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121785-71-5

121785-71-5 structural image
Product Name: 21R-Argatroban
Formula: C23H36N6O5S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Solubility 2.21e-01 g/L
LogP 1

COMPUTED DESCRIPTORS

Molecular Weight 508.6 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 9
Exact Mass 508.24678944 g/mol
Monoisotopic Mass 508.24678944 g/mol
Topological Polar Surface Area 189 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 887
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes