
 CHEMBL89153

 82 85  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL89153

>  <PubChem CID>
21255272

>  <Formula>
C32H44N4O2

>  <Molecular Weight>
516.730000

>  <IUPAC Name>
N-(cyclohexylmethyl)-2-[[2,6-di(propan-2-yl)phenyl]carbamoylamino]-3-(1H-indol-3-yl)-2-methylpropanamide

>  <XlogP>
7.2

>  <Hydrogen Bond Donors>
4

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NC(C)(CC2=CNC3=CC=CC=C32)C(=O)NCC4CCCCC4

>  <Isomeric SMILES>
CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NC(C)(CC2=CNC3=CC=CC=C32)C(=O)NCC4CCCCC4

>  <InChI Std. ID>
InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)29(25)35-31(38)36-32(5,30(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H2,35,36,38)

>  <InChI Key>
FKOHSYGDMKTNKS-UHFFFAOYSA-N

