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SMILES: OC(=O)CC[C@@H](Cc1ccc(OC\C=C\c2ccccc2)cc1)NC(=O)CCCCCCc1ccccc1

InChI Key: InChIKey=FUSMGPGPZJPQPM-OAXDOYGISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 82343   
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


(Homo sapiens (Human))		BDBM82343
PNG
(hnpsPLA2-IIa Inhibitor, 2n)
Show SMILES OC(=O)CC[C@@H](Cc1ccc(OC\C=C\c2ccccc2)cc1)NC(=O)CCCCCCc1ccccc1 |r|
Show InChI InChI=1S/C33H39NO4/c35-32(18-10-2-1-5-12-27-13-6-3-7-14-27)34-30(21-24-33(36)37)26-29-19-22-31(23-20-29)38-25-11-17-28-15-8-4-9-16-28/h3-4,6-9,11,13-17,19-20,22-23,30H,1-2,5,10,12,18,21,24-26H2,(H,34,35)(H,36,37)/b17-11+/t30-/m0/s1
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Article
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n/an/a 116n/an/an/an/an/an/a



University of Queensland Brisbane



Assay Description
Compounds 2a-q were evaluated as inhibitors by using an in vitro colorimetric enzyme assay.

Chembiochem 4: 181-5 (2003)


Article DOI: 10.1002/cbic.200390029
BindingDB Entry DOI: 10.7270/Q28S4NDS
More data for this
Ligand-Target Pair