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55748-93-1

55748-93-1 structural image
Product Name: Paracetamol mercapturate
Formula: C13H16N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 296.34 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 296.08307817 g/mol
Monoisotopic Mass 296.08307817 g/mol
Topological Polar Surface Area 85.5 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 367
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes