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105161-35-1

105161-35-1 structural image
Product Name: 5-Pyrimidinecarboxaldehyde, 4-amino-1,2-dihydro-2-thioxo- (9CI)
Formula: C5H5N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 155.18 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 155.01533297 g/mol
Monoisotopic Mass 155.01533297 g/mol
Topological Polar Surface Area 99.6 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 243
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes