SEQ2FUN

BioLiP

PDB CCD ID: BCN
Number of entries in BioLiP: 7
Chemical formula: C6 H13 N O4
InChI: InChI=1S/C6H13NO4/c8-3-1-7(2-4-9)5-6(10)11/h8-9H,1-5H2,(H,10,11)
InChIKey: FSVCELGFZIQNCK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(CO)N(CCO)CC(=O)O
CACTVS 3.341OCCN(CCO)CC(O)=O
ACDLabs 10.04O=C(O)CN(CCO)CCO
Name:BICINE
DrugBank: DB03709
ZINC: ZINC000001683490
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).