944
  -OEChem-12102014443D

  5  4  0     0  0  0  0  0  0999 V2000
   -0.0416   -1.3017    0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1005    0.6377    0.0001 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.1387    0.5685    0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0034    0.0956   -0.0004 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9095   -1.5016    0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
  3  4  2  0  0  0  0
M  CHG  2   2  -1   4   1
M  END
> <DATABASE_ID>
DB15995

> <DATABASE_NAME>
drugbank

> <ORIGINAL_SOURCE>
PUBCHEM

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

> <SMILES>
O[N+]([O-])=O

> <INCHI_IDENTIFIER>
InChI=1S/HNO3/c2-1(3)4/h(H,2,3,4)

> <INCHI_KEY>
GRYLNZFGIOXLOG-UHFFFAOYSA-N

> <FORMULA>
HNO3

> <MOLECULAR_WEIGHT>
63.012

> <EXACT_MASS>
62.995642896

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
5

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
0.0

> <JCHEM_AVERAGE_POLARIZABILITY>
3.6022100472692586

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
nitric acid

> <JCHEM_LOGP>
-0.19802315000000004

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
-1

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_BASIC>
-9.93762264919614

> <JCHEM_POLAR_SURFACE_AREA>
63.370000000000005

> <JCHEM_REFRACTIVITY>
9.4688

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
L-arginine; L-aspartic acid

> <JCHEM_VEBER_RULE>
0

$$$$