
 CHEMBL2326175

 53 57  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL2326175

>  <PubChem CID>
71508712

>  <Formula>
C23H24FN5

>  <Molecular Weight>
389.478000

>  <IUPAC Name>
1-(4-fluorophenyl)-3-(1-methylpiperidin-4-yl)-5-(1-methyl-1,2,4-triazol-3-yl)indole

>  <XlogP>
4.1

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CN1CCC(CC1)C2=CN(C3=C2C=C(C=C3)C4=NN(C=N4)C)C5=CC=C(C=C5)F

>  <Isomeric SMILES>
CN1CCC(CC1)C2=CN(C3=C2C=C(C=C3)C4=NN(C=N4)C)C5=CC=C(C=C5)F

>  <InChI Std. ID>
InChI=1S/C23H24FN5/c1-27-11-9-16(10-12-27)21-14-29(19-6-4-18(24)5-7-19)22-8-3-17(13-20(21)22)23-25-15-28(2)26-23/h3-8,13-16H,9-12H2,1-2H3

>  <InChI Key>
QHNXJRSEHMJHRM-UHFFFAOYSA-N

