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58899-27-7

58899-27-7 structural image
Product Name: Aripiprazole Metabolite
Formula: C13H15NO4
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COMPUTED DESCRIPTORS

Molecular Weight 249.26 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 249.10010796 g/mol
Monoisotopic Mass 249.10010796 g/mol
Topological Polar Surface Area 75.6 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 318
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes