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157380-72-8

157380-72-8 structural image
Product Name: TAK 044
Formula: C45H51N9O11S.2Na
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COMPUTED DESCRIPTORS

Molecular Weight 972.0 g/mol
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 10
Exact Mass 971.32241321 g/mol
Monoisotopic Mass 971.32241321 g/mol
Topological Polar Surface Area 322 Ų
Heavy Atom Count 68
Formal Charge 0
Complexity 1780
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes