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BioLiP Library

PDB CCD ID: DIX
Number of entries in BioLiP: 0
Chemical formula: C9 H19 N
InChI: InChI=1S/C9H19N/c1-10-8-4-7-9-5-2-3-6-9/h9-10H,2-8H2,1H3
InChIKey: XQXPWKNEZKBRNQ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04N(CCCC1CCCC1)C
CACTVS 3.341
OpenEye OEToolkits 1.5.0		CNCCCC1CCCC1
Name:METHYL(CYCLOPENTYL-PROPYL)AMINE
ZINC: ZINC000008205016
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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