NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(3S,4R)-4-(hydroxymethyl)-1-[4-(1H-1,2,3,4-tetrazol-1-ylmethyl)benzoyl]piperidin-3-ol
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IUPAC Traditional name
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(3S,4R)-4-(hydroxymethyl)-1-[4-(1,2,3,4-tetrazol-1-ylmethyl)benzoyl]piperidin-3-ol
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Synonyms
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(3S*,4R*)-4-(hydroxymethyl)-1-[4-(1H-tetrazol-1-ylmethyl)benzoyl]-3-piperidinol
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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14.4344015
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H Acceptors
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6
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H Donor
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2
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LogD (pH = 5.5)
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-0.8795095
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LogD (pH = 7.4)
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-0.8795093
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Log P
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-0.87950927
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Molar Refractivity
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96.824 cm3
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Polarizability
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31.226538 Å3
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Polar Surface Area
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104.37 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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H Acceptors
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6
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H Donor
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2
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Log P
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-1.81
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LOG S
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-1.28
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Polar Surface Area
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104.37 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent