NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-(2-propoxyethyl)-4-{7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine
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IUPAC Traditional name
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1-(2-propoxyethyl)-4-{7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperazine
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Synonyms
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4-[4-(2-propoxyethyl)piperazin-1-yl]-7H-pyrrolo[2,3-d]pyrimidine
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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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13.561629
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H Acceptors
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5
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H Donor
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1
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LogD (pH = 5.5)
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-0.70830363
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LogD (pH = 7.4)
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1.5149206
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Log P
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1.8979353
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Molar Refractivity
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84.8697 cm3
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Polarizability
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32.28251 Å3
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Polar Surface Area
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57.28 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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1
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Log P
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1.63
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LOG S
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-1.7
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Polar Surface Area
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57.28 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent