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Homecas2232228-54-3

2232228-54-3

2232228-54-3 structural image
Product Name: Regorafenib N-Glucuronide
Formula: C27H23ClF4N4O9
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COMPUTED DESCRIPTORS

Molecular Weight 658.9 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 7
Exact Mass 658.1089687 g/mol
Monoisotopic Mass 658.1089687 g/mol
Topological Polar Surface Area 191 Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 1060
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes