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Homecas81531-57-9

81531-57-9

81531-57-9 structural image
Product Name: detalliptinium
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COMPUTED DESCRIPTORS

Molecular Weight 362.5 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 362.223237525 g/mol
Monoisotopic Mass 362.223237525 g/mol
Topological Polar Surface Area 43.1 Ų
Heavy Atom Count 27
Formal Charge 1
Complexity 496
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes