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170663-33-9

170663-33-9 structural image
Product Name: ALPHA-CONOTOXIN EL
Formula: C83H125N27O27S5
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COMPUTED DESCRIPTORS

Molecular Weight 2093.4 g/mol
XLogP3 -12.1
Hydrogen Bond Donor Count 28
Hydrogen Bond Acceptor Count 35
Rotatable Bond Count 31
Exact Mass 2091.7841777 g/mol
Monoisotopic Mass 2091.7841777 g/mol
Topological Polar Surface Area 1000 Ų
Heavy Atom Count 142
Formal Charge 0
Complexity 4540
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 21
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes