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BioLiP

PDB CCD ID: T5D
Number of entries in BioLiP: 1
Chemical formula: C11 H15 N O
InChI: InChI=1S/C11H15NO/c13-9-11(6-2-3-7-11)10-5-1-4-8-12-10/h1,4-5,8,13H,2-3,6-7,9H2
InChIKey: NQXVUFAYASZGFN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccnc(c1)C2(CCCC2)CO
ACDLabs 12.01c1ccc(nc1)C2(CCCC2)CO
CACTVS 3.385OCC1(CCCC1)c2ccccn2
Name:[1-(pyridin-2-yl)cyclopentyl]methanol
ZINC: ZINC000084333727
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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