Mrv0541 02241205522D          

  5  2  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2393    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.6500    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.0625    0.0000 Cu  0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.6500    0.0000 Cl  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
M  END
> <DATABASE_ID>
DBSALT001851

> <DATABASE_NAME>
drugbank

> <SMILES>
O.O.Cl[Cu]Cl

> <INCHI_IDENTIFIER>
InChI=1S/2ClH.Cu.2H2O/h2*1H;;2*1H2/q;;+2;;/p-2

> <INCHI_KEY>
MPTQRFCYZCXJFQ-UHFFFAOYSA-L

> <FORMULA>
Cl2CuH4O2

> <MOLECULAR_WEIGHT>
170.483

> <EXACT_MASS>
168.888435865

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
9

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
0.0

> <JCHEM_AVERAGE_POLARIZABILITY>
7.265316990745099

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dichlorocopper dihydrate

> <ALOGPS_LOGP>
0.94

> <JCHEM_LOGP>
0.5189999999999999

> <ALOGPS_LOGS>
-0.48

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
12.2726

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.46e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
biotin

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DBSALT001851

> <NAME>
Cupric chloride dihydrate

> <DRUG_DRUGBANK_ID>
DB09131

> <DRUG_NAME>
Cupric Chloride

> <CAS_NUMBER>
10125-13-0

> <UNII>
S2QG84156O

$$$$