NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2S,4R)-4-(dimethylamino)-N-[2-(4-fluorophenyl)ethyl]-2-(hydroxymethyl)pyrrolidine-1-carboxamide
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IUPAC Traditional name
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(2S,4R)-4-(dimethylamino)-N-[2-(4-fluorophenyl)ethyl]-2-(hydroxymethyl)pyrrolidine-1-carboxamide
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Synonyms
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(2S,4R)-4-(dimethylamino)-N-[2-(4-fluorophenyl)ethyl]-2-(hydroxymethyl)pyrrolidine-1-carboxamide
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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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14.568792
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H Acceptors
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3
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H Donor
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2
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LogD (pH = 5.5)
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-2.0740187
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LogD (pH = 7.4)
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-0.3223999
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Log P
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0.79954207
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Molar Refractivity
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83.9649 cm3
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Polarizability
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32.186146 Å3
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Polar Surface Area
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55.81 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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3
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H Donor
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2
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Log P
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1.74
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LOG S
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-2.94
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Polar Surface Area
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55.81 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