NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methylpiperidin-1-yl]-3-(1-methyl-1H-pyrazol-4-yl)propan-1-one
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IUPAC Traditional name
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1-[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methylpiperidin-1-yl]-3-(1-methylpyrazol-4-yl)propan-1-one
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Synonyms
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(3R*,4R*)-4-(2-methoxyethyl)-3-methyl-1-[3-(1-methyl-1H-pyrazol-4-yl)propanoyl]piperidin-4-ol
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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14.403968
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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-0.14213502
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LogD (pH = 7.4)
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-0.1420329
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Log P
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-0.14203157
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Molar Refractivity
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96.4248 cm3
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Polarizability
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32.81104 Å3
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Polar Surface Area
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67.59 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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H Acceptors
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4
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H Donor
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1
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Log P
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-0.12
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LOG S
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-2.66
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Polar Surface Area
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67.59 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent