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118060-90-5

118060-90-5 structural image
Product Name: beta-casokinin 10
Formula: C53H85N15O14
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COMPUTED DESCRIPTORS

Molecular Weight 1156.3 g/mol
XLogP3 -4.1
Hydrogen Bond Donor Count 14
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 33
Exact Mass 1155.64004244 g/mol
Monoisotopic Mass 1155.64004244 g/mol
Topological Polar Surface Area 478 Ų
Heavy Atom Count 82
Formal Charge 0
Complexity 2290
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes