NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-{[(adamantan-1-yl)amino]methyl}-4-(2,5-dimethoxyphenyl)phenol
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IUPAC Traditional name
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2-[(adamantan-1-ylamino)methyl]-4-(2,5-dimethoxyphenyl)phenol
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Synonyms
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3-[(1-adamantylamino)methyl]-2',5'-dimethoxy-4-biphenylol
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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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7.8626113
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H Acceptors
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4
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H Donor
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2
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LogD (pH = 5.5)
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1.6002684
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LogD (pH = 7.4)
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2.9377756
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Log P
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3.4988785
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Molar Refractivity
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114.9663 cm3
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Polarizability
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46.543888 Å3
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Polar Surface Area
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50.72 Å2
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Rotatable Bonds
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6
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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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2
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Log P
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4.85
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LOG S
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-4.66
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Polar Surface Area
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50.72 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