Mrv1718001201810222D          

  3  0  0  0  0  0            999 V2000
    0.0000   -0.2500    0.0000 Cu  0  2  0  0  0  0  0  0  0  0  0  0
    0.8660    0.2500    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
   -0.8660    0.2500    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  3   1   2   2  -1   3  -1
M  ISO  1   1  64
M  END
> <DATABASE_ID>
DBSALT002631

> <DATABASE_NAME>
drugbank

> <SMILES>
[Cl-].[Cl-].[64Cu++]

> <INCHI_IDENTIFIER>
InChI=1S/2ClH.Cu/h2*1H;/q;;+2/p-2/i;;1+0

> <INCHI_KEY>
ORTQZVOHEJQUHG-OUMJLSBWSA-L

> <FORMULA>
Cl2Cu

> <MOLECULAR_WEIGHT>
134.83

> <EXACT_MASS>
133.8674733

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(64Cu)copper(2+) dichloride

> <ALOGPS_LOGP>
0.94

> <JCHEM_LOGP>
0.156

> <ALOGPS_LOGS>
-0.48

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA>
3.55

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.09

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.46e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(64Cu)copper(2+) dichloride

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DBSALT002631

> <NAME>
Cupric chloride anhydrous Cu-64

> <DRUG_DRUGBANK_ID>
DB13980

> <DRUG_NAME>
Copper Cu-64

> <CAS_NUMBER>
35121-64-3

> <UNII>
3IGV2Y2378

$$$$