Mrv1652306231722462D          

 18  8  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
    3.3000    0.0000    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
    6.6000    0.0000    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
    1.7679   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5929   -1.6500    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    3.4179   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1857   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0107   -1.6500    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    6.8357   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.3000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5929   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4179   -3.3000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    4.2429   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    0.0000    0.0000 Al  0  1  0  0  0  0  0  0  0  0  0  0
    5.7750    0.0000    0.0000 Al  0  1  0  0  0  0  0  0  0  0  0  0
  5  6  2  0  0  0  0
  6  7  2  0  0  0  0
  8  9  2  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 12 13  2  0  0  0  0
 14 15  2  0  0  0  0
 15 16  2  0  0  0  0
M  CHG  5   2  -2   3  -2   4  -2  17   3  18   3
M  END
> <DATABASE_ID>
DB13654

> <DATABASE_NAME>
drugbank

> <SMILES>
O.[O--].[O--].[O--].[Al+3].[Al+3].O=[Si]=O.O=[Si]=O.O=[Si]=O.O=[Si]=O

> <INCHI_IDENTIFIER>
InChI=1S/2Al.4O2Si.H2O.3O/c;;4*1-3-2;;;;/h;;;;;;1H2;;;/q2*+3;;;;;;3*-2

> <INCHI_KEY>
GUJOJGAPFQRJSV-UHFFFAOYSA-N

> <FORMULA>
Al2H2O12Si4

> <MOLECULAR_WEIGHT>
360.307

> <EXACT_MASS>
359.8254086

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
20

> <JCHEM_AVERAGE_POLARIZABILITY>
3.2811468900078617

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dialuminium(3+) ion tetrakis(silanedione) hydrate trioxidandiide

> <JCHEM_LOGP>
-0.6577999999999999

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-8.532702804224158

> <JCHEM_POLAR_SURFACE_AREA>
34.14

> <JCHEM_REFRACTIVITY>
2.8858

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
dialuminium(3+) ion tetrakis(silica) hydrate trioxidandiide

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DB13654

> <DRUG_GROUPS>
experimental; investigational

> <GENERIC_NAME>
Montmorillonite

> <SYNONYMS>
Diosmectite; Montmorillonite; Montmorrillonite

> <PRODUCTS>
Dr. SEED Teatree and Lime Vegan No-sebum Cool Anti HairlossShampoo

$$$$