NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-{2-[4-(4-fluorophenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]ethyl}-3-(2-methoxyphenyl)propanamide
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IUPAC Traditional name
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N-{2-[4-(4-fluorophenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-1,2,4-triazol-3-yl]ethyl}-3-(2-methoxyphenyl)propanamide
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Synonyms
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N-(2-{4-(4-fluorophenyl)-5-[(2-methylbenzyl)thio]-4H-1,2,4-triazol-3-yl}ethyl)-3-(2-methoxyphenyl)propanamide
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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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14.818341
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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5.7412496
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LogD (pH = 7.4)
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5.7412753
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Log P
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5.741276
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Molar Refractivity
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154.1039 cm3
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Polarizability
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54.97919 Å3
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Polar Surface Area
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69.04 Å2
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Rotatable Bonds
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11
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Lipinski's Rule of Five
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false
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H Acceptors
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5
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H Donor
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1
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Log P
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4.02
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LOG S
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-8.33
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Polar Surface Area
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69.04 Å2
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Rotatable Bonds
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10
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent