BioLiP

PDB

BioLiP

PDB CCD ID:

TQK

Number of entries in BioLiP:

Chemical formula:

C17 H14 N2 O

InChI:

InChI=1S/C17H14N2O/c1-13-11-16(8-7-15(13)12-20)19-10-9-18-17(19)14-5-3-2-4-6-14/h2-12H,1H3

InChIKey:

JLZNBKMFWOJNBX-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	Cc1cc(ccc1C=O)n2ccnc2c3ccccc3

Name:

2-methyl-4-(2-phenylimidazol-1-yl)benzaldehyde

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).