Mrv0541 02241215052D          

  6  3  0  0  0  0            999 V2000
   -1.5680   -0.8298    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    1.5680    0.5530    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.5680    0.0919    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    0.4604    0.8298    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8294    0.0919    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1837   -0.2763    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
M  CHG  4   1   1   2  -1   3   1   6  -1
M  END
> <DATABASE_ID>
FDB015405

> <DATABASE_NAME>
foodb

> <SMILES>
[K+].[K+].[O-]S([O-])=O

> <INCHI_IDENTIFIER>
InChI=1S/2K.H2O3S/c;;1-4(2)3/h;;(H2,1,2,3)/q2*+1;/p-2

> <INCHI_KEY>
BHZRJJOHZFYXTO-UHFFFAOYSA-L

> <FORMULA>
K2O3S

> <MOLECULAR_WEIGHT>
158.26

> <EXACT_MASS>
157.884228278

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
5.102053194780092

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dipotassium sulfite

> <JCHEM_LOGP>
-1.1546872626666664

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
8.916909462941165

> <JCHEM_PKA_STRONGEST_ACIDIC>
-3.6693460536121636

> <JCHEM_POLAR_SURFACE_AREA>
63.19

> <JCHEM_REFRACTIVITY>
10.0845

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
dipotassium sulfite

> <JCHEM_VEBER_RULE>
0

> <FOODB_ID>
FDB015405

> <GENERIC_NAME>
Potassium sulfite (K2SO3)

$$$$