NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-[(4-methylphenyl)sulfanyl]pyridine-3-carboxylic acid
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IUPAC Traditional name
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2-[(4-methylphenyl)sulfanyl]pyridine-3-carboxylic acid
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Synonyms
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2-[(4-Methylphenyl)thio]pyridine-3-carboxylic acid
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2-[(4-Methylphenyl)sulphanyl]pyridine-3-carboxylic acid
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3-Carboxy-2-[(4-methylphenyl)thio]pyridine
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2-[(4-Methylphenyl)thio]nicotinic acid
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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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3.654257
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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1.855561
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LogD (pH = 7.4)
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0.38215718
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Log P
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3.7097847
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Molar Refractivity
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69.1961 cm3
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Polarizability
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26.16269 Å3
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Polar Surface Area
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50.19 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent