Mrv1718007031811552D          

 11  8  0  0  0  0            999 V2000
   -0.6837    0.7697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0307   -0.4677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7451    0.7697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4596   -0.4677    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.3982   -0.4677    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.6837   -0.0552    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0962   -0.7697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7451   -0.0552    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
    0.3326   -0.7697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8643    0.2090    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    1.8643    0.1598    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  6  5  1  0  0  0  0
  6  2  1  0  0  0  0
  8  3  2  0  0  0  0
  8  2  1  0  0  0  0
  8  4  1  0  0  0  0
  6  7  2  0  0  0  0
  8  9  2  0  0  0  0
M  CHG  4   4  -1   5  -1  10   1  11   1
M  END
> <DATABASE_ID>
DBSALT002757

> <DATABASE_NAME>
drugbank

> <SMILES>
[K+].[K+].[O-][Cr](=O)(=O)O[Cr]([O-])(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/2Cr.2K.7O/q;;2*+1;;;;;;2*-1

> <INCHI_KEY>
KMUONIBRACKNSN-UHFFFAOYSA-N

> <FORMULA>
Cr2K2O7

> <MOLECULAR_WEIGHT>
294.182

> <EXACT_MASS>
293.772827

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
11.066130658685811

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dipotassium [(oxidodioxochromio)oxy]chromiumoylolate

> <ALOGPS_LOGP>
-0.61

> <JCHEM_LOGP>
-3.7067999999999994

> <ALOGPS_LOGS>
-1.39

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
-1.6989700043360187

> <JCHEM_PKA_STRONGEST_ACIDIC>
-2.3010299956639813

> <JCHEM_POLAR_SURFACE_AREA>
123.63

> <JCHEM_REFRACTIVITY>
10.0076

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.20e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
potassium dichromate

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DBSALT002757

> <SECONDARY_ACCESSION_NUMBERS>
DB11212

> <NAME>
Potassium dichromate

> <DRUG_DRUGBANK_ID>
DB14182

> <DRUG_NAME>
Dichromate

> <CAS_NUMBER>
7778-50-9

> <UNII>
T4423S18FM

$$$$