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866008-98-2

866008-98-2 structural image
Product Name: 1H-Pyrrole-3-acetic acid, 1-(1H-indazol-6-yl)-2,5-dimethyl-α-oxo-
Formula: C15H13N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 283.28 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 283.09569129 g/mol
Monoisotopic Mass 283.09569129 g/mol
Topological Polar Surface Area 88 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 442
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes