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BioLiP

PDB CCD ID: FCW
Number of entries in BioLiP: 1
Chemical formula: C14 H17 N O
InChI: InChI=1S/C14H17NO/c16-14-9-12-8-11(6-7-13(12)15-14)10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,15,16)
InChIKey: GAMOWVPYWCFRMK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1cc2c(cc1C3CCCCC3)CC(=O)N2
CACTVS 3.385O=C1Cc2cc(ccc2N1)C3CCCCC3
Name:5-cyclohexyl-1,3-dihydroindol-2-one
ChEMBL: CHEMBL4577264
ZINC: ZINC000145480932
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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