NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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{5-[(4-bromophenyl)sulfanyl]-1-methyl-3-phenyl-1H-pyrazol-4-yl}methanol
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IUPAC Traditional name
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{5-[(4-bromophenyl)sulfanyl]-1-methyl-3-phenylpyrazol-4-yl}methanol
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Synonyms
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{5-[(4-Bromophenyl)sulfanyl]-1-methyl-3-phenyl-1H-pyrazol-4-yl}methanol
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CAS Number
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MDL 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
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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14.7143345
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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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4.713592
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LogD (pH = 7.4)
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4.7136245
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Log P
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4.713625
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Molar Refractivity
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106.1017 cm3
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Polarizability
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37.597305 Å3
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Polar Surface Area
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38.05 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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PATENTS
PATENTS
PubChem Patent
Google Patent