
 SCHEMBL2192314

 25 27  0  0  0  0  0  0  0  0999 V2000
   -0.4983   -1.2842   -0.4571 C   0  0  0  0  0
    0.8902   -1.2109   -0.3101 C   0  0  0  0  0
    1.4656   -0.0877    0.2698 C   0  0  0  0  0
    0.6793    0.9731    0.6981 C   0  0  0  0  0
   -0.7094    0.9110    0.5519 C   0  0  0  0  0
   -1.3089   -0.2275   -0.0138 C   0  0  0  0  0
   -2.7210   -0.2873   -0.1581 N   0  0  0  0  0
   -3.5926    0.7934   -0.2181 C   0  0  0  0  0
   -4.8481    0.4403   -0.4244 N   0  0  0  0  0
   -4.7983   -0.9070   -0.4681 C   0  0  0  0  0
   -3.5334   -1.3996   -0.2770 C   0  0  0  0  0
   -3.3081   -2.7607   -0.1691 N   0  0  0  0  0
   -4.3983   -3.6823   -0.3149 C   0  0  0  0  0
   -4.1644   -4.8708   -0.2143 O   0  0  0  0  0
   -5.7401   -3.0956   -0.5657 C   0  0  0  0  0
   -5.9077   -1.7642   -0.6264 C   0  0  0  0  0
    2.7953   -0.0235    0.4070 F   0  0  0  0  0
   -0.8961   -2.1459   -0.9829 H   0  0  0  0  0
    1.5323   -2.0140   -0.6615 H   0  0  0  0  0
    1.1535    1.8423    1.1459 H   0  0  0  0  0
   -1.2895    1.7539    0.9207 H   0  0  0  0  0
   -3.2542    1.8200   -0.1517 H   0  0  0  0  0
   -2.4074   -3.1502    0.0699 H   0  0  0  0  0
   -6.5601   -3.7932   -0.6788 H   0  0  0  0  0
   -6.8876   -1.3285   -0.7946 H   0  0  0  0  0
  1  6  1  0  0  0
  1  2  2  0  0  0
  1 18  1  0  0  0
  2  3  1  0  0  0
  2 19  1  0  0  0
  3  4  2  0  0  0
  3 17  1  0  0  0
  4  5  1  0  0  0
  4 20  1  0  0  0
  5  6  2  0  0  0
  5 21  1  0  0  0
  6  7  1  0  0  0
  7  8  1  0  0  0
  7 11  1  0  0  0
  8  9  2  0  0  0
  8 22  1  0  0  0
  9 10  1  0  0  0
 10 16  1  0  0  0
 10 11  2  0  0  0
 11 12  1  0  0  0
 12 13  1  0  0  0
 12 23  1  0  0  0
 13 15  1  0  0  0
 13 14  2  0  0  0
 15 16  2  0  0  0
 15 24  1  0  0  0
 16 25  1  0  0  0
M  END

>  <Chemical Name>
SCHEMBL2192314

>  <PubChem CID>
58345770

>  <Formula>
C12H8FN3O

>  <Molecular Weight>
229.214000

>  <IUPAC Name>
3-(4-fluorophenyl)-4H-imidazo[4,5-b]pyridin-5-one

>  <XlogP>
1.6

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1=CC(=CC=C1N2C=NC3=C2NC(=O)C=C3)F

>  <Isomeric SMILES>
C1=CC(=CC=C1N2C=NC3=C2NC(=O)C=C3)F

>  <InChI Std. ID>
InChI=1S/C12H8FN3O/c13-8-1-3-9(4-2-8)16-7-14-10-5-6-11(17)15-12(10)16/h1-7H,(H,15,17)

>  <InChI Key>
GRPYPKSUYUVNPX-UHFFFAOYSA-N

