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443688-20-8

443688-20-8 structural image
Product Name: tetrasodium 6-amino-5-[2-(4-{[4-({4-[2-(2-amino-8-hydroxy-6-sulfonaphthalen-1-yl)diazen-1-yl]-3-sulfophenyl}amino)-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl]amino}-2-sulfophenyl)diazen-1-yl]-4-hydroxynaphthalene-2-sulfonate
Formula: C39H32N12Na4O16S4
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COMPUTED DESCRIPTORS

Molecular Weight 1145.0 g/mol
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 28
Rotatable Bond Count 13
Exact Mass 1144.0532848 g/mol
Monoisotopic Mass 1144.0532848 g/mol
Topological Polar Surface Area 511 Ų
Heavy Atom Count 75
Formal Charge 0
Complexity 2100
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 5
Compound Is Canonicalized Yes