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53749-60-3

53749-60-3 structural image
Product Name: SUBSTANCE P (4-11)
Formula: C46H67N11O10S
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COMPUTED DESCRIPTORS

Molecular Weight 966.2 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 11
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 30
Exact Mass 965.47930855 g/mol
Monoisotopic Mass 965.47930855 g/mol
Topological Polar Surface Area 370 Ų
Heavy Atom Count 68
Formal Charge 0
Complexity 1730
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes