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18921-68-1

18921-68-1 structural image
Product Name: Deaza-Aminopterin
Formula: C21H22N6O5
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COMPUTED DESCRIPTORS

Molecular Weight 438.4 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 9
Exact Mass 438.16516782 g/mol
Monoisotopic Mass 438.16516782 g/mol
Topological Polar Surface Area 194 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 671
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