Mrv0541 02231219332D          

  1  0  0  0  0  0            999 V2000
   11.5108  -14.4400    0.0000 Br  0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  1   1  -1
M  END
> <DATABASE_ID>
DBMET00329

> <DATABASE_NAME>
drugbank

> <SMILES>
[Br-]

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

> <INCHI_KEY>
CPELXLSAUQHCOX-UHFFFAOYSA-M

> <FORMULA>
Br

> <MOLECULAR_WEIGHT>
79.904

> <EXACT_MASS>
78.918337647

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
1

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-0.999999999999999

> <JCHEM_AVERAGE_POLARIZABILITY>
3.35926422

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
-1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
bromide

> <JCHEM_LOGP>
0.7978339843333333

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
-1

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
-7.999999999999998

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
8.5991

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
biotin

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DBMET00329

> <NAME>
bromide

> <UNII>
952902IX06

$$$$