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1446322-66-2

1446322-66-2 structural image
Product Name: TAT-cyclo-CLLFVY
Formula: C111H188N42O24S2
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COMPUTED DESCRIPTORS

Molecular Weight 2559.1 g/mol
XLogP3 -9.2
Hydrogen Bond Donor Count 42
Hydrogen Bond Acceptor Count 35
Rotatable Bond Count 83
Exact Mass 2558.4256622 g/mol
Monoisotopic Mass 2557.4223074 g/mol
Topological Polar Surface Area 1180 Ų
Heavy Atom Count 179
Formal Charge 0
Complexity 5560
Isotope Atom Count 0
Defined Atom Stereocenter Count 19
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes