-ISIS-  08091621332D

 17 18  0  0  0  0  0  0  0  0999 V2000
    0.0792    1.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7875    0.5917    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    0.0917    2.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6458    1.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6458    2.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7708    2.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5167   -2.7333    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9292   -2.4083    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    1.8417   -1.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9417    0.5667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0167   -3.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0417   -3.3958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7958   -0.4083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0667   -0.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7708    3.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0667   -1.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5208    0.6042    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  6  1  0  0  0  0
  6  3  2  0  0  0  0
  7  9  2  0  0  0  0
  8 16  1  0  0  0  0
  9  8  1  0  0  0  0
 10  1  2  0  0  0  0
 11 12  2  0  0  0  0
 12  8  1  0  0  0  0
 13  2  1  0  0  0  0
 14 13  1  0  0  0  0
 15  6  1  0  0  0  0
 16 14  1  0  0  0  0
 17  4  1  0  0  0  0
  5  4  2  0  0  0  0
 11  7  1  0  0  0  0
M  END
>  <ID> (BBL003347)
BBL003347

>  <Rotatable_Bonds> (BBL003347)
5

>  <logP> (BBL003347)
0.411

>  <PSA> (BBL003347)
58.36

>  <H_Donors> (BBL003347)
1

>  <H_Acceptors> (BBL003347)
2

>  <Number_of_rings> (BBL003347)
2

>  <NAME> (BBL003347)
4-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-6-methylpyridin-2(1H)-one

>  <Mol_Weight> (BBL003347)
233.27

>  <Mol_Formula> (BBL003347)
C12H15N3O2

>  <Smiles> (BBL003347)
Oc1cc(C)n(c(=O)c1)CCCn1cncc1

>  <Alternative_identifier> (BBL003347)
MFCD06405476

$$$$