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29138-42-9

29138-42-9 structural image
Product Name: LU 6-041 hydrochloride
Formula: C21H21F6NO.ClH
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COMPUTED DESCRIPTORS

Molecular Weight 453.8 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 453.1294110 g/mol
Monoisotopic Mass 453.1294110 g/mol
Topological Polar Surface Area 12.5 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 540
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 2
Compound Is Canonicalized Yes