NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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ethyl 5-({[2-(pyrrolidin-1-yl)-1,3-thiazol-4-yl]methyl}carbamoyl)-1H-imidazole-4-carboxylate
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IUPAC Traditional name
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ethyl 5-({[2-(pyrrolidin-1-yl)-1,3-thiazol-4-yl]methyl}carbamoyl)-1H-imidazole-4-carboxylate
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Synonyms
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ethyl 5-({[(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)methyl]amino}carbonyl)-1H-imidazole-4-carboxylate
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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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6.423434
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H Acceptors
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5
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H Donor
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2
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LogD (pH = 5.5)
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1.0133933
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LogD (pH = 7.4)
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0.33123344
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Log P
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1.0580577
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Molar Refractivity
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90.009 cm3
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Polarizability
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33.383 Å3
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Polar Surface Area
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100.21 Å2
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Rotatable Bonds
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7
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Lipinski's Rule of Five
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true
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H Acceptors
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5
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H Donor
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2
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Log P
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0.24
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LOG S
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-3.26
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Polar Surface Area
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100.21 Å2
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Rotatable Bonds
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7
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent