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116169-42-7

116169-42-7 structural image
Product Name: 3-Quinolinecarboxylic acid, 1,4-dihydro-7-(3-amino-3-phenyl-1-pyrrolid inyl)-1-cyclopropyl-6,8-difluoro-4-oxo-
Formula: C23H21F2N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 425.4 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 425.15509786 g/mol
Monoisotopic Mass 425.15509786 g/mol
Topological Polar Surface Area 86.9 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 782
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 1
Compound Is Canonicalized Yes