
 CHEMBL1092499

 45 47  0  0  0  0  0  0  0  0999 V2000
   -1.0853    4.1707    1.2956 C   0  0  0  0  0
   -0.3580    3.0118    1.9197 C   0  0  0  0  0
    0.8803    2.5757    1.4124 C   0  0  0  0  0
    1.5238    1.4715    1.9806 C   0  0  0  0  0
    0.9429    0.8089    3.0652 C   0  0  0  0  0
   -0.2786    1.2417    3.5625 C   0  0  0  0  0
   -0.9366    2.3279    2.9986 C   0  0  0  0  0
   -0.8363    0.5975    4.5963 F   0  0  0  0  0
    1.3720    3.2874    0.3449 O   0  0  0  0  0
    2.7556    3.1429   -0.0429 C   0  0  0  0  0
    3.2681    4.2713   -0.9576 C   0  0  0  0  0
    4.4914    4.3018   -0.1477 N   0  0  0  0  0
    3.8434    3.5654    0.9532 C   0  0  0  0  0
    5.2703    5.4237    0.1058 C   0  0  0  0  0
    5.4894    5.7373    1.2767 O   0  0  0  0  0
    5.7536    6.1259   -1.0083 N   0  0  0  0  0
    5.6274    5.5926   -2.3647 C   0  0  0  0  0
    6.5216    7.3457   -0.8675 C   0  0  0  0  0
    7.1923    7.7151    0.3033 C   0  0  0  0  0
    8.0044    8.8001    0.4339 N   0  0  0  0  0
    8.1492    9.5842   -0.6476 C   0  0  0  0  0
    7.4901    9.3589   -1.8405 C   0  0  0  0  0
    6.6744    8.2300   -1.9464 C   0  0  0  0  0
    8.9987   10.6706   -0.6059 O   0  0  0  0  0
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    1.4332   -0.0459    3.5200 H   0  0  0  0  0
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    2.7012    5.2054   -0.9209 H   0  0  0  0  0
    3.4150    3.9580   -1.9941 H   0  0  0  0  0
    4.4654    2.7517    1.3361 H   0  0  0  0  0
    3.5026    4.2012    1.7746 H   0  0  0  0  0
    5.5618    4.5026   -2.3565 H   0  0  0  0  0
    6.5134    5.8278   -2.9637 H   0  0  0  0  0
    4.7329    6.0160   -2.8329 H   0  0  0  0  0
    7.1663    7.1175    1.2080 H   0  0  0  0  0
    7.6221   10.0354   -2.6781 H   0  0  0  0  0
    6.1589    8.0722   -2.8894 H   0  0  0  0  0
   10.5607   11.4776    0.4358 H   0  0  0  0  0
   10.4195    9.7270    0.6051 H   0  0  0  0  0
    9.2704   10.8290    1.4567 H   0  0  0  0  0
  1  2  1  0  0  0
  1 26  1  0  0  0
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  1 28  1  0  0  0
  2  3  2  0  0  0
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  9 10  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL1092499

>  <PubChem CID>
46881861

>  <Formula>
C18H20FN3O3

>  <Molecular Weight>
345.374000

>  <IUPAC Name>
3-(4-fluoro-2-methylphenoxy)-N-(6-methoxypyridin-3-yl)-N-methylazetidine-1-carboxamide

>  <XlogP>
2.5

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1=C(C=CC(=C1)F)OC2CN(C2)C(=O)N(C)C3=CN=C(C=C3)OC

>  <Isomeric SMILES>
CC1=C(C=CC(=C1)F)OC2CN(C2)C(=O)N(C)C3=CN=C(C=C3)OC

>  <InChI Std. ID>
InChI=1S/C18H20FN3O3/c1-12-8-13(19)4-6-16(12)25-15-10-22(11-15)18(23)21(2)14-5-7-17(24-3)20-9-14/h4-9,15H,10-11H2,1-3H3

>  <InChI Key>
AHFWVQQNXZZLQH-UHFFFAOYSA-N

