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130018-76-7

130018-76-7 structural image
Product Name: (S)-Cetirizine
Formula: C21H25ClN2O3
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COMPUTED DESCRIPTORS

Molecular Weight 388.9 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 388.1553704 g/mol
Monoisotopic Mass 388.1553704 g/mol
Topological Polar Surface Area 53 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 443
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