BioLiP

PDB

BioLiP

PDB CCD ID:

JK9

Number of entries in BioLiP:

Chemical formula:

C12 H11 N O

InChI:

InChI=1S/C12H11NO/c1-14-12-4-2-10(3-5-12)11-6-8-13-9-7-11/h2-9H,1H3

InChIKey:

BDXPUDLCSHDVGK-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	COc1ccc(cc1)c2ccncc2

Name:

4-(4-methoxyphenyl)pyridine

ZINC:

ZINC000008632712

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).