Mrv0541 02241203532D          

  5  4  0  0  0  0            999 V2000
   11.9998  -14.6313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8248  -14.6313    0.0000 Mo  0  0  0  0  0  0  0  0  0  0  0  0
   12.8248  -15.4563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8248  -13.8063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6498  -14.6313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  2  1  0  0  0  0
  5  2  2  0  0  0  0
M  END
> <DATABASE_ID>
FDB028899

> <DATABASE_NAME>
foodb

> <SMILES>
O[Mo](O)(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/Mo.2H2O.2O/h;2*1H2;;/q+2;;;;/p-2

> <INCHI_KEY>
VLAPMBHFAWRUQP-UHFFFAOYSA-L

> <FORMULA>
H2MoO4

> <MOLECULAR_WEIGHT>
161.95

> <EXACT_MASS>
163.900716398

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
6.510685269472223

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dioxomolybdenumdiol

> <JCHEM_LOGP>
-1.7751999999999997

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
16.419463088170005

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.076221007282351

> <JCHEM_POLAR_SURFACE_AREA>
74.6

> <JCHEM_REFRACTIVITY>
8.015

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
molybdic acid

> <JCHEM_VEBER_RULE>
0

> <FOODB_ID>
FDB028899

> <GENERIC_NAME>
Molybdate

$$$$