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87444-27-7

87444-27-7 structural image
Product Name: Pyrazinamine, 5,6-dimethyl-3-(methylthio)- (9CI)
Formula: C7H11N3S
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COMPUTED DESCRIPTORS

Molecular Weight 169.25 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 169.06736854 g/mol
Monoisotopic Mass 169.06736854 g/mol
Topological Polar Surface Area 77.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 131
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes