SEQ2FUN

BioLiP

PDB CCD ID: UHL
Number of entries in BioLiP: 6
Chemical formula: C5 H9 N3 O2
InChI: InChI=1S/C5H9N3O2/c1-9-3-2-4-7-8-5(6)10-4/h2-3H2,1H3,(H2,6,8)
InChIKey: NOHAGGWBLILEEG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7COCCc1nnc(o1)N
CACTVS 3.385COCCc1oc(N)nn1
Name:5-(2-methoxyethyl)-1,3,4-oxadiazol-2-amine
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).