SEQ2FUN

BioLiP

PDB CCD ID: VZX
Number of entries in BioLiP: 0
Chemical formula: C31 H28 N4
InChI: InChI=1S/C31H28N4/c1(10-20-32-30-22-12-2-6-16-26(22)34-27-17-7-3-13-23(27)30)11-21-33-31-24-14-4-8-18-28(24)35-29-19-9-5-15-25(29)31/h2-9,12-19H,1,10-11,20-21H2,(H,32,34)(H,33,35)
InChIKey: ZDZDJUSBDOZJNB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385C(CCNc1c2ccccc2nc3ccccc13)CCNc4c5ccccc5nc6ccccc46
OpenEye OEToolkits 2.0.7c1ccc2c(c1)c(c3ccccc3n2)NCCCCCNc4c5ccccc5nc6c4cccc6
Name:~{N},~{N}'-di(acridin-9-yl)pentane-1,5-diamine
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).