SEQ2FUN

BioLiP

PDB CCD ID: MJB
Number of entries in BioLiP: 1
Chemical formula: C6 H14 N2 O
InChI: InChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2
InChIKey: WFCSWCVEJLETKA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C1CN(CCN1)CCO
CACTVS 3.385OCCN1CCNCC1
Name:2-piperazin-1-ylethanol
ChEMBL: CHEMBL3183736
ZINC: ZINC000019230137
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).