BioLiP

PDB

BioLiP

PDB CCD ID:

V4A

Number of entries in BioLiP:

Chemical formula:

C22 H16 N8 Pt

InChI:

InChI=1S/2C11H8N4.Pt/c2*1-3-7-12-9(5-1)11-14-13-10-6-2-4-8-15(10)11;/h2*1-8H;/q;;+2

InChIKey:

RJNZXUGUJQBFMV-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	[Pt++].c1ccc(nc1)c2nnc3ccccn23.c4ccc(nc4)c5nnc6ccccn56
ACDLabs 12.01	c3cccc4c2n1c(cccc1)nn2[Pt+2]6(n34)n8c(c5ccccn56)n7c(cccc7)n8
OpenEye OEToolkits 2.0.7	C1=CC2=[N](C=C1)[Pt+2]3([N]4=C(C=CC=C4)C5=[N]3N=C6N5C=CC=C6)[N]7=C2N8C=CC=CC8=N7

Name:

Platinum(II) bis[3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-a]pyridine]

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).