-ISIS-  08091621332D

 18 19  0  0  0  0  0  0  0  0999 V2000
    1.4375   -1.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4250   -1.8125    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    1.5542   -0.7042    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
   -0.0208   -0.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6917   -0.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4292    0.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1417   -2.3542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9833   -0.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0333   -2.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4542   -0.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2333    0.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5458    1.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4583    1.5417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0708    2.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2083    0.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7500    2.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7833    2.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9042    2.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  2  0  0  0  0
  8  4  1  0  0  0  0
  9  2  1  0  0  0  0
 10  3  1  0  0  0  0
 11  8  2  0  0  0  0
 12  6  2  0  0  0  0
 13 15  1  0  0  0  0
 14 17  1  0  0  0  0
 15 11  1  0  0  0  0
 16 13  1  0  0  0  0
 17 16  1  0  0  0  0
 18 14  1  0  0  0  0
  5  4  2  0  0  0  0
 12 11  1  0  0  0  0
M  END
>  <ID> (BBL000335)
BBL000335

>  <Rotatable_Bonds> (BBL000335)
5

>  <logP> (BBL000335)
0.859

>  <PSA> (BBL000335)
44.81

>  <H_Donors> (BBL000335)
1

>  <H_Acceptors> (BBL000335)
2

>  <Number_of_rings> (BBL000335)
2

>  <NAME> (BBL000335)
5-{[(2-methoxyethyl)amino]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one

>  <Mol_Weight> (BBL000335)
249.31

>  <Mol_Formula> (BBL000335)
C13H19N3O2

>  <Smiles> (BBL000335)
COCCNCc1ccc2c(c1)n(C)c(=O)n2C

>  <Alternative_identifier> (BBL000335)
MFCD07434419

$$$$