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1044741-01-6

Product Name: 2-Pyrrolidine-2,3,4,5-13C4-1-15N-carbonitrile-13C, 1-[2-[(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-, (2S)-
Formula: C17H25N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 309.36 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 309.20848612 g/mol
Monoisotopic Mass 309.20848612 g/mol
Topological Polar Surface Area 76.4 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 523
Isotope Atom Count 6
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes