Mrv1652305301723402D          

  7  6  0  0  0  0            999 V2000
    6.9903   -5.6602    0.0000 Co  0  7  0  0  0  0  0  0  0  0  0  0
    6.9903   -4.6257    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.9903   -6.5987    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.7366   -5.3129    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.3253   -5.2982    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.7440   -6.0001    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.3179   -5.9410    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
M  CHG  7   1  -3   2   1   3   1   4   1   5   1   6   1   7   1
M  END
> <DATABASE_ID>
DB03350

> <DATABASE_NAME>
drugbank

> <SMILES>
[NH3+][Co-3]([NH3+])([NH3+])([NH3+])([NH3+])[NH3+]

> <INCHI_IDENTIFIER>
InChI=1S/Co.6H3N/h;6*1H3/q+3;;;;;;

> <INCHI_KEY>
DYLMFCCYOUSRTK-UHFFFAOYSA-N

> <FORMULA>
CoH18N6

> <MOLECULAR_WEIGHT>
161.118

> <EXACT_MASS>
161.090843

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
25

> <JCHEM_AVERAGE_POLARIZABILITY>
13.866349928291797

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
3

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
hexaazaniumylcobalttriuide

> <JCHEM_LOGP>
-2.4328

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_BASIC>
9.925238580256107

> <JCHEM_POLAR_SURFACE_AREA>
165.83999999999997

> <JCHEM_REFRACTIVITY>
93.0894

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
hexaamminecobalt(3+)

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB03350

> <SECONDARY_ACCESSION_NUMBERS>
EXPT02313

> <DRUG_GROUPS>
experimental

> <GENERIC_NAME>
Cobalt hexammine ion

> <SYNONYMS>
Cobalt Hexammine(III); hexaamminecobalt(3+)

$$$$