BioLiP

PDB

BioLiP

PDB CCD ID:

GZ6

Number of entries in BioLiP:

Chemical formula:

C H6 N3

InChI:

InChI=1S/CH5N3/c2-1(3)4/h(H5,2,3,4)/p+1

InChIKey:

ZRALSGWEFCBTJO-UHFFFAOYSA-O

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C(=[NH2+])(N)N
CACTVS 3.385	NC(N)=[NH2+]
ACDLabs 12.01	C(\N)(N)=[NH2+]

Name:

Guanidinium

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).