SEQ2FUN

BioLiP

PDB CCD ID: GOY
Number of entries in BioLiP: 3
Chemical formula: C11 H20 N2 O
InChI: InChI=1S/C11H20N2O/c14-11(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H2
InChIKey: SNOJOKOVTYPHMC-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C1CCN(CC1)C(=O)N2CCCCC2
CACTVS 3.385O=C(N1CCCCC1)N2CCCCC2
Name:di(piperidin-1-yl)methanone
ChEMBL: CHEMBL11960
ZINC: ZINC000000155163
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).