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872043-01-1

872043-01-1 structural image
Product Name: Polybia-MP1 trifluoroacetate salt
Formula: C78H132N20O19
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COMPUTED DESCRIPTORS

Molecular Weight 1654.0 g/mol
XLogP3 -4.5
Hydrogen Bond Donor Count 22
Hydrogen Bond Acceptor Count 23
Rotatable Bond Count 58
Exact Mass 1652.99776206 g/mol
Monoisotopic Mass 1652.99776206 g/mol
Topological Polar Surface Area 659 Ų
Heavy Atom Count 117
Formal Charge 0
Complexity 3290
Isotope Atom Count 0
Defined Atom Stereocenter Count 16
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes