NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[(5-methylthiophen-2-yl)methyl]-4-(1H-pyrazol-1-yl)piperidine-4-carboxylic acid
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IUPAC Traditional name
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1-[(5-methylthiophen-2-yl)methyl]-4-(pyrazol-1-yl)piperidine-4-carboxylic acid
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Synonyms
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1-[(5-methyl-2-thienyl)methyl]-4-(1H-pyrazol-1-yl)piperidine-4-carboxylic acid
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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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3.7654605
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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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-0.31884602
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LogD (pH = 7.4)
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-0.31833896
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Log P
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-0.3145169
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Molar Refractivity
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93.0957 cm3
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Polarizability
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31.371227 Å3
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Polar Surface Area
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58.36 Å2
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Rotatable Bonds
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4
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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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2.04
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LOG S
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-5.24
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Polar Surface Area
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58.36 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent