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81888-43-9

81888-43-9 structural image
Product Name: 2-Naphthacenecarboxamide, 7-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-4-(methylamino)-1,11-dioxo-, [4S-(4α,4aα,5aα,12aα)]- (9CI)
Formula: C22H25N3O7
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COMPUTED DESCRIPTORS

Molecular Weight 443.4 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 3
Exact Mass 443.16925015 g/mol
Monoisotopic Mass 443.16925015 g/mol
Topological Polar Surface Area 173 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 942
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes