NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxy-4H-chromen-4-one
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IUPAC Traditional name
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Synonyms
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6-Methoxyquercetin
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Quercetagetin 6-methyl ether
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2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxy-4-benzopyrone
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Patuletin
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CAS Number
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PubChem SID
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PubChem CID
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CHEMBL
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Wikipedia Title
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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6.9472156
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H Acceptors
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8
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H Donor
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5
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LogD (pH = 5.5)
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1.9834946
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LogD (pH = 7.4)
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1.3923264
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Log P
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1.9986281
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Molar Refractivity
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83.3254 cm3
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Polarizability
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30.975847 Å3
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Polar Surface Area
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136.68 Å2
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Rotatable Bonds
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2
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
DETAILS
DETAILS
Wikipedia
PATENTS
PATENTS
PubChem Patent
Google Patent