Mrv1718002161817302D          

  9  6  0  0  0  0            999 V2000
   -1.1197    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7072   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7072    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9447    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.3573    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7698    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7698   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5322    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.7698    0.0000    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
M  CHG  3   4  -1   8  -1   9   2
M  END
> <DATABASE_ID>
DB13996

> <DATABASE_NAME>
drugbank

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

> <INCHI_IDENTIFIER>
InChI=1S/2C2H4O2.Mg/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2

> <INCHI_KEY>
UEGPKNKPLBYCNK-UHFFFAOYSA-L

> <FORMULA>
C4H6MgO4

> <MOLECULAR_WEIGHT>
142.393

> <EXACT_MASS>
142.01165037

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
15

> <JCHEM_AVERAGE_POLARIZABILITY>
4.956734056404354

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
magnesium(2+) diacetate

> <ALOGPS_LOGP>
0.29

> <JCHEM_LOGP>
-0.2233457143333334

> <ALOGPS_LOGS>
-0.16

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.543439679000835

> <JCHEM_POLAR_SURFACE_AREA>
40.129999999999995

> <JCHEM_REFRACTIVITY>
23.480800000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
9.82e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
magnesium acetate

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB13996

> <SECONDARY_ACCESSION_NUMBERS>
DBSALT001426

> <DRUG_GROUPS>
approved

> <GENERIC_NAME>
Magnesium acetate

> <SYNONYMS>
acetato de magnesio; acetic acid magnesium salt; Acetic acid, magnesium salt (2:1); Magnesium di(acetate); magnesium diacetate; Mg(II) acetate

> <PRODUCTS>
Aminosyn; Aminosyn 3.5% M; FreAmine III; Hyperlyte (multi-electrolyte Concentrate); Lypholyte; Lypholyte Multi-electrolyte Conc Inj; Normosol-M & 5% Dextrose; Normosol-M and Dextrose; Nutrilyte; Plasma-lyte 56 5% Dextrose Inj; ProcalAmine

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