BioLiP

PDB

BioLiP

PDB CCD ID:

7M0

Number of entries in BioLiP:

Chemical formula:

C6 H3 Br2 N3

InChI:

InChI=1S/C6H3Br2N3/c7-3-1-5-6(2-4(3)8)10-11-9-5/h1-2H,(H,9,10,11)

InChIKey:

DULRVLLMOREPRG-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.6	c1c2c(cc(c1Br)Br)nn[nH]2
CACTVS 3.385	Brc1cc2[nH]nnc2cc1Br

Name:

5,6-DIBROMOBENZOTRIAZOLE;
DIBROMO-2-BENZOTRIAZOLE

ZINC:

ZINC000005286147

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).