BioLiP

PDB

BioLiP

PDB CCD ID:

V06

Number of entries in BioLiP:

Chemical formula:

C5 H5 Br N2

InChI:

InChI=1S/C5H5BrN2/c6-4-3-8-2-1-5(4)7/h1-3H,(H2,7,8)

InChIKey:

DDQYSZWFFXOXER-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01 CACTVS 3.385	Nc1ccncc1Br
OpenEye OEToolkits 2.0.7	c1cncc(c1N)Br

Name:

3-bromopyridin-4-amine

ZINC:

ZINC000019015182

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).