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BioLiP

PDB CCD ID: XA5
Number of entries in BioLiP: 0
Chemical formula: C30 H26 N4
InChI: InChI=1S/C30H26N4/c1-5-15-25-21(11-1)29(22-12-2-6-16-26(22)33-25)31-19-9-10-20-32-30-23-13-3-7-17-27(23)34-28-18-8-4-14-24(28)30/h1-8,11-18H,9-10,19-20H2,(H,31,33)(H,32,34)
InChIKey: MKFRLGCMWOIRSO-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385C(CCNc1c2ccccc2nc3ccccc13)CNc4c5ccccc5nc6ccccc46
OpenEye OEToolkits 2.0.7c1ccc2c(c1)c(c3ccccc3n2)NCCCCNc4c5ccccc5nc6c4cccc6
Name:N,N'-di(acridin-9-yl)butane-1,4-diamine
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)(download the PDF file).
  • 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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