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Homecas123338-10-3

123338-10-3

123338-10-3 structural image
Product Name: ALLATOSTATIN I
Formula: C61H94N18O16
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COMPUTED DESCRIPTORS

Molecular Weight 1335.5 g/mol
XLogP3 -3.3
Hydrogen Bond Donor Count 18
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 40
Exact Mass 1334.70951898 g/mol
Monoisotopic Mass 1334.70951898 g/mol
Topological Polar Surface Area 558 Ų
Heavy Atom Count 95
Formal Charge 0
Complexity 2670
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes