Mrv1652306231722382D          

 19 19  0  0  0  0            999 V2000
    5.9004   -2.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0902   -2.4428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8202   -3.2223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5501   -1.8191    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7400   -1.9750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1999   -1.3514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3898   -1.5073    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8497   -0.8837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1197   -0.1041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0396   -1.0396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4995   -0.4159    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3225   -0.4863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6435    0.2737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0198    0.8138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6866    0.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4466    0.7085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8202   -1.0396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2801   -0.4159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6303   -0.8837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  2  0  0  0  0
  4 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
M  END
> <DATABASE_ID>
DB13247

> <DATABASE_NAME>
drugbank

> <SMILES>
CC(C)N(CCNC(=O)CN1CCCC1=O)C(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C14H27N3O2/c1-11(2)17(12(3)4)9-7-15-13(18)10-16-8-5-6-14(16)19/h11-12H,5-10H2,1-4H3,(H,15,18)

> <INCHI_KEY>
ZULJGOSFKWFVRX-UHFFFAOYSA-N

> <FORMULA>
C14H27N3O2

> <MOLECULAR_WEIGHT>
269.389

> <EXACT_MASS>
269.210327121

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
46

> <JCHEM_AVERAGE_POLARIZABILITY>
30.803684490124745

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
N-{2-[bis(propan-2-yl)amino]ethyl}-2-(2-oxopyrrolidin-1-yl)acetamide

> <ALOGPS_LOGP>
1.17

> <JCHEM_LOGP>
0.10419400866666628

> <ALOGPS_LOGS>
-1.70

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.849032630218588

> <JCHEM_PKA_STRONGEST_BASIC>
9.605961268594719

> <JCHEM_POLAR_SURFACE_AREA>
52.650000000000006

> <JCHEM_REFRACTIVITY>
76.31200000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
5.31e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
pramiracetam

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB13247

> <DRUG_GROUPS>
approved

> <GENERIC_NAME>
Pramiracetam

> <SYNONYMS>
Pramiracetam

> <SALTS>
Pramiracetam sulfate

$$$$