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274693-49-1

274693-49-1 structural image
Product Name: (3aR,4S,6R,6aS)-6-(7-(((1R,2S)-2-(3,4-difluorophenyl)cyclopropyl)aMino)-5-(propylthio)-3H-[1,2,3]triazolo[4,5-d]pyriMidin-3-yl)-2,2-
Formula: C24H28F2N6O3S
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COMPUTED DESCRIPTORS

Molecular Weight 518.6 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 7
Exact Mass 518.19116627 g/mol
Monoisotopic Mass 518.19116627 g/mol
Topological Polar Surface Area 133 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 803
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes