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158884-64-1

158884-64-1 structural image
Product Name: (D-VAL22)-BIG ENDOTHELIN-1 FRAGMENT (16-38) (HUMAN)
Formula: C119H180N32O33
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COMPUTED DESCRIPTORS

Molecular Weight 2586.9 g/mol
XLogP3 -4.2
Hydrogen Bond Donor Count 34
Hydrogen Bond Acceptor Count 37
Rotatable Bond Count 76
Exact Mass 2586.3424111 g/mol
Monoisotopic Mass 2585.3390563 g/mol
Topological Polar Surface Area 1010 Ų
Heavy Atom Count 184
Formal Charge 0
Complexity 5930
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 24
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes