SEQ2FUN

BioLiP

PDB CCD ID: LOQ
Number of entries in BioLiP: 1
Chemical formula: C11 H11 N O2
InChI: InChI=1S/C11H11NO2/c1-8-2-4-9(5-3-8)12-10(13)6-7-11(12)14/h2-5H,6-7H2,1H3
InChIKey: IDSFKFXFMNGXCK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.7		Cc1ccc(cc1)N2C(=O)CCC2=O
Name:1-(4-methylphenyl)pyrrolidine-2,5-dione
ChEMBL: CHEMBL1078597
ZINC: ZINC000000069314
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).