
 CHEMBL2387636

 77 81  0  0  0  0  0  0  0  0999 V2000
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    7.0840    3.7863    1.3233 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL2387636

>  <PubChem CID>
71660217

>  <Formula>
C32H40N4O

>  <Molecular Weight>
496.699000

>  <IUPAC Name>
N-[7-[2-(4-phenylpiperazin-1-yl)ethyl-propylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]benzamide

>  <XlogP>
6.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCCN(CCN1CCN(CC1)C2=CC=CC=C2)C3CCC4=C(C3)C=C(C=C4)NC(=O)C5=CC=CC=C5

>  <Isomeric SMILES>
CCCN(CCN1CCN(CC1)C2=CC=CC=C2)C3CCC4=C(C3)C=C(C=C4)NC(=O)C5=CC=CC=C5

>  <InChI Std. ID>
InChI=1S/C32H40N4O/c1-2-17-35(21-18-34-19-22-36(23-20-34)30-11-7-4-8-12-30)31-16-14-26-13-15-29(24-28(26)25-31)33-32(37)27-9-5-3-6-10-27/h3-13,15,24,31H,2,14,16-23,25H2,1H3,(H,33,37)

>  <InChI Key>
BHBAIXGPPLACOR-UHFFFAOYSA-N

