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219138-21-3

219138-21-3 structural image
Product Name: AC-IETD-PNA
Formula: C27H38N6O12
Synonyms: Ac-IETD-AMC;Ac-IETD-pNA
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COMPUTED DESCRIPTORS

Molecular Weight 638.6 g/mol
XLogP3 -0.8
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 17
Exact Mass 638.25477067 g/mol
Monoisotopic Mass 638.25477067 g/mol
Topological Polar Surface Area 286 Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 1100
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes