SEQ2FUN

BioLiP

PDB CCD ID: N4P
Number of entries in BioLiP: 15
Chemical formula: C10 H26 N4
InChI: InChI=1S/C10H26N4/c11-5-1-2-8-14(9-3-6-12)10-4-7-13/h1-13H2
InChIKey: CAARYRKDWMNHCB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.4C(CCN(CCCN)CCCN)CN
CACTVS 3.385NCCCCN(CCCN)CCCN
Name:N,N-bis(3-aminopropyl)butane-1,4-diamine;
N4-aminopropylspermidine
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).