BioLiP

PDB

BioLiP

PDB CCD ID:

LR2

Number of entries in BioLiP:

Chemical formula:

C12 H10 N2 O Se

InChI:

InChI=1S/C12H10N2OSe/c15-12(9-5-1-2-6-10(9)16)14-11-7-3-4-8-13-11/h1-8,16H,(H,13,14,15)

InChIKey:

IIISTDSZDJBBTA-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc(c(c1)C(=O)Nc2ccccn2)[SeH]
CACTVS 3.385	[SeH]c1ccccc1C(=O)Nc2ccccn2

Name:

~{N}-pyridin-2-yl-2-selanyl-benzamide

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).