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112209-92-4

112209-92-4 structural image
Product Name: (4,4'-dehydrophenylalanine)gramicidin S
Formula: C60H88N12O10
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COMPUTED DESCRIPTORS

Molecular Weight 1137.4 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 10
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 14
Exact Mass 1136.67463705 g/mol
Monoisotopic Mass 1136.67463705 g/mol
Topological Polar Surface Area 326 Ų
Heavy Atom Count 82
Formal Charge 0
Complexity 2140
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 8
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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