SEQ2FUN

BioLiP

PDB CCD ID: MXE
Number of entries in BioLiP: 38
Chemical formula: C3 H8 O2
InChI: InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3
InChIKey: XNWFRZJHXBZDAG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0		COCCO
ACDLabs 10.04OCCOC
Name:2-METHOXYETHANOL
ChEMBL: CHEMBL444144
DrugBank: DB02806
ZINC: ZINC000001591817
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).