Mrv1909 12041923282D          

 11 11  0  0  0  0            999 V2000
   -0.3572   -1.2374    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0716   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0716    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3572    0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717   -1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7861    0.4125    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  6  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  3 11  1  0  0  0  0
M  END
> <DATABASE_ID>
DB12466

> <DATABASE_NAME>
drugbank

> <SMILES>
NC(=O)C1=NC(F)=CN=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C5H4FN3O2/c6-2-1-8-5(11)3(9-2)4(7)10/h1H,(H2,7,10)(H,8,11)

> <INCHI_KEY>
ZCGNOVWYSGBHAU-UHFFFAOYSA-N

> <FORMULA>
C5H4FN3O2

> <MOLECULAR_WEIGHT>
157.104

> <EXACT_MASS>
157.028754544

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
15

> <JCHEM_AVERAGE_POLARIZABILITY>
12.123878906367722

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
6-fluoro-3-hydroxypyrazine-2-carboxamide

> <ALOGPS_LOGP>
0.49

> <JCHEM_LOGP>
0.25191639600000004

> <ALOGPS_LOGS>
-1.26

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
13.579307723139335

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.39401731404919

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6791532864267253

> <JCHEM_POLAR_SURFACE_AREA>
89.1

> <JCHEM_REFRACTIVITY>
33.9761

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
8.70e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[(2R,3S,4R,5R)-5-(4-amino-5-methyl-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxyphosphonic acid

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB12466

> <SECONDARY_ACCESSION_NUMBERS>
DB06046; DB15625

> <DRUG_GROUPS>
approved; investigational

> <GENERIC_NAME>
Favipiravir

> <SYNONYMS>
Fapilavir; Favilavir; Favipiravir

> <INTERNATIONAL_BRANDS>
Avigan

$$$$