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72630-61-6

72630-61-6 structural image
Product Name: 4-Amino-6-[5-(5-chloro-2-fluoro-6-methylpyrimidin-4-ylamino)-2-sulfophenylazo]-5-hydroxy-3-(2,5-disulfophenylazo)-2,7-naphthalenedisulfonic acid
Formula: C27H20ClFN8O16S5
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COMPUTED DESCRIPTORS

Molecular Weight 927.3 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 25
Rotatable Bond Count 11
Exact Mass 925.9273383 g/mol
Monoisotopic Mass 925.9273383 g/mol
Topological Polar Surface Area 447 Ų
Heavy Atom Count 58
Formal Charge 0
Complexity 2110
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 1
Compound Is Canonicalized Yes