NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-chloro-1-methyl-3-{[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]methyl}-1H-indazole
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IUPAC Traditional name
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4-chloro-1-methyl-3-{[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]methyl}indazole
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Synonyms
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4-chloro-1-methyl-3-[(4-pyrimidin-2-yl-1,4-diazepan-1-yl)methyl]-1H-indazole
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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)
H Acceptors
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5
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H Donor
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0
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LogD (pH = 5.5)
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1.084187
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LogD (pH = 7.4)
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2.4528563
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Log P
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2.6003723
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Molar Refractivity
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112.1387 cm3
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Polarizability
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39.066475 Å3
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Polar Surface Area
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50.08 Å2
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Rotatable Bonds
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3
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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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Log P
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3.14
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LOG S
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-3.48
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Polar Surface Area
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50.08 Å2
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Rotatable Bonds
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3
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent