Mrv1909 11232018582D          

  5  3  0  0  0  0            999 V2000
   -0.9503   -0.1869    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9639    0.7513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5520   -0.7513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1343   -0.1869    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5520   -0.1360    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
M  CHG  2   4  -1   5   1
M  END
> <DATABASE_ID>
DB15923

> <DATABASE_NAME>
drugbank

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

> <INCHI_IDENTIFIER>
InChI=1S/HIO3.K/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1

> <INCHI_KEY>
JLKDVMWYMMLWTI-UHFFFAOYSA-M

> <FORMULA>
IKO3

> <MOLECULAR_WEIGHT>
214.0

> <EXACT_MASS>
213.85292

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
5

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-0.12462572651417253

> <JCHEM_AVERAGE_POLARIZABILITY>
7.85179374753421

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
potassium iodate

> <JCHEM_LOGP>
0.17827241766666668

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
-1

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
0.8465860758384406

> <JCHEM_POLAR_SURFACE_AREA>
57.2

> <JCHEM_REFRACTIVITY>
17.669500000000003

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
potassium iodate

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB15923

> <DRUG_GROUPS>
experimental

> <GENERIC_NAME>
Potassium iodate

> <SYNONYMS>
Iodic acid, potassium salt

$$$$