
 CHEMBL2035983

 72 78  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL2035983

>  <PubChem CID>
56944164

>  <Formula>
C31H30F2N6O3

>  <Molecular Weight>
572.617000

>  <IUPAC Name>
2-[(8R)-8-(3,5-difluorophenyl)-8-methyl-10-oxo-6,9-diazaspiro[4.5]decan-9-yl]-N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-3'-yl]acetamide

>  <XlogP>
1.9

>  <Hydrogen Bond Donors>
3

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC1(CNC2(CCCC2)C(=O)N1CC(=O)NC3=CN=C4CC5(CC4=C3)C6=C(NC5=O)N=CC=C6)C7=CC(=CC(=C7)F)F

>  <Isomeric SMILES>
C[C@]1(CNC2(CCCC2)C(=O)N1CC(=O)NC3=CN=C4C[C@@]5(CC4=C3)C6=C(NC5=O)N=CC=C6)C7=CC(=CC(=C7)F)F

>  <InChI Std. ID>
InChI=1S/C31H30F2N6O3/c1-29(19-10-20(32)12-21(33)11-19)17-36-31(6-2-3-7-31)28(42)39(29)16-25(40)37-22-9-18-13-30(14-24(18)35-15-22)23-5-4-8-34-26(23)38-27(30)41/h4-5,8-12,15,36H,2-3,6-7,13-14,16-17H2,1H3,(H,37,40)(H,34,38,41)/t29-,30-/m0/s1

>  <InChI Key>
IDKKNSOZWQOAAS-KYJUHHDHSA-N

