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766536-21-4

766536-21-4 structural image
Product Name: (R)-3-PHENYL-3-([4-(4-PYRIDIN-4-YL-PHENYL)-THIOPHENE-2-CARBONYL]-AMINO)-PROPIONIC ACID
Formula: C25H20N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 428.5 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 428.11946368 g/mol
Monoisotopic Mass 428.11946368 g/mol
Topological Polar Surface Area 108 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 596
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