
 CHEMBL3787261

 62 66  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL3787261

>  <PubChem CID>
127030070

>  <Formula>
C25H28N4O5

>  <Molecular Weight>
464.522000

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

>  <XlogP>
2.2

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC1(CCN(C1)CC2=CC=C(C=C2)OC3CN(C3)C(=O)C4=NN=C(O4)C5=CC=C(C=C5)OC)O

>  <Isomeric SMILES>
CC1(CCN(C1)CC2=CC=C(C=C2)OC3CN(C3)C(=O)C4=NN=C(O4)C5=CC=C(C=C5)OC)O

>  <InChI Std. ID>
InChI=1S/C25H28N4O5/c1-25(31)11-12-28(16-25)13-17-3-7-20(8-4-17)33-21-14-29(15-21)24(30)23-27-26-22(34-23)18-5-9-19(32-2)10-6-18/h3-10,21,31H,11-16H2,1-2H3

>  <InChI Key>
BAKIYMNVCWZQIA-UHFFFAOYSA-N

