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177943-89-4

177943-89-4 structural image
Product Name: DOTA-(Tyr3)-Octreotate
Formula: C67H94N14O21S2
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COMPUTED DESCRIPTORS

Molecular Weight 1675.8 g/mol
Hydrogen Bond Donor Count 21
Hydrogen Bond Acceptor Count 34
Rotatable Bond Count 26
Exact Mass 1674.67932651 g/mol
Monoisotopic Mass 1674.67932651 g/mol
Topological Polar Surface Area 697 Ų
Heavy Atom Count 116
Formal Charge 0
Complexity 2740
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 5
Compound Is Canonicalized Yes