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175201-70-4

175201-70-4 structural image
Product Name: 4-(METHYLTHIO)-2-(([2-(METHYLTHIO)-3-PYRIDYL]CARBONYL)AMINO)BUTANOIC ACID
Formula: C12H16N2O3S2
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COMPUTED DESCRIPTORS

Molecular Weight 300.4 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 300.06023472 g/mol
Monoisotopic Mass 300.06023472 g/mol
Topological Polar Surface Area 130 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 315
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes