
 CHEMBL1783352

 56 59  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL1783352

>  <PubChem CID>
53304674

>  <Formula>
C24H26N6

>  <Molecular Weight>
398.514000

>  <IUPAC Name>
N-cyano-N'-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl]pyridine-4-carboximidamide

>  <XlogP>
3.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CN(CCN1CCCN=C(C2=CC=NC=C2)NC#N)C3=CC=CC4=CC=CC=C43

>  <Isomeric SMILES>
C1CN(CCN1CCCN=C(C2=CC=NC=C2)NC#N)C3=CC=CC4=CC=CC=C43

>  <InChI Std. ID>
InChI=1S/C24H26N6/c25-19-28-24(21-9-12-26-13-10-21)27-11-4-14-29-15-17-30(18-16-29)23-8-3-6-20-5-1-2-7-22(20)23/h1-3,5-10,12-13H,4,11,14-18H2,(H,27,28)

>  <InChI Key>
AAKZKXONERDTDD-UHFFFAOYSA-N

