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85187-55-9

85187-55-9 structural image
Product Name: dansyl alprenolol
Formula: C27H34N2O5S
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COMPUTED DESCRIPTORS

Molecular Weight 498.6 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 12
Exact Mass 498.21884336 g/mol
Monoisotopic Mass 498.21884336 g/mol
Topological Polar Surface Area 87.7 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 745
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

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