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Homecas111127-62-9

111127-62-9

111127-62-9 structural image
Product Name: sadopine
Formula: C30H40F3N3O7S
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COMPUTED DESCRIPTORS

Molecular Weight 643.7 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 16
Exact Mass 643.25390628 g/mol
Monoisotopic Mass 643.25390628 g/mol
Topological Polar Surface Area 157 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 1120
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes