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102604-64-8

102604-64-8 structural image
Product Name: N(alpha)-3-(4-hydroxyphenylpropionyl)asparaginyl-lysyl-(N(epsilon)-4-azidobenzoyl)threoninamide
Formula: C30H39N9O8
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COMPUTED DESCRIPTORS

Molecular Weight 653.7 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 19
Exact Mass 653.29215924 g/mol
Monoisotopic Mass 653.29215924 g/mol
Topological Polar Surface Area 257 Ų
Heavy Atom Count 47
Formal Charge 0
Complexity 1130
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes