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73413-78-2

73413-78-2 structural image
Product Name: N-(7-NITROBENZOFURAZAN-4-YL)PHALLACIDIN
Formula: C45H57N13O15S
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COMPUTED DESCRIPTORS

Molecular Weight 1052.1 g/mol
XLogP3 -1
Hydrogen Bond Donor Count 13
Hydrogen Bond Acceptor Count 19
Rotatable Bond Count 10
Exact Mass 1051.38177934 g/mol
Monoisotopic Mass 1051.38177934 g/mol
Topological Polar Surface Area 443 Ų
Heavy Atom Count 74
Formal Charge 0
Complexity 2130
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 10
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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