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87798-90-1

87798-90-1 structural image
Product Name: 1-(4-(4-(p-Fluorophenyl)-1-piperazinyl)butyl)theobromine dihydrochlori de
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COMPUTED DESCRIPTORS

Molecular Weight 487.4 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 486.1713077 g/mol
Monoisotopic Mass 486.1713077 g/mol
Topological Polar Surface Area 64.9 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 621
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 3
Compound Is Canonicalized Yes