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3604-60-2

3604-60-2 structural image
Product Name: 17A-PREGN-5-EN-20-YNE-3B,17-DIOL
Formula: C21H30O2
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COMPUTED DESCRIPTORS

Molecular Weight 314.5 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 314.224580195 g/mol
Monoisotopic Mass 314.224580195 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 598
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes