NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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ethyl 3-(1-{3-amino-4-[(2H3)methylamino]phenyl}-N-(pyridin-2-yl)formamido)propanoate
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IUPAC Traditional name
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ethyl 3-(1-{3-amino-4-[(2H3)methylamino]phenyl}-N-(pyridin-2-yl)formamido)propanoate
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Synonyms
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N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine-d3 Ethyl Ester
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
H Acceptors
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5
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H Donor
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2
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LogD (pH = 5.5)
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1.1626132
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LogD (pH = 7.4)
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1.1674697
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Log P
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1.167532
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Molar Refractivity
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98.0599 cm3
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Polarizability
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36.148277 Å3
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Polar Surface Area
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97.55 Å2
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Rotatable Bonds
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8
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
TRC
PATENTS
PATENTS
PubChem Patent
Google Patent