Mrv0541 02241203522D          

  1  0  0  0  0  0            999 V2000
   19.5814  -17.2259    0.0000 I   0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  1   1  -1
M  END
> <DATABASE_ID>
DB12754

> <DATABASE_NAME>
drugbank

> <SMILES>
[I-]

> <INCHI_IDENTIFIER>
InChI=1S/HI/h1H/p-1

> <INCHI_KEY>
XMBWDFGMSWQBCA-UHFFFAOYSA-M

> <FORMULA>
I

> <MOLECULAR_WEIGHT>
126.9045

> <EXACT_MASS>
126.90446842

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
1

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-1.0

> <JCHEM_AVERAGE_POLARIZABILITY>
5.07487188

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
-1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
iodide

> <JCHEM_LOGP>
1.02055578

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
-1

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
-8.999999999999998

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
13.9462

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
biotin

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DB12754

> <DRUG_GROUPS>
approved; experimental

> <GENERIC_NAME>
Iodide

> <SYNONYMS>
Iodide ion

$$$$