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21657-52-3

21657-52-3 structural image
Product Name: K9
Formula: C54H110N18O10
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COMPUTED DESCRIPTORS

Molecular Weight 1171.6 g/mol
XLogP3 -7.1
Hydrogen Bond Donor Count 19
Hydrogen Bond Acceptor Count 20
Rotatable Bond Count 53
Exact Mass 1170.86523178 g/mol
Monoisotopic Mass 1170.86523178 g/mol
Topological Polar Surface Area 530 Ų
Heavy Atom Count 82
Formal Charge 0
Complexity 1810
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