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BioLiP Library

PDB CCD ID: 8BT
Number of entries in BioLiP: 1
Chemical formula: C6 H13 N O2 S
InChI: InChI=1S/C6H13NO2S/c1-10(8,9)7-6-4-2-3-5-6/h6-7H,2-5H2,1H3
InChIKey: IJXUJLYIQLLJEP-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385C[S](=O)(=O)NC1CCCC1
OpenEye OEToolkits 2.0.7CS(=O)(=O)NC1CCCC1
ACDLabs 12.01O=S(=O)(C)NC1CCCC1
Name:N-cyclopentylmethanesulfonamide
ZINC: ZINC000000304622
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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