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167289-62-5

167289-62-5 structural image
Product Name: Bacitracin I1 (9CI)
Formula: C64H94N16O17S
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COMPUTED DESCRIPTORS

Molecular Weight 1391.6 g/mol
XLogP3 -1.2
Hydrogen Bond Donor Count 16
Hydrogen Bond Acceptor Count 21
Rotatable Bond Count 29
Exact Mass 1390.67035677 g/mol
Monoisotopic Mass 1390.67035677 g/mol
Topological Polar Surface Area 551 Ų
Heavy Atom Count 98
Formal Charge 0
Complexity 2790
Isotope Atom Count 0
Defined Atom Stereocenter Count 11
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes