NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2R,3R)-2-amino-3-hydroxybutanoic acid
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IUPAC Traditional name
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allo-threonine
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D-allothreonine
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Synonyms
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D-Threonine
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(2S,3R)-2-Amino-3-hydroxybutanoic acid
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L-Threonine
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DL-allo-Threonine
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(2R,3R)-2-Amino-3-hydroxybutyric acid
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D-allo-Threonine
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H-D-allo-Thr-OH
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D-Allo-Threonine
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(2R,3R)-2-AMino-3-hydroxybutanoic acid
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(2R,3R)-2-氨基-3-羟基丁酸
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D-别苏氨酸
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D-allo-苏氨酸
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CAS Number
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EC Number
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MDL Number
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MFCD00004526
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MFCD00064270
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MFCD00067248
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Beilstein 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
ALOGPS 2.1
Acid pKa
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2.207432
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H Acceptors
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4
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H Donor
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3
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LogD (pH = 5.5)
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-3.4708102
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LogD (pH = 7.4)
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-3.4806278
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Log P
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-3.4709635
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Molar Refractivity
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26.4598 cm3
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Polarizability
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10.868561 Å3
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Polar Surface Area
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83.55 Å2
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Rotatable Bonds
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2
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Lipinski's Rule of Five
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true
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Log P
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-3.01
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LOG S
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0.6
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Solubility (Water)
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4.77e+02 g/l
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DETAILS
DETAILS
DrugBank
PATENTS
PATENTS
PubChem Patent
Google Patent