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96607-61-3

96607-61-3 structural image
Product Name: (TYR9)-CHOLECYSTOKININ OCTAPEPTIDE (SULFATED)
Formula: C58H70N10O19S3
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COMPUTED DESCRIPTORS

Molecular Weight 1307.4 g/mol
XLogP3 -0.7
Hydrogen Bond Donor Count 15
Hydrogen Bond Acceptor Count 22
Rotatable Bond Count 37
Exact Mass 1306.39808356 g/mol
Monoisotopic Mass 1306.39808356 g/mol
Topological Polar Surface Area 529 Ų
Heavy Atom Count 90
Formal Charge 0
Complexity 2550
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes