Compound Information
CID 199540
Create Date: 2005-08-09
Suppressed Compound
Properties and Descriptors
Properties
Molecular Weight 302.303109 [g/mol]
Molecular FormulaC8H11N2NaO5S2
H-Bond Donor2
H-Bond Acceptor7
Rotatable Bond Count3
Exact Mass302.000708
MonoIsotopic Mass302.000708
Topological Polar Surface Area146
Heavy Atom Count18
Formal Charge0
Complexity426
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Descriptors
IUPAC Name
Canonical SMILES
Isomeric SMILES
Old Version Substance Information