SEQ2FUN

BioLiP

PDB CCD ID: V1L
Number of entries in BioLiP: 5
Chemical formula: C5 H9 N O
InChI: InChI=1S/C5H9NO/c7-5-3-1-2-4-6-5/h1-4H2,(H,6,7)
InChIKey: XUWHAWMETYGRKB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C1CCNC(=O)C1
CACTVS 3.385O=C1CCCCN1
Name:piperidin-2-one;
valerolactam
ChEMBL: CHEMBL12193
ZINC: ZINC000003860817
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).