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126054-44-2

126054-44-2 structural image
Product Name: Ethanaminium, 2-(((3-beta,5-alpha,17-beta)-17-((cyanomethyl)methylamin o)androstan-3-yl)oxy)-N,N,N-trimethyl-2-oxo-, chloride
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COMPUTED DESCRIPTORS

Molecular Weight 480.1 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 479.3278554 g/mol
Monoisotopic Mass 479.3278554 g/mol
Topological Polar Surface Area 53.3 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 767
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes