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1310347-50-2

1310347-50-2 structural image
Product Name: BACE1-IN-1
Formula: C18H14F3N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 389.3 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 389.10995919 g/mol
Monoisotopic Mass 389.10995919 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 694
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes