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2140305-65-1

2140305-65-1 structural image
Product Name: Pyrazolo[1,5-a]-1,3,5-triazine-8-carboxylic acid, 1,2-dihydro-2-oxo-
Formula: C6H4N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 180.12 g/mol
XLogP3 -0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 180.02834000 g/mol
Monoisotopic Mass 180.02834000 g/mol
Topological Polar Surface Area 96.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 290
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