2-Methyl-1-prop-1-enylcyclohexa-1,3-diene

Details

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Internal ID a334eb6d-af77-470d-b090-8d8392520b37
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Branched unsaturated hydrocarbons
IUPAC Name 2-methyl-1-prop-1-enylcyclohexa-1,3-diene
SMILES (Canonical) CC=CC1=C(C=CCC1)C
SMILES (Isomeric) CC=CC1=C(C=CCC1)C
InChI InChI=1S/C10H14/c1-3-6-10-8-5-4-7-9(10)2/h3-4,6-7H,5,8H2,1-2H3
InChI Key JYXMWRFAAXNIPT-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C10H14
Molecular Weight 134.22 g/mol
Exact Mass 134.109550447 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 2.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2-Methyl-1-prop-1-enylcyclohexa-1,3-diene

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
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.48% 95.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 86.54% 91.11%
CHEMBL4208 P20618 Proteasome component C5 85.21% 90.00%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 80.13% 93.40%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.00% 86.33%

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.
Thymus martinezii

Cross-Links

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PubChem 123433621
LOTUS LTS0073238
wikiData Q105137252