BioLiP

PDB

BioLiP

PDB CCD ID:

HGW

Number of entries in BioLiP:

Chemical formula:

C4 H3 I N2

InChI:

InChI=1S/C4H3IN2/c5-4-1-6-3-7-2-4/h1-3H

InChIKey:

DNWRLMRKDSGSPL-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	Ic1cncnc1
OpenEye OEToolkits 2.0.6	c1c(cncn1)I

Name:

5-iodanylpyrimidine

ZINC:

ZINC000000967270

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).