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123714-50-1

123714-50-1 structural image
Product Name: Ac-Asp-Pro-Met-Ser-Ser-Thr-Tyr-Ile-Glu-Glu-Leu-Gly-Lys-Arg-Glu-Val-Thr-Ile-Pro-Pro-Lys-Tyr-Arg-Glu-Leu-Leu-Ala-NH2
Formula: C142H230N36O44S
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COMPUTED DESCRIPTORS

Molecular Weight 3177.6 g/mol
XLogP3 -9.4
Hydrogen Bond Donor Count 44
Hydrogen Bond Acceptor Count 49
Rotatable Bond Count 105
Exact Mass 3176.6620907 g/mol
Monoisotopic Mass 3175.6587359 g/mol
Topological Polar Surface Area 1310 Ų
Heavy Atom Count 223
Formal Charge 0
Complexity 7290
Isotope Atom Count 0
Defined Atom Stereocenter Count 30
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Calpastatin peptide Ac 184-210 is a 27-membered polypeptide comprising the sequence Ac-Asp-Pro-Met-Ser-Ser-Thr-Tyr-Ile-Glu-Glu-Leu-Gly-Lys-Arg-Glu-Val-Thr-Ile-Pro-Pro-Lys-Tyr-Arg-Glu-Leu-Leu-Ala-NH2. An acetylated synthetic peptide from human calpastatin that strongly inhibits both calpains I and II but not papain (a cysteine protease) or trypsin (a serine protease). It has a role as an EC 3.4.22.52 (calpain-1) inhibitor and an EC 3.4.22.53 (calpain-2) inhibitor.