Mrv2304 05032316232D          

  9  8  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.5047    0.6164    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7696    0.2419    0.0000 Te  0  5  0  0  0  0  0  0  0  0  0  0
    2.7696    1.0669    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0346    0.6164    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.4371   -0.2431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1821   -1.0277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3571   -1.0277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1022   -0.2431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  3  9  1  0  0  0  0
M  CHG  2   1   1   3  -1
M  END
> <DATABASE_ID>
DB17740

> <DATABASE_NAME>
drugbank

> <SMILES>
[NH4+].Cl[Te-]1(Cl)(Cl)OCCO1

> <INCHI_IDENTIFIER>
InChI=1S/C2H4Cl3O2Te.H3N/c3-8(4,5)6-1-2-7-8;/h1-2H2;1H3/q-1;/p+1

> <INCHI_KEY>
AXWLPMGUUAIGJK-UHFFFAOYSA-O

> <FORMULA>
C2H8Cl3NO2Te

> <MOLECULAR_WEIGHT>
312.04

> <EXACT_MASS>
312.8682844

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
17

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
5.2047314413114635e-05

> <JCHEM_AVERAGE_POLARIZABILITY>
15.79933360642902

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
ammonium 2,2,2-trichloro-1,3,2lambda4-dioxatellurolan-2-uide

> <JCHEM_LOGP>
2.1090999999999998

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
18.46

> <JCHEM_REFRACTIVITY>
30.533700000000003

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
ammonium 2,2,2-trichloro-1,3,2lambda4-dioxatellurolan-2-uide

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DB17740

> <DRUG_GROUPS>
investigational

> <GENERIC_NAME>
Ammonium trichlorotellurate

> <SYNONYMS>
Ammonium trichloro [dioxoethylene-O,O') tellurium (IV); Ammonium trichloro(dioxyethylene-o,o')tellurium(iv); Ammonium trichlorotellurate; Ossirene

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