BioLiP

PDB

BioLiP

PDB CCD ID:

XZT

Number of entries in BioLiP:

Chemical formula:

C10 H7 F2 N O2

InChI:

InChI=1S/C10H7F2NO2/c11-6-1-2-8(7(12)5-6)13-9(14)3-4-10(13)15/h1-2,5H,3-4H2

InChIKey:

YZJWAYPUZVVMIA-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1cc(c(cc1F)F)N2C(=O)CCC2=O
ACDLabs 12.01	Fc1cc(F)c(cc1)N1C(=O)CCC1=O
CACTVS 3.385	Fc1ccc(N2C(=O)CCC2=O)c(F)c1

Name:

1-(2,4-difluorophenyl)pyrrolidine-2,5-dione

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).