
 CHEMBL2325928

 54 58  0  0  0  0  0  0  0  0999 V2000
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    0.4128   -1.9876   -3.0423 H   0  0  0  0  0
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    3.9127   -2.9942   -4.1439 H   0  0  0  0  0
    3.5132   -0.7755   -5.0813 H   0  0  0  0  0
    1.8975   -0.7206   -4.4014 H   0  0  0  0  0
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    9.1442    1.1563   -2.3917 H   0  0  0  0  0
    4.3942    4.7189   -4.3837 H   0  0  0  0  0
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    3.6256    7.0359   -4.7959 H   0  0  0  0  0
    4.9972    8.1856   -4.7584 H   0  0  0  0  0
    3.8766    8.0723   -3.3580 H   0  0  0  0  0
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    9.5901   -0.4505   -3.8155 H   0  0  0  0  0
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  3 34  1  0  0  0
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  5  6  1  0  0  0
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  5 37  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL2325928

>  <PubChem CID>
71508683

>  <Formula>
C24H25FN4

>  <Molecular Weight>
388.490000

>  <IUPAC Name>
1-(4-fluorophenyl)-3-(1-methylpiperidin-4-yl)-5-(1-methylpyrazol-4-yl)indole

>  <XlogP>
4.3

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CN1CCC(CC1)C2=CN(C3=C2C=C(C=C3)C4=CN(N=C4)C)C5=CC=C(C=C5)F

>  <Isomeric SMILES>
CN1CCC(CC1)C2=CN(C3=C2C=C(C=C3)C4=CN(N=C4)C)C5=CC=C(C=C5)F

>  <InChI Std. ID>
InChI=1S/C24H25FN4/c1-27-11-9-17(10-12-27)23-16-29(21-6-4-20(25)5-7-21)24-8-3-18(13-22(23)24)19-14-26-28(2)15-19/h3-8,13-17H,9-12H2,1-2H3

>  <InChI Key>
BVLYMIHOEUYZBL-UHFFFAOYSA-N

