NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-(2-methyl-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-4-(5-methylpyridin-2-yl)piperidin-4-ol
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IUPAC Traditional name
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1-(2-methyl-3,4-dihydro-1H-isoquinoline-3-carbonyl)-4-(5-methylpyridin-2-yl)piperidin-4-ol
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Synonyms
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4-(5-methyl-2-pyridinyl)-1-[(2-methyl-1,2,3,4-tetrahydro-3-isoquinolinyl)carbonyl]-4-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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13.397593
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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0.05414687
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LogD (pH = 7.4)
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1.6943392
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Log P
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1.9327809
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Molar Refractivity
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106.0946 cm3
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Polarizability
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41.09237 Å3
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Polar Surface Area
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56.67 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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H Acceptors
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4
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H Donor
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1
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Log P
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1.63
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LOG S
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-3.26
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Polar Surface Area
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56.67 Å2
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Rotatable Bonds
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2
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent