NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-{4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]phenyl}acetic acid
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IUPAC Traditional name
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{4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]phenyl}acetic acid
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Synonyms
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[4-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)phenyl]acetic 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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3.7206717
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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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1.3195297
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LogD (pH = 7.4)
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-0.2103855
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Log P
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2.0542068
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Molar Refractivity
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85.3012 cm3
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Polarizability
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33.215633 Å3
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Polar Surface Area
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66.32 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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3.16
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LOG S
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-3.67
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Polar Surface Area
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66.32 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