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389867-93-0

389867-93-0 structural image
Product Name: H-LYS-THR-GLU-GLU-ILE-SER-GLU-VAL-LYS-MET-PNA
Formula: C56H92N14O20S
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COMPUTED DESCRIPTORS

Molecular Weight 1313.5 g/mol
XLogP3 -9.5
Hydrogen Bond Donor Count 18
Hydrogen Bond Acceptor Count 24
Rotatable Bond Count 45
Exact Mass 1312.63330255 g/mol
Monoisotopic Mass 1312.63330255 g/mol
Topological Polar Surface Area 593 Ų
Heavy Atom Count 91
Formal Charge 0
Complexity 2430
Isotope Atom Count 0
Defined Atom Stereocenter Count 12
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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