ene

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
CHEMBL3401 O75469 Pregnane X receptor 91.46% 94.73%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 90.00% 91.11%
CHEMBL2581 P07339 Cathepsin D 87.09% 98.95%
CHEMBL253 P34972 Cannabinoid CB2 receptor 86.77% 97.25%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.75% 96.09%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 81.76% 89.34%

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 74052094
LOTUS LTS0145666
wikiData Q105028314