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1214261-78-5

1214261-78-5 structural image
Product Name: L-Phenylalanine,N-(2-broMo-3-oxospiro[3.5]non-1-en-1-yl)-4-(2,7-naphthyridin-1-ylaMino)-,ethyl ester,sulfate (2:1
Formula: C56H60Br2N8O10S
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COMPUTED DESCRIPTORS

Molecular Weight 647.5 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 9
Exact Mass 646.10968 g/mol
Monoisotopic Mass 646.10968 g/mol
Topological Polar Surface Area 176 Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 916
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

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