
 CHEMBL60459

 55 58  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL60459

>  <PubChem CID>
44301695

>  <Formula>
C23H27FN2O2

>  <Molecular Weight>
382.479000

>  <IUPAC Name>
1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-[(2-methylphenoxy)methyl]piperidin-4-ol

>  <XlogP>
4.2

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1=CC=CC=C1OCC2(CCN(CC2)CCC3=CNC4=C3C=C(C=C4)F)O

>  <Isomeric SMILES>
CC1=CC=CC=C1OCC2(CCN(CC2)CCC3=CNC4=C3C=C(C=C4)F)O

>  <InChI Std. ID>
InChI=1S/C23H27FN2O2/c1-17-4-2-3-5-22(17)28-16-23(27)9-12-26(13-10-23)11-8-18-15-25-21-7-6-19(24)14-20(18)21/h2-7,14-15,25,27H,8-13,16H2,1H3

>  <InChI Key>
FNERFHNEKHXCAW-UHFFFAOYSA-N

