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126054-51-1

126054-51-1 structural image
Product Name: Acetonitrile, ((2-(((3-beta,5-alpha,17-beta)-3-hydroxyandrostan-17-yl) methylamino)ethyl)amino)-, dihydrochloride
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COMPUTED DESCRIPTORS

Molecular Weight 460.5 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 459.2783184 g/mol
Monoisotopic Mass 459.2783184 g/mol
Topological Polar Surface Area 59.3 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 614
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 3
Compound Is Canonicalized Yes