Mrv1652306121717402D          

  2  1  0  0  0  0            999 V2000
   -0.4125    0.0000    0.0000 Tl  0  0  0  0  0  1  0  0  0  0  0  0
    0.4125    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
M  END
> <DATABASE_ID>
DB09316

> <DATABASE_NAME>
drugbank

> <SMILES>
Cl[Tl]

> <INCHI_IDENTIFIER>
InChI=1S/ClH.Tl/h1H;/q;+1/p-1

> <INCHI_KEY>
GBECUEIQVRDUKB-UHFFFAOYSA-M

> <FORMULA>
ClTl

> <MOLECULAR_WEIGHT>
239.83

> <EXACT_MASS>
239.943281

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
2

> <JCHEM_AVERAGE_POLARIZABILITY>
4.346510788320492

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
chlorothallane

> <ALOGPS_LOGP>
-0.55

> <JCHEM_LOGP>
0.5345

> <ALOGPS_LOGS>
-0.29

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
6.1363

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.23e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
thallous chloride

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DB09316

> <DRUG_GROUPS>
approved

> <GENERIC_NAME>
Thallous chloride

> <SYNONYMS>
Thallium chloride; thallium monochloride; Thallium(I) chloride

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