NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-{4-[4-(2-aminopropan-2-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-3-cyclohexylpropan-1-one
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IUPAC Traditional name
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1-{4-[4-(2-aminopropan-2-yl)-1,2,3-triazol-1-yl]piperidin-1-yl}-3-cyclohexylpropan-1-one
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Synonyms
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(1-{1-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-1H-1,2,3-triazol-4-yl}-1-methylethyl)amine
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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)
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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-0.58937883
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LogD (pH = 7.4)
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0.89037555
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Log P
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2.2293732
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Molar Refractivity
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110.5774 cm3
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Polarizability
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38.839394 Å3
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Polar Surface Area
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77.04 Å2
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Rotatable Bonds
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5
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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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0.97
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LOG S
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-2.56
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Polar Surface Area
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77.04 Å2
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Rotatable Bonds
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5
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent