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86394-16-3

86394-16-3 structural image
Product Name: MU-CONOTOXIN GIIIA
Formula: C100H176N38O32S6
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COMPUTED DESCRIPTORS

Molecular Weight 2609.1 g/mol
XLogP3 -21.6
Hydrogen Bond Donor Count 41
Hydrogen Bond Acceptor Count 46
Rotatable Bond Count 49
Exact Mass 2608.1201173 g/mol
Monoisotopic Mass 2607.1167624 g/mol
Topological Polar Surface Area 1340 Ų
Heavy Atom Count 176
Formal Charge 0
Complexity 5700
Isotope Atom Count 0
Defined Atom Stereocenter Count 26
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes