Mrv0541 02241205262D          

  6  3  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    1.0018    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.4125   -1.6500    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.3645    0.0000 Se  0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -3.0789    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8250   -2.3645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
M  CHG  4   1   1   2   1   3  -1   5  -1
M  END
> <DATABASE_ID>
T3D1839

> <DATABASE_NAME>
t3db

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

> <INCHI_IDENTIFIER>
InChI=1S/2Na.H2O3Se/c;;1-4(2)3/h;;(H2,1,2,3)/q2*+1;/p-2

> <INCHI_KEY>
BVTBRVFYZUCAKH-UHFFFAOYSA-L

> <FORMULA>
Na2O3Se

> <MOLECULAR_WEIGHT>
172.94

> <EXACT_MASS>
173.880805044

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
5.319366337913601

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
disodium selenite

> <JCHEM_LOGP>
-1.2765

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
16.85751541308702

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.928731587215967

> <JCHEM_POLAR_SURFACE_AREA>
63.19

> <JCHEM_REFRACTIVITY>
17.443600000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
disodium selenite

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D1839

> <NAME>
Sodium selenite

> <CAS>
10102-18-8

> <SYNONYMS>
Disodium selenite; Disodium selenium trioxide; H2-O3-Se.1/2Na; Natriumselenit; Selenious acid (H2seo3), disodium salt; Selenious acid, disodium salt; Sodium selenite pentahydrate; Sodium selenite, anhydr

> <TYPES>
Inorganic Compound; Selenium Compound; Pollutant; Industrial/Workplace Toxin; Synthetic Compound

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