NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-(2-{1-ethyl-1H,4H-pyrazolo[3,4-d]imidazol-5-yl}-4-fluorophenyl)-1H-pyrazole
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IUPAC Traditional name
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1-(2-{1-ethyl-4H-pyrazolo[3,4-d]imidazol-5-yl}-4-fluorophenyl)pyrazole
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Synonyms
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1-ethyl-5-[5-fluoro-2-(1H-pyrazol-1-yl)phenyl]-1,4-dihydroimidazo[4,5-c]pyrazole
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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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9.048939
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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2.290919
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LogD (pH = 7.4)
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2.2998047
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Log P
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2.3084755
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Molar Refractivity
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102.5023 cm3
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Polarizability
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31.38782 Å3
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Polar Surface Area
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64.32 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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H Acceptors
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3
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H Donor
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1
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Log P
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3.49
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LOG S
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-4.34
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Polar Surface Area
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64.32 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