NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-methyl-5-(methylamino)-1H-imidazole-4-carboxamide hydrochloride
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IUPAC Traditional name
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N-methyl-5-(methylamino)-1H-imidazole-4-carboxamide hydrochloride
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Synonyms
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N-Methyl-5-(methylamino)-1H-imidazole-4-carboxamide Hydrochloride
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N-Methyl-5(or 4)-methylamino-imidazole-4(or 5)-carboxamide Hydrochloride
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Theophyllidine Hydrochloride
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CAS Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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10.329721
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H Acceptors
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3
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H Donor
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3
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LogD (pH = 5.5)
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-0.62893736
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LogD (pH = 7.4)
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-0.4759027
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Log P
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-0.4729884
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Molar Refractivity
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42.063 cm3
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Polarizability
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14.8718195 Å3
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Polar Surface Area
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69.81 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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PROPERTIES
PROPERTIES
Safety Information
Product Information
Bioassay(PubChem)
DETAILS
DETAILS
TRC
PATENTS
PATENTS
PubChem Patent
Google Patent