5-Methoxy-2-propylchromone

Details

• Internal ID: 1681f224-94b1-40b1-b0ea-956faec29b82
• Taxonomy: Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Chromones
• IUPAC Name: 5-methoxy-2-propylchromen-4-one
• InChI: InChI=1S/C13H14O3/c1-3-5-9-8-10(14)13-11(15-2)6-4-7-12(13)16-9/h4,6-8H,3,5H2,1-2H3
• InChI Key: NXPKLVRCZBVUOI-UHFFFAOYSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₃H₁₄O₃
• Molecular Weight: 218.25 g/mol
• Exact Mass: 218.094294304 g/mol
• Topological Polar Surface Area (TPSA): 35.50 Ų
• XlogP: 3.00

Synonyms

• CHEMBL4452189

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
CHEMBL1293249	Q13887	Kruppel-like factor 5	96.82%	86.33%
CHEMBL2581	P07339	Cathepsin D	95.89%	98.95%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	92.87%	91.11%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	91.82%	95.56%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	90.04%	94.00%
CHEMBL4306	P22460	Voltage-gated potassium channel subunit Kv1.5	89.86%	94.03%
CHEMBL2535	P11166	Glucose transporter	89.47%	98.75%
CHEMBL1907	P15144	Aminopeptidase N	87.45%	93.31%
CHEMBL3401	O75469	Pregnane X receptor	85.12%	94.73%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	84.46%	96.00%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	83.03%	96.09%
CHEMBL1806	P11388	DNA topoisomerase II alpha	82.75%	89.00%
CHEMBL3192	Q9BY41	Histone deacetylase 8	81.31%	93.99%
CHEMBL3060	Q9Y345	Glycine transporter 2	80.80%	99.17%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 145721058
• LOTUS: LTS0080869
• wikiData: Q104180128