NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2S)-2-(2-methylpropanamido)-3-sulfanylpropanoic acid
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IUPAC Traditional name
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(2S)-2-(2-methylpropanamido)-3-sulfanylpropanoic acid
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Synonyms
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N-(2-Methylpropionyl)-D-cysteine
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N-Isobutyryl-D-cysteine
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N-异丁酰-D-半胱氨酸
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N-异丁酰基-D-巯基丙氨酸
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CAS 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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4.0261164
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H Acceptors
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3
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H Donor
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3
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LogD (pH = 5.5)
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-0.95222986
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LogD (pH = 7.4)
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-2.6125834
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Log P
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0.5322094
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Molar Refractivity
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46.8688 cm3
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Polarizability
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18.482368 Å3
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Polar Surface Area
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66.4 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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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent