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110500-78-2

110500-78-2 structural image
Product Name: O-Ethyl-N-[[1-mercapto(1)cyclohexyl]acetyl]-D-Tyr-L-Phe-L-Val-L-Asn-L-Cys(1)-L-Arg-D-Arg-NH2
Formula: C52H79N15O10S2
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COMPUTED DESCRIPTORS

Molecular Weight 1138.4 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 13
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 22
Exact Mass 1137.55757612 g/mol
Monoisotopic Mass 1137.55757612 g/mol
Topological Polar Surface Area 479 Ų
Heavy Atom Count 79
Formal Charge 0
Complexity 2110
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes