2-(1-Phenylprop-2-enyl)benzene-1,4-diol

Details

• Internal ID: 5879349b-b85d-49e6-9166-3df451f4dd58
• Taxonomy: Benzenoids > Benzene and substituted derivatives > Diphenylmethanes
• IUPAC Name: 2-(1-phenylprop-2-enyl)benzene-1,4-diol
• InChI: InChI=1S/C15H14O2/c1-2-13(11-6-4-3-5-7-11)14-10-12(16)8-9-15(14)17/h2-10,13,16-17H,1H2
• InChI Key: YWLDSNVXQNBZKU-UHFFFAOYSA-N
• Popularity: 0 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₅H₁₄O₂
• Molecular Weight: 226.27 g/mol
• Exact Mass: 226.099379685 g/mol
• Topological Polar Surface Area (TPSA): 40.50 Ų
• XlogP: 3.70

Synonyms

There are no found synonyms.

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	98.26%	91.11%
CHEMBL2035	P08912	Muscarinic acetylcholine receptor M5	96.76%	94.62%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	91.20%	95.56%
CHEMBL1860	P10827	Thyroid hormone receptor alpha	90.29%	99.15%
CHEMBL1821	P08173	Muscarinic acetylcholine receptor M4	89.65%	94.08%
CHEMBL1907594	P30926	Neuronal acetylcholine receptor; alpha3/beta4	87.20%	97.23%
CHEMBL242	Q92731	Estrogen receptor beta	85.55%	98.35%
CHEMBL1293249	Q13887	Kruppel-like factor 5	85.51%	86.33%
CHEMBL2581	P07339	Cathepsin D	84.14%	98.95%
CHEMBL1951	P21397	Monoamine oxidase A	82.34%	91.49%
CHEMBL3902	P09211	Glutathione S-transferase Pi	81.60%	93.81%
CHEMBL3060	Q9Y345	Glycine transporter 2	80.53%	99.17%

Plants that contains it

• Dalbergia sissoo

Cross-Links

• PubChem: 67642141
• LOTUS: LTS0051139
• wikiData: Q105366879