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BioLiP

PDB CCD ID: TLQ
Number of entries in BioLiP: 1
Chemical formula: C20 H14 N2 O
InChI: InChI=1S/C20H14N2O/c23-14-16-10-11-19(18-9-5-4-8-17(16)18)22-13-12-21-20(22)15-6-2-1-3-7-15/h1-14H
InChIKey: JHRQNTBVKVZKLW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385O=Cc1ccc(n2ccnc2c3ccccc3)c4ccccc14
OpenEye OEToolkits 2.0.7c1ccc(cc1)c2nccn2c3ccc(c4c3cccc4)C=O
Name:4-(2-phenylimidazol-1-yl)naphthalene-1-carbaldehyde
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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