SEQ2FUN

BioLiP

PDB CCD ID: A1CXG
Number of entries in BioLiP: 2
Chemical formula: C10 H8 N2 O2
InChI: InChI=1S/C10H8N2O2/c13-10(14)9-6-12(7-11-9)8-4-2-1-3-5-8/h1-7H,(H,13,14)
InChIKey: DBYLAWFMMVZTRR-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 3.1.0.0c1ccc(cc1)n2cc(nc2)C(=O)O
CACTVS 3.385OC(=O)c1cn(cn1)c2ccccc2
ACDLabs 14.52O=C(O)c1cn(cn1)c1ccccc1
Name:1-phenyl-1H-imidazole-4-carboxylic acid
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).