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Homecas112748-19-3

112748-19-3

112748-19-3 structural image
Product Name: scyliorhinin II
Formula: C77H119N21O26S3
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COMPUTED DESCRIPTORS

Molecular Weight 1851.1 g/mol
XLogP3 -12.5
Hydrogen Bond Donor Count 23
Hydrogen Bond Acceptor Count 31
Rotatable Bond Count 43
Exact Mass 1849.7797265 g/mol
Monoisotopic Mass 1849.7797265 g/mol
Topological Polar Surface Area 818 Ų
Heavy Atom Count 127
Formal Charge 0
Complexity 3910
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 16
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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