NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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5-[({[1-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl}(methyl)amino)methyl]pyrimidin-2-amine
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IUPAC Traditional name
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5-[({[1-(4-fluorophenyl)pyrazol-4-yl]methyl}(methyl)amino)methyl]pyrimidin-2-amine
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Synonyms
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5-{[{[1-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl}(methyl)amino]methyl}pyrimidin-2-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)
Acid pKa
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16.580513
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H Acceptors
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5
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H Donor
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1
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LogD (pH = 5.5)
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0.27437884
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LogD (pH = 7.4)
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1.6454012
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Log P
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1.7939858
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Molar Refractivity
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89.1021 cm3
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Polarizability
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33.046726 Å3
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Polar Surface Area
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72.86 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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1.68
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LOG S
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-1.9
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Polar Surface Area
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72.86 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