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126586-85-4

126586-85-4 structural image
Product Name: LIGA 20
Formula: C57H97Cl2N3O31
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COMPUTED DESCRIPTORS

Molecular Weight 1391.3 g/mol
XLogP3 -3.1
Hydrogen Bond Donor Count 20
Hydrogen Bond Acceptor Count 31
Rotatable Bond Count 37
Exact Mass 1389.5483087 g/mol
Monoisotopic Mass 1389.5483087 g/mol
Topological Polar Surface Area 541 Ų
Heavy Atom Count 93
Formal Charge 0
Complexity 2280
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 28
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes