BioLiP

PDB

BioLiP

PDB CCD ID:

A1AJU

Number of entries in BioLiP:

Chemical formula:

C5 H6 N2

InChI:

InChI=1S/C5H6N2/c1-2-5-3-6-4-7-5/h2-4H,1H2,(H,6,7)

InChIKey:

MHQZDNQHLGFBRN-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	C=Cc1c[nH]cn1
ACDLabs 12.01	C=Cc1c[NH]cn1

Name:

4-ethenyl-1H-imidazole

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).