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83759-54-0

83759-54-0 structural image
Product Name: neo-kyotorphin
Formula: C28H47N9O9
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COMPUTED DESCRIPTORS

Molecular Weight 653.7 g/mol
XLogP3 -5.9
Hydrogen Bond Donor Count 12
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 21
Exact Mass 653.34967411 g/mol
Monoisotopic Mass 653.34967411 g/mol
Topological Polar Surface Area 331 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1020
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes