
 CHEMBL517244

 82 87  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL517244

>  <PubChem CID>
25212276

>  <Formula>
C35H44N2O

>  <Molecular Weight>
508.750000

>  <IUPAC Name>


>  <XlogP>
7.8

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CN(CCCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24)CC5=CC=C(C=C5)OCCCN6CCCCC6

>  <Isomeric SMILES>
CN(CCCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24)CC5=CC=C(C=C5)OCCCN6CCCCC6

>  <InChI Std. ID>
InChI=1S/C35H44N2O/c1-36(27-28-15-17-29(18-16-28)38-26-10-25-37-23-7-2-8-24-37)22-9-20-35-21-19-30(31-11-3-5-13-33(31)35)32-12-4-6-14-34(32)35/h3-6,11-18,30H,2,7-10,19-27H2,1H3

>  <InChI Key>
AQQFXOLTZFTABW-UHFFFAOYSA-N

