BioLiP

PDB

BioLiP

PDB CCD ID:

A1L9F

Number of entries in BioLiP:

Chemical formula:

C20 H11 N O2

InChI:

InChI=1S/C20H11NO2/c22-17-10-11-18(23)21(17)16-9-7-14-5-4-12-2-1-3-13-6-8-15(16)20(14)19(12)13/h1-11H

InChIKey:

YXKWRQLPBHVBRP-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1cc2ccc3ccc(c4c3c2c(c1)cc4)N5C(=O)C=CC5=O
CACTVS 3.385	O=C1C=CC(=O)N1c2ccc3ccc4cccc5ccc2c3c45

Name:

N-(1-pyrenyl)maleimide;
1-pyren-1-ylpyrrole-2,5-dione

ChEMBL:

CHEMBL4214687

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).