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125279-79-0

125279-79-0 structural image
Product Name: Ersentilide
Formula: C21H26N4O5S
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COMPUTED DESCRIPTORS

Molecular Weight 446.5 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 12
Exact Mass 446.16239112 g/mol
Monoisotopic Mass 446.16239112 g/mol
Topological Polar Surface Area 123 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 601
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