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2989-84-6

2989-84-6 structural image
Product Name: 3-MERCAPTOPROPIONYL-TYR-PHE-GLN-ASN-CYS-PRO-LYS-GLY-NH2, (DISULFIDE BOND)
Formula: C46H64N12O12S2
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COMPUTED DESCRIPTORS

Molecular Weight 1041.2 g/mol
XLogP3 -3.1
Hydrogen Bond Donor Count 12
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 19
Exact Mass 1040.42080787 g/mol
Monoisotopic Mass 1040.42080787 g/mol
Topological Polar Surface Area 450 Ų
Heavy Atom Count 72
Formal Charge 0
Complexity 1920
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes