4-(1-Hydroxyethyl)cyclohexan-1-ol

Details

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Internal ID 1a62ff4f-de5a-4106-a028-5d2e93f78025
Taxonomy Organic oxygen compounds > Organooxygen compounds > Alcohols and polyols > Secondary alcohols > Cyclohexanols
IUPAC Name 4-(1-hydroxyethyl)cyclohexan-1-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C8H16O2/c1-6(9)7-2-4-8(10)5-3-7/h6-10H,2-5H2,1H3
InChI Key QJLYVCMEBJYLQD-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C8H16O2
Molecular Weight 144.21 g/mol
Exact Mass 144.115029749 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 0.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 4-(1-Hydroxyethyl)cyclohexan-1-ol

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
CHEMBL4040 P28482 MAP kinase ERK2 95.84% 83.82%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.39% 96.09%
CHEMBL226 P30542 Adenosine A1 receptor 88.08% 95.93%
CHEMBL253 P34972 Cannabinoid CB2 receptor 84.15% 97.25%
CHEMBL2581 P07339 Cathepsin D 83.63% 98.95%
CHEMBL5203 P33316 dUTP pyrophosphatase 81.99% 99.18%
CHEMBL4685 P14902 Indoleamine 2,3-dioxygenase 81.06% 96.38%
CHEMBL3137262 O60341 LSD1/CoREST complex 80.72% 97.09%

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 22245678
LOTUS LTS0098385
wikiData Q105222753