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1217718-11-0

1217718-11-0 structural image
Product Name: BIOTINYLAMIDOETHYL]-DITHIOMETHYLENEMALONIC ACID BIS(2-AMINOETHANOIC ACID)
Formula: C22H34N6O9S3
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COMPUTED DESCRIPTORS

Molecular Weight 622.7 g/mol
XLogP3 -1.9
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 19
Exact Mass 622.15494020 g/mol
Monoisotopic Mass 622.15494020 g/mol
Topological Polar Surface Area 308 Ų
Heavy Atom Count 40
Formal Charge 0
Complexity 927
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes