SEQ2FUN

BioLiP

PDB CCD ID: HN9
Number of entries in BioLiP: 4
Chemical formula: C11 H10 N2 O3
InChI: InChI=1S/C11H10N2O3/c14-9-3-1-8(2-4-9)7-13-6-5-12-10(13)11(15)16/h1-6,14H,7H2,(H,15,16)
InChIKey: LLGCUNZOZLGRNP-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(ccc1Cn2ccnc2C(=O)O)O
CACTVS 3.385Oc1ccc(Cn2ccnc2C(O)=O)cc1
Name:1-[(4-hydroxyphenyl)methyl]imidazole-2-carboxylic acid
ChEMBL: CHEMBL165087
ZINC: ZINC000027873512
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).