NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-[(4-acetylpiperazin-1-yl)methyl]-3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one
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IUPAC Traditional name
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2-[(4-acetylpiperazin-1-yl)methyl]-3-hydroxy-6-(hydroxymethyl)pyran-4-one
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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9.170731
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H Acceptors
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6
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H Donor
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2
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LogD (pH = 5.5)
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-1.6291956
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LogD (pH = 7.4)
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-1.5708333
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Log P
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-1.5625589
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Molar Refractivity
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74.6766 cm3
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Polarizability
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27.57184 Å3
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Polar Surface Area
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90.31 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Product Information
Bioassay(PubChem)
Classification
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Derivatives & analogs of Natural Compounds
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Show
data source
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PATENTS
PATENTS
PubChem Patent
Google Patent