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102488-56-2

102488-56-2 structural image
Product Name: Dispegatrine
Formula: C40H48N4O4+2
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COMPUTED DESCRIPTORS

Molecular Weight 648.8 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 648.36755603 g/mol
Monoisotopic Mass 648.36755603 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 48
Formal Charge 2
Complexity 1290
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 10
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes