SEQ2FUN

BioLiP

PDB CCD ID: EHO
Number of entries in BioLiP: 2
Chemical formula: C13 H11 N O2
InChI: InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16)
InChIKey: ZWJINEZUASEZBH-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)Nc2ccccc2C(=O)O
CACTVS 3.385OC(=O)c1ccccc1Nc2ccccc2
Name:2-phenylazanylbenzoic acid
ChEMBL: CHEMBL23832
ZINC: ZINC000000154642
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).