1,5-Dihydroxynaphthalene

Details

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Internal ID 1b1bc604-dbb7-470b-b6c3-4d9beaffc836
Taxonomy Benzenoids > Naphthalenes > Naphthols and derivatives
IUPAC Name naphthalene-1,5-diol
SMILES (Canonical) C1=CC2=C(C=CC=C2O)C(=C1)O
SMILES (Isomeric) C1=CC2=C(C=CC=C2O)C(=C1)O
InChI InChI=1S/C10H8O2/c11-9-5-1-3-7-8(9)4-2-6-10(7)12/h1-6,11-12H
InChI Key BOKGTLAJQHTOKE-UHFFFAOYSA-N
Popularity 305 references in papers

Physical and Chemical Properties

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Molecular Formula C10H8O2
Molecular Weight 160.17 g/mol
Exact Mass 160.052429494 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 1.80

Synonyms

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naphthalene-1,5-diol
83-56-7
1,5-Naphthalenediol
1,5-Dihydroxy naphthalene
Durafur Developer E
Oxidation Base
1,5-Dihydroxynapthalene
CI 76625
C.I. 76625
1,5-dihydroxynaphtalene
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 1,5-Dihydroxynaphthalene

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
CHEMBL1951 P21397 Monoamine oxidase A 95.97% 91.49%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.38% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.63% 95.56%
CHEMBL3192 Q9BY41 Histone deacetylase 8 84.35% 93.99%
CHEMBL3401 O75469 Pregnane X receptor 82.74% 94.73%

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.
Sanicula lamelligera

Cross-Links

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PubChem 6749
LOTUS LTS0129676
wikiData Q19842073