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112898-47-2

112898-47-2 structural image
Product Name: PGLU-LEU-TYR-GLU-ASN-LYS-PRO-ARG-ARG-PRO-3,5-DIBROMO-TYR-ILE-LEU
Formula: C78H119Br2N21O20
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COMPUTED DESCRIPTORS

Molecular Weight 1830.7 g/mol
XLogP3 -2.3
Hydrogen Bond Donor Count 21
Hydrogen Bond Acceptor Count 23
Rotatable Bond Count 50
Exact Mass 1829.72865 g/mol
Monoisotopic Mass 1827.73070 g/mol
Topological Polar Surface Area 674 Ų
Heavy Atom Count 121
Formal Charge 0
Complexity 3610
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 14
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes