NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[benzyl(methyl)amino]-3-{2-methoxy-5-[(4-methylpiperazin-1-yl)methyl]phenoxy}propan-2-ol
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IUPAC Traditional name
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1-[benzyl(methyl)amino]-3-{2-methoxy-5-[(4-methylpiperazin-1-yl)methyl]phenoxy}propan-2-ol
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Synonyms
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1-[benzyl(methyl)amino]-3-{2-methoxy-5-[(4-methyl-1-piperazinyl)methyl]phenoxy}-2-propanol
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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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14.078852
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H Acceptors
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6
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H Donor
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1
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LogD (pH = 5.5)
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-2.9790397
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LogD (pH = 7.4)
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0.5362761
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Log P
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2.5592024
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Molar Refractivity
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122.1714 cm3
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Polarizability
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47.85169 Å3
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Polar Surface Area
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48.41 Å2
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Rotatable Bonds
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10
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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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1
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Log P
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3.12
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LOG S
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-0.92
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Polar Surface Area
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48.41 Å2
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Rotatable Bonds
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9
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent