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BDBM50004497 CHEMBL330205::Phosphoric acid 2-trimethylamino-ethyl ester 2-hexadecanoylamino-3-octadecyloxy-propyl ester

SMILES: CCCCCCCCCCCCCCCCCCOC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCCCC

InChI Key: InChIKey=CFJZFSABZRMWIK-VQJSHJPSSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50004497   
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 A2, major isoenzyme


(Sus scrofa (pig))		BDBM50004497
PNG
(CHEMBL330205 | Phosphoric acid 2-trimethylamino-et...)
Show SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCCCC
Show InChI InChI=1S/C42H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-37-48-39-41(40-50-51(46,47)49-38-36-44(3,4)5)43-42(45)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h41H,6-40H2,1-5H3,(H-,43,45,46,47)/t41-/m1/s1
PDB
MMDB

KEGG

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Fisons plc

Curated by ChEMBL


Assay Description
In vitro inhibition of porcine pancreatic phospholipase A2 evaluated by Deoxycholate-phospholipid mixed micelle assay

J Med Chem 35: 2939-51 (1992)


BindingDB Entry DOI: 10.7270/Q2RF5T0R
More data for this
Ligand-Target Pair