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1233509-68-6

1233509-68-6 structural image
Product Name: L-Thiocitrulline
Formula: C6H13N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 191.25 g/mol
XLogP3 -1.5
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 191.07284784 g/mol
Monoisotopic Mass 191.07284784 g/mol
Topological Polar Surface Area 99.2 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 174
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