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BDBM50180991 1,12-Bis(N-butylpyrrolidinium)dodecane dichloride::CHEMBL381324

SMILES: CCCC[N+]1(CCCCCCCCCCCC[N+]2(CCCC)CCCC2)CCCC1

InChI Key: InChIKey=SUURYGHSCZUBDB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50180991   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phospholipase B


(Cryptococcus neoformans)
BDBM50180991
PNG
(1,12-Bis(N-butylpyrrolidinium)dodecane dichloride ...)
Show SMILES CCCC[N+]1(CCCCCCCCCCCC[N+]2(CCCC)CCCC2)CCCC1
Show InChI InChI=1S/C28H58N2/c1-3-5-21-29(25-17-18-26-29)23-15-13-11-9-7-8-10-12-14-16-24-30(22-6-4-2)27-19-20-28-30/h3-28H2,1-2H3/q+2
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of Cryptococccus neoformans H99 PLB1activity


J Med Chem 49: 811-6 (2006)


Article DOI: 10.1021/jm0508843
BindingDB Entry DOI: 10.7270/Q2M61JT1
More data for this
Ligand-Target Pair