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70382-26-2

70382-26-2 structural image
Product Name: benzyl N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate:hydrochloride
Formula: C33H37ClN6O6
Synonyms: Z-Phe-Arg-7-amido-4-methylcoumarin, Hydrochloride - CAS 70382-26-2 - Calbiochem
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COMPUTED DESCRIPTORS

Molecular Weight 649.1 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 14
Exact Mass 648.2463106 g/mol
Monoisotopic Mass 648.2463106 g/mol
Topological Polar Surface Area 187 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1080
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes