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1255087-87-6

1255087-87-6 structural image
Product Name: 3-[[2-(BIOTINAMIDO)ETHYL]DITHIO]PROPIONIC ACID 4'-(HYDROXYMETHYL)DMPO ESTER
Formula: C22H36N4O5S3
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COMPUTED DESCRIPTORS

Molecular Weight 532.7 g/mol
XLogP3 0
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 15
Exact Mass 532.18478378 g/mol
Monoisotopic Mass 532.18478378 g/mol
Topological Polar Surface Area 201 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 767
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes