
 CHEMBL3753240

 57 61  0  0  0  0  0  0  0  0999 V2000
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    5.7854    8.7868   -0.3757 O   0  0  0  0  0
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    7.2789   -4.2967   -0.0037 H   0  0  0  0  0
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    2.5476   -3.7091    3.4701 H   0  0  0  0  0
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    4.9531    8.7752    1.5782 H   0  0  0  0  0
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    6.8965    7.3335    2.4499 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL3753240

>  <PubChem CID>
57385591

>  <Formula>
C28H26N2O

>  <Molecular Weight>
406.529000

>  <IUPAC Name>
(1R)-1-naphthalen-1-yl-N-[(5-phenylmethoxy-1H-indol-2-yl)methyl]ethanamine

>  <XlogP>
6.1

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CC(C1=CC=CC2=CC=CC=C21)NCC3=CC4=C(N3)C=CC(=C4)OCC5=CC=CC=C5

>  <Isomeric SMILES>
C[C@H](C1=CC=CC2=CC=CC=C21)NCC3=CC4=C(N3)C=CC(=C4)OCC5=CC=CC=C5

>  <InChI Std. ID>
InChI=1S/C28H26N2O/c1-20(26-13-7-11-22-10-5-6-12-27(22)26)29-18-24-16-23-17-25(14-15-28(23)30-24)31-19-21-8-3-2-4-9-21/h2-17,20,29-30H,18-19H2,1H3/t20-/m1/s1

>  <InChI Key>
ALQXJYXDVNQDJH-HXUWFJFHSA-N

