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Homecas1196151-16-2

1196151-16-2

1196151-16-2 structural image
Product Name: Acemetacin-D4
Formula: C21H18ClNO6
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COMPUTED DESCRIPTORS

Molecular Weight 419.8 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 419.1073720 g/mol
Monoisotopic Mass 419.1073720 g/mol
Topological Polar Surface Area 94.8 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 620
Isotope Atom Count 4
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