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497258-54-5

497258-54-5 structural image
Product Name: Ethanesulfonic acid, 2-[[(1,2,3,4-tetrahydro-4-oxo-1-β-D-ribofuranosyl-2-thioxo-5-pyrimidinyl)methyl]amino]-
Formula: C12H19N3O8S2
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COMPUTED DESCRIPTORS

Molecular Weight 397.4 g/mol
XLogP3 -5.2
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 7
Exact Mass 397.06135692 g/mol
Monoisotopic Mass 397.06135692 g/mol
Topological Polar Surface Area 209 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 662
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes