NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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6-amino-2-sulfanylidene-1,2,3,4-tetrahydro(6-13C)pyrimidin-4-one
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IUPAC Traditional name
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6-amino-2-sulfanylidene-1,3-dihydro(6-13C)pyrimidin-4-one
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Synonyms
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4-Amino-6-hydroxy-2-mercaptopyrimidine-13C
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4-Amino-2-thioxo-6-pyrimidinone-13C
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6-Amino-2-thiouracil-13C
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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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8.014538
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H Acceptors
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2
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H Donor
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3
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LogD (pH = 5.5)
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-0.47436255
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LogD (pH = 7.4)
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-0.5599725
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Log P
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-0.46662077
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Molar Refractivity
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46.8962 cm3
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Polarizability
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14.0733595 Å3
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Polar Surface Area
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67.15 Å2
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Rotatable Bonds
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0
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Physical Property
Safety Information
Product Information
Bioassay(PubChem)
Solubility
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Aqueous Sodium Hydroxide
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Show
data source
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Apperance
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White Solid
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Show
data source
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DETAILS
DETAILS
TRC
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Ji, X., et al.: Drug Dev. Res., 33, 51 (1994)
- • Poulsen, S., et al.: Bioorg. Med. Chem., 6, 619 (1994)
- • Fredholm, B., et al.: Pharmacol. Rev., 53, 527 (1994)
- • Gessi, S., et al.: Clin. Cancer Res., 10, 5895 (1994)
- • Moro, S., et al.: Med. Chem. Res., 26, 131
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PATENTS
PATENTS
PubChem Patent
Google Patent