
 CHEMBL15961

 66 70  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL15961

>  <PubChem CID>
10412190

>  <Formula>
C26H32FN5O2

>  <Molecular Weight>
465.573000

>  <IUPAC Name>
4-(4-fluoro-1H-indol-3-yl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]piperidine-1-carboxamide

>  <XlogP>
3.5

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)N3CCC(CC3)C4=CNC5=C4C(=CC=C5)F)OC

>  <Isomeric SMILES>
CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)N3CCC(CC3)C4=CNC5=C4C(=CC=C5)F)OC

>  <InChI Std. ID>
InChI=1S/C26H32FN5O2/c1-30-12-14-31(15-13-30)23-16-19(6-7-24(23)34-2)29-26(33)32-10-8-18(9-11-32)20-17-28-22-5-3-4-21(27)25(20)22/h3-7,16-18,28H,8-15H2,1-2H3,(H,29,33)

>  <InChI Key>
GFTOBRDTIUVBRH-UHFFFAOYSA-N

