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254452-86-3

254452-86-3 structural image
Product Name: (3S,5R,6E)-7-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoic acid
Formula: C25H24FNO4
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COMPUTED DESCRIPTORS

Molecular Weight 421.5 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 421.16893641 g/mol
Monoisotopic Mass 421.16893641 g/mol
Topological Polar Surface Area 90.6 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 631
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes