Mrv1718006281815392D          

  5  3  0  0  0  0            999 V2000
   -0.9134    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7384    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
   -0.5009    0.7145    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.5009   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7384    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  1  5  2  0  0  0  0
M  CHG  2   2   1   3  -1
M  END
> <DATABASE_ID>
DBSALT002747

> <DATABASE_NAME>
drugbank

> <SMILES>
[Na+].[O-][Cl](=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/ClHO3.Na/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1

> <INCHI_KEY>
YZHUMGUJCQRKBT-UHFFFAOYSA-M

> <FORMULA>
ClNaO3

> <MOLECULAR_WEIGHT>
106.44

> <EXACT_MASS>
105.9433658

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
5

> <JCHEM_AVERAGE_POLARIZABILITY>
4.565604727528822

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
sodium chlorate

> <ALOGPS_LOGP>
-0.97

> <JCHEM_LOGP>
0.040962167666666695

> <ALOGPS_LOGS>
0.66

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.6223785013074545

> <JCHEM_POLAR_SURFACE_AREA>
57.199999999999996

> <JCHEM_REFRACTIVITY>
10.465

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.88e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
sodium chlorate

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DBSALT002747

> <NAME>
Sodium chlorate

> <DRUG_DRUGBANK_ID>
DB14150

> <DRUG_NAME>
Chloric acid

> <CAS_NUMBER>
7775-09-9

> <UNII>
T95DR77GMR

$$$$