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SMILES: CCS(=O)(=O)N[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@H]23)C1

InChI Key: InChIKey=UOCXCVRXVINRCQ-POBGKJHXSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50388505   
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
Glucose-6-phosphate 1-dehydrogenase


(Homo sapiens (Human))		BDBM50388505
PNG
(CHEMBL2057308)
Show SMILES CCS(=O)(=O)N[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@H]23)C1 |r|
Show InChI InChI=1S/C23H39NO3S/c1-5-28(26,27)24-17-10-12-22(3)16(14-17)6-7-18-20-9-8-19(15(2)25)23(20,4)13-11-21(18)22/h16-21,24H,5-14H2,1-4H3/t16-,17-,18-,19+,20-,21-,22-,23+/m0/s1
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antibodypedia
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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal His tagged G6PD expressed in Escherichia coli JM109 (DE3) cells assessed as production of NADPH after 30 m...

J Med Chem 55: 4431-45 (2012)


Article DOI: 10.1021/jm300317k
BindingDB Entry DOI: 10.7270/Q298883V
More data for this
Ligand-Target Pair