SEQ2FUN

BioLiP

PDB CCD ID: 6LB
Number of entries in BioLiP: 1
Chemical formula: C6 H13 N O
InChI: InChI=1S/C6H13NO/c1-2-7-3-5-8-6-4-7/h2-6H2,1H3
InChIKey: HVCNXQOWACZAFN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01
CACTVS 3.385
OpenEye OEToolkits 2.0.4		CCN1CCOCC1
Name:4-ethylmorpholine
ChEMBL: CHEMBL3561880
ZINC: ZINC000020230620
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).