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BioLiP

PDB CCD ID: MM1
Number of entries in BioLiP: 2
Chemical formula: C10 H24 Cu N4
InChI: InChI=1S/C10H24N4.Cu/c1-3-11-7-9-13-5-2-6-14-10-8-12-4-1;/h11-14H,1-10H2;
InChIKey: LXENXYBNGDTDRA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385[Cu]|1|2|3|N4CCCN|1CCN|2CCCN|3CC4
OpenEye OEToolkits 1.7.5C1C[N@@H]2CC[N@@H]3[Cu]24[N@@H](C1)CC[N@@H]4CCC3
OpenEye OEToolkits 1.7.5C1C[NH]2CC[NH]3[Cu]24[NH](C1)CC[NH]4CCC3
Name:1,4,8,11-TETRAAZA-CYCLOTETRADECANE CU(II);
CU-CYCLAM
DrugBank: DB03189
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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