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126370-52-3

126370-52-3 structural image
Product Name: H-ILE-ALA-ALA-GLY-ARG-THR-GLY-ARG-ARG-GLN-ALA-ILE-HIS-ASP-ILE-LEU-VAL-ALA-ALA-OH
Formula: C85H149N31O24
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COMPUTED DESCRIPTORS

Molecular Weight 1989.3 g/mol
XLogP3 -7.5
Hydrogen Bond Donor Count 33
Hydrogen Bond Acceptor Count 29
Rotatable Bond Count 69
Exact Mass 1988.1391747 g/mol
Monoisotopic Mass 1988.1391747 g/mol
Topological Polar Surface Area 902 Ų
Heavy Atom Count 140
Formal Charge 0
Complexity 4260
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 21
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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