NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-(cyclopropylmethyl)-4-(1-methyl-1H-imidazole-5-carbonyl)-2-(propan-2-yl)-1,4-diazepane
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IUPAC Traditional name
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1-(cyclopropylmethyl)-2-isopropyl-4-(3-methylimidazole-4-carbonyl)-1,4-diazepane
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Synonyms
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1-(cyclopropylmethyl)-2-isopropyl-4-[(1-methyl-1H-imidazol-5-yl)carbonyl]-1,4-diazepane
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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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3
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H Donor
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0
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LogD (pH = 5.5)
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-2.1221366
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LogD (pH = 7.4)
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-0.66564006
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Log P
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1.2881722
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Molar Refractivity
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88.9307 cm3
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Polarizability
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33.910007 Å3
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Polar Surface Area
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41.37 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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H Acceptors
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3
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H Donor
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0
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Log P
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1.51
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LOG S
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-2.71
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Polar Surface Area
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41.37 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent