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38536-28-6

38536-28-6 structural image
Product Name: Nicergoline-5-Chloro Analogue
Formula: C24H26ClN3O3
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COMPUTED DESCRIPTORS

Molecular Weight 439.9 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 439.1662694 g/mol
Monoisotopic Mass 439.1662694 g/mol
Topological Polar Surface Area 56.6 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 681
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes