NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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ethyl 1-[2-(2H-1,2,3-benzotriazol-2-yl)acetyl]-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate
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IUPAC Traditional name
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ethyl 1-[2-(1,2,3-benzotriazol-2-yl)acetyl]-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate
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Synonyms
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ethyl 1-(2H-1,2,3-benzotriazol-2-ylacetyl)-3-(4-fluorobenzyl)-3-piperidinecarboxylate
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
供应商提供(Chembridge)
JChem
LOG S
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-4.56
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Polar Surface Area
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77.32 Å2
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Rotatable Bonds
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5
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H Acceptors
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6
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H Donor
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0
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Log P
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4.76
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Molar Refractivity
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124.4554 cm3
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Polarizability
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44.52583 Å3
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Polar Surface Area
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77.32 Å2
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Rotatable Bonds
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7
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Lipinski's Rule of Five
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true
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H Acceptors
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4
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H Donor
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0
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LogD (pH = 5.5)
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3.6137846
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LogD (pH = 7.4)
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3.613785
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Log P
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3.613785
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent