119432
  -OEChem-10051722093D

  4  3  0     0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 N  -1  0  0  0  0  0  0  0  0  0  0  0
   -0.4417    0.2906    0.8711 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7256    0.6896   -0.1907 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4875   -0.8701    0.2089 H   0  0  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
M  ISO  1   1  13
M  END
> <DATABASE_ID>
DB09326

> <DATABASE_NAME>
drugbank

> <ORIGINAL_SOURCE>
PUBCHEM

> <ORIGINAL_SOURCE_URL>
https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/QGZKDVFQNNGYKY-BJUDXGSMSA-N/SDF?record_type=3d

> <SMILES>
[13NH3]

> <INCHI_IDENTIFIER>
InChI=1S/H3N/h1H3/i1-1

> <INCHI_KEY>
QGZKDVFQNNGYKY-BJUDXGSMSA-N

> <FORMULA>
H3N

> <MOLECULAR_WEIGHT>
16.03

> <EXACT_MASS>
16.029213681

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
1.9904529105652708

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(¹³N)ammonia

> <JCHEM_LOGP>
-0.9779999999999999

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
8.861981369487705

> <JCHEM_POLAR_SURFACE_AREA>
13.59

> <JCHEM_REFRACTIVITY>
15.5149

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(¹³N)ammonia

> <JCHEM_VEBER_RULE>
1

$$$$