BioLiP

PDB

BioLiP

PDB CCD ID:

A1BVY

Number of entries in BioLiP:

Chemical formula:

C7 H6 N4

InChI:

InChI=1S/C7H6N4/c1-2-4-7(5-3-1)11-6-8-9-10-11/h1-6H

InChIKey:

IYPXPGSELZFFMI-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 3.1.0.0	c1ccc(cc1)n2cnnn2
ACDLabs 14.52	c1ccc(cc1)n1cnnn1

Name:

1-phenyl-1H-tetrazole

ChEMBL:

CHEMBL3186008

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).