Mrv1909 01292016452D          

 10 10  0  0  0  0            999 V2000
    0.0114   -0.3963    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6559   -0.8814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6790   -0.8814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0114    0.4285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4010   -1.6660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4405   -0.6264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4239   -1.6660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7259    0.8410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7259    1.6660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4405    0.4285    0.0000 N   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
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
  5  7  1  0  0  0  0
M  END
> <DATABASE_ID>
DB09210

> <DATABASE_NAME>
drugbank

> <SMILES>
NC(=O)CN1CCCC1=O

> <INCHI_IDENTIFIER>
InChI=1S/C6H10N2O2/c7-5(9)4-8-3-1-2-6(8)10/h1-4H2,(H2,7,9)

> <INCHI_KEY>
GMZVRMREEHBGGF-UHFFFAOYSA-N

> <FORMULA>
C6H10N2O2

> <MOLECULAR_WEIGHT>
142.1558

> <EXACT_MASS>
142.074227574

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
20

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
0.010492983722142881

> <JCHEM_AVERAGE_POLARIZABILITY>
13.958479593517573

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-(2-oxopyrrolidin-1-yl)acetamide

> <ALOGPS_LOGP>
-1.58

> <JCHEM_LOGP>
-1.6848925380000002

> <ALOGPS_LOGS>
0.53

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.934726694050129

> <JCHEM_PKA_STRONGEST_BASIC>
-1.9726546753523186

> <JCHEM_POLAR_SURFACE_AREA>
63.400000000000006

> <JCHEM_REFRACTIVITY>
35.0614

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.79e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
fidaxomicin

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB09210

> <DRUG_GROUPS>
approved; investigational

> <GENERIC_NAME>
Piracetam

> <SYNONYMS>
Piracetam; Piracetamum

> <INTERNATIONAL_BRANDS>
Myocalm

$$$$