274693-49-1
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 |