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76863-84-8

76863-84-8 structural image
Product Name: N-(3-NITRO-2-PYRIDINESULFENYL)-O-T-BUTYL-L-TYROSINE
Formula: C18H21N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 391.4 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 8
Exact Mass 391.12019195 g/mol
Monoisotopic Mass 391.12019195 g/mol
Topological Polar Surface Area 143 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 500
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 1
Compound Is Canonicalized Yes