NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3,4,7-trimethyl-2-(4-phenyl-1,4-diazepane-1-carbonyl)-1H-indole
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IUPAC Traditional name
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3,4,7-trimethyl-2-(4-phenyl-1,4-diazepane-1-carbonyl)-1H-indole
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Synonyms
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3,4,7-trimethyl-2-[(4-phenyl-1,4-diazepan-1-yl)carbonyl]-1H-indole
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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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14.199547
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H Acceptors
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2
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H Donor
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1
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LogD (pH = 5.5)
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4.545067
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LogD (pH = 7.4)
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4.627309
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Log P
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4.628465
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Molar Refractivity
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112.4314 cm3
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Polarizability
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42.92203 Å3
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Polar Surface Area
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39.34 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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1
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H Donor
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1
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Log P
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3.02
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LOG S
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-4.42
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Polar Surface Area
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39.34 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