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BioLiP

PDB CCD ID: N4Q
Number of entries in BioLiP: 1
Chemical formula: C22 H20 N2 O3
InChI: InChI=1S/C22H20N2O3/c1-25-18-7-4-15(5-8-18)21-14-24-13-16(6-9-22(24)23-21)17-10-19(26-2)12-20(11-17)27-3/h4-14H,1-3H3
InChIKey: IHJONSSVOHRQHD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7COc1ccc(cc1)c2cn3cc(ccc3n2)c4cc(cc(c4)OC)OC
CACTVS 3.385COc1ccc(cc1)c2cn3cc(ccc3n2)c4cc(OC)cc(OC)c4
Name:6-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine
ChEMBL: CHEMBL4441577
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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