
 CHEMBL517157

 53 57  0  0  0  0  0  0  0  0999 V2000
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    2.3374    2.3435    4.5883 C   0  0  0  0  0
    2.4261    1.9929    5.9177 C   0  0  0  0  0
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    2.3844    2.9726    7.0377 C   0  0  0  0  0
    2.2404    4.2723    6.8681 N   0  0  0  0  0
    2.2856    4.7516    8.1544 C   0  0  0  0  0
    2.3999    3.8097    9.1007 N   0  0  0  0  0
    2.4805    2.6287    8.3620 O   0  0  0  0  0
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    3.5354    6.7849    8.3489 C   0  0  0  0  0
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    5.6729    7.3774    9.3423 C   0  0  0  0  0
    4.3911    6.8376    9.4601 C   0  0  0  0  0
   -0.5575    1.0889   -1.1184 H   0  0  0  0  0
   -1.1218    1.6349    0.4484 H   0  0  0  0  0
   -2.2495   -0.4780   -0.3058 H   0  0  0  0  0
   -1.3740   -0.7640    1.2004 H   0  0  0  0  0
    0.8165   -1.9500    1.0161 H   0  0  0  0  0
    1.3294   -2.4179   -0.6061 H   0  0  0  0  0
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    1.6027   -0.0911   -1.3065 H   0  0  0  0  0
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    2.6266   -1.6394    3.3604 H   0  0  0  0  0
    1.7519    6.3502    9.4811 H   0  0  0  0  0
    1.4606    6.6834    7.7759 H   0  0  0  0  0
    3.3568    7.2324    6.2364 H   0  0  0  0  0
    5.6236    8.1917    6.0433 H   0  0  0  0  0
    7.1141    8.2840    8.0238 H   0  0  0  0  0
    6.3292    7.4096   10.2081 H   0  0  0  0  0
    4.0659    6.4490   10.4232 H   0  0  0  0  0
  1  6  1  0  0  0
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  6  7  1  0  0  0
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  8  9  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL517157

>  <PubChem CID>
10271599

>  <Formula>
C23H24N4O2

>  <Molecular Weight>
388.471000

>  <IUPAC Name>
4-[2-[3-(3-benzyl-1,2,4-oxadiazol-5-yl)indol-1-yl]ethyl]morpholine

>  <XlogP>
3.4

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1COCCN1CCN2C=C(C3=CC=CC=C32)C4=NC(=NO4)CC5=CC=CC=C5

>  <Isomeric SMILES>
C1COCCN1CCN2C=C(C3=CC=CC=C32)C4=NC(=NO4)CC5=CC=CC=C5

>  <InChI Std. ID>
InChI=1S/C23H24N4O2/c1-2-6-18(7-3-1)16-22-24-23(29-25-22)20-17-27(21-9-5-4-8-19(20)21)11-10-26-12-14-28-15-13-26/h1-9,17H,10-16H2

>  <InChI Key>
JCDROPVAEVESRD-UHFFFAOYSA-N

