NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid
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IUPAC Traditional name
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3-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid
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Synonyms
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CAS Number
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EC Number
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MDL Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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4.2333956
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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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0.24976474
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LogD (pH = 7.4)
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-1.4735848
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Log P
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1.5368972
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Molar Refractivity
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68.9956 cm3
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Polarizability
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26.95329 Å3
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Polar Surface Area
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69.64 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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PROPERTIES
PROPERTIES
Safety Information
Bioassay(PubChem)
RTECS
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NI9570000
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Show
data source
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German water hazard class
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2
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Show
data source
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PATENTS
PATENTS
PubChem Patent
Google Patent