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BioLiP Library

PDB CCD ID: JZ9
Number of entries in BioLiP: 1
Chemical formula: C8 H11 N
InChI: InChI=1S/C8H11N/c1-2-4-8-7(3-1)5-6-9-8/h5-6,9H,1-4H2
InChIKey: KQBVVLOYXDVATK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0c1c[nH]c2c1CCCC2
CACTVS 3.352C1CCc2cc[nH]c2C1
Name:4,5,6,7-tetrahydro-1H-indole
ZINC: ZINC000004521854
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)(download the PDF file).
  • 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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