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66842-71-5

66842-71-5 structural image
Product Name: 5H-Pyrido[3,4-b]indol-5-one, 1,2,3,4,6,7,8,9-octahydro-4-hydroxy-2,9-dimethyl-
Formula: C13H18N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 234.29 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 234.136827821 g/mol
Monoisotopic Mass 234.136827821 g/mol
Topological Polar Surface Area 45.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 333
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