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104809-33-8

104809-33-8 structural image
Product Name: N-O-NITROPHENYLSULFENYL-GAMMA-AMINOBUTYRIC ACID DI(CYCLOHEXYL)AMMONIUM SALT
Formula: C22H35N3O4S
Synonyms: NPS-GABA
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COMPUTED DESCRIPTORS

Molecular Weight 437.6 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 437.23482778 g/mol
Monoisotopic Mass 437.23482778 g/mol
Topological Polar Surface Area 133 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 386
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 2
Compound Is Canonicalized Yes