Mrv1718002161810512D          

  9  4  0  0  0  0            999 V2000
   -1.1785    2.0625    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0
   -1.1785    1.2375    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.1785   -0.4125    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.0035    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3535    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1785    0.4125    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.0035    0.6875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1785   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1785   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  2  1  0  0  0  0
  6  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  2  0  0  0  0
M  CHG  3   1   2   2  -1   3  -1
M  END
> <DATABASE_ID>
DBSALT002646

> <DATABASE_NAME>
drugbank

> <SMILES>
O.O.O.[Mg++].OP([O-])([O-])=O

> <INCHI_IDENTIFIER>
InChI=1S/Mg.H3O4P.3H2O/c;1-5(2,3)4;;;/h;(H3,1,2,3,4);3*1H2/q+2;;;;/p-2

> <INCHI_KEY>
OKIWLDVQGKRUNR-UHFFFAOYSA-L

> <FORMULA>
H7MgO7P

> <MOLECULAR_WEIGHT>
174.33

> <EXACT_MASS>
173.977980988

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
16

> <JCHEM_AVERAGE_POLARIZABILITY>
5.2416041624152285

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
magnesium(2+) trihydrate hydrogen phosphate

> <JCHEM_LOGP>
-1.0201038226666665

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.951626889535468

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.7961261340181292

> <JCHEM_POLAR_SURFACE_AREA>
83.41999999999999

> <JCHEM_REFRACTIVITY>
12.4085

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
magnesium(2+) trihydrate hydrogen phosphate

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DBSALT002646

> <NAME>
Magnesium phosphate dibasic trihydrate

> <DRUG_DRUGBANK_ID>
DB13862

> <DRUG_NAME>
Magnesium phosphate

> <CAS_NUMBER>
7782-75-4

> <UNII>
HF539G9L3Q

$$$$