
 CHEMBL3786311

 65 69  0  0  0  0  0  0  0  0999 V2000
    0.9443   -0.3452   -6.0802 C   0  0  0  0  0
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    1.2432    3.0564   -5.3107 H   0  0  0  0  0
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    4.8829    1.4547   -5.7087 H   0  0  0  0  0
    3.8815    2.5856   -4.7701 H   0  0  0  0  0
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    4.2371    1.1833   -2.6616 H   0  0  0  0  0
    6.4383    1.9853   -3.1511 H   0  0  0  0  0
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    7.7095   -2.5317   -4.7661 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL3786311

>  <PubChem CID>
127030367

>  <Formula>
C26H30N4O5

>  <Molecular Weight>
478.549000

>  <IUPAC Name>
[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-[3-[4-[[methyl-[(3-methyloxetan-3-yl)methyl]amino]methyl]phenoxy]azetidin-1-yl]methanone

>  <XlogP>
2.8

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC1(COC1)CN(C)CC2=CC=C(C=C2)OC3CN(C3)C(=O)C4=NN=C(O4)C5=CC=C(C=C5)OC

>  <Isomeric SMILES>
CC1(COC1)CN(C)CC2=CC=C(C=C2)OC3CN(C3)C(=O)C4=NN=C(O4)C5=CC=C(C=C5)OC

>  <InChI Std. ID>
InChI=1S/C26H30N4O5/c1-26(16-33-17-26)15-29(2)12-18-4-8-21(9-5-18)34-22-13-30(14-22)25(31)24-28-27-23(35-24)19-6-10-20(32-3)11-7-19/h4-11,22H,12-17H2,1-3H3

>  <InChI Key>
QPXDFWVAPQNHHH-UHFFFAOYSA-N

