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131104-10-4

131104-10-4 structural image
Product Name: BIOTIN-X-D-PHE-PRO-ARG-CHLOROMETHYLKETONE, 2HCL
Formula: C37H56ClN9O6S
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COMPUTED DESCRIPTORS

Molecular Weight 818.4 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 23
Exact Mass 817.3711940 g/mol
Monoisotopic Mass 817.3711940 g/mol
Topological Polar Surface Area 278 Ų
Heavy Atom Count 56
Formal Charge 0
Complexity 1430
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes