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113967-71-8

113967-71-8 structural image
Product Name: 7-AMINO-2-(METHYLSULFANYL)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLIC ACID
Formula: C7H7N5O2S
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COMPUTED DESCRIPTORS

Molecular Weight 225.23 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 225.03204566 g/mol
Monoisotopic Mass 225.03204566 g/mol
Topological Polar Surface Area 132 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 266
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