NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-{4-[4-(hydroxymethyl)phenyl]benzenesulfonamido}benzoic acid
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IUPAC Traditional name
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3-{4-[4-(hydroxymethyl)phenyl]benzenesulfonamido}benzoic acid
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Synonyms
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3-[4-(4-Methoxyphenyl)phenylsulfonamido]benzoic acid
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3-[4-(4-甲氧基苯基)苯基磺酰胺基]苯甲酸
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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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3.9658523
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H Acceptors
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5
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H Donor
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3
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LogD (pH = 5.5)
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1.4545912
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LogD (pH = 7.4)
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-0.28566107
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Log P
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2.9983697
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Molar Refractivity
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102.0985 cm3
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Polarizability
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40.90684 Å3
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Polar Surface Area
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103.7 Å2
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Rotatable Bonds
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5
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent