
 CHEMBL425013

 64 69  0  0  0  0  0  0  0  0999 V2000
    5.8139   -0.8295    4.9742 C   0  0  0  0  0
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    6.5919    1.8085   -3.4181 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL425013

>  <PubChem CID>
11518384

>  <Formula>
C28H29N5O2

>  <Molecular Weight>
467.573000

>  <IUPAC Name>
1-(4-phenoxyphenyl)-3-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]imidazolidin-2-one

>  <XlogP>
4.300

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CCN(C1)CCN2C3=C(C=C(C=C3)N4CCN(C4=O)C5=CC=C(C=C5)OC6=CC=CC=C6)C=N2

>  <Isomeric SMILES>
C1CCN(C1)CCN2C3=C(C=C(C=C3)N4CCN(C4=O)C5=CC=C(C=C5)OC6=CC=CC=C6)C=N2

>  <InChI Std. ID>
InChI=1S/C28H29N5O2/c34-28-31(23-8-11-26(12-9-23)35-25-6-2-1-3-7-25)17-18-32(28)24-10-13-27-22(20-24)21-29-33(27)19-16-30-14-4-5-15-30/h1-3,6-13,20-21H,4-5,14-19H2

>  <InChI Key>
DYWKKARJVZJMJV-UHFFFAOYSA-N

