SEQ2FUN

BioLiP

PDB CCD ID:

Number of entries in BioLiP:

Chemical formula:

C3 H7 N3 O2

InChI:

InChI=1S/C3H7N3O2/c4-3(5)6-1-2(7)8/h1H2,(H,7,8)(H4,4,5,6)

InChIKey:

BPMFZUMJYQTVII-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 10.04	O=C(O)CNC(=[N@H])N
OpenEye OEToolkits 1.5.0	[H]/N=C(/N)\NCC(=O)O
CACTVS 3.341	NC(=N)NCC(O)=O
OpenEye OEToolkits 1.5.0	[H]N=C(N)NCC(=O)O

Name:

GUANIDINO ACETATE;
N-[AMINO(IMINO)METHYL]GLYCINE

ChEMBL:

DrugBank:

ZINC:

ZINC000000895314

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).