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Compile Data Set for Download or QSAR

Found 2 hits of ec50 for monomerid = 50402870   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50402870
PNG
(CHEMBL2205585)
Show SMILES COCC(C)(C)NC(=O)c1c(NC(=O)c2ccccc2C(F)(F)F)sc2COCCc12
Show InChI InChI=1S/C21H23F3N2O4S/c1-20(2,11-29-3)26-18(28)16-13-8-9-30-10-15(13)31-19(16)25-17(27)12-6-4-5-7-14(12)21(22,23)24/h4-7H,8-11H2,1-3H3,(H,25,27)(H,26,28)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 41n/an/an/an/a



Nycomed Pharma Pvt. Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor after 4 hrs by luciferase reporter gene assay


Bioorg Med Chem Lett 22: 7314-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.10.087
BindingDB Entry DOI: 10.7270/Q2QR4Z9V
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50402870
PNG
(CHEMBL2205585)
Show SMILES COCC(C)(C)NC(=O)c1c(NC(=O)c2ccccc2C(F)(F)F)sc2COCCc12
Show InChI InChI=1S/C21H23F3N2O4S/c1-20(2,11-29-3)26-18(28)16-13-8-9-30-10-15(13)31-19(16)25-17(27)12-6-4-5-7-14(12)21(22,23)24/h4-7H,8-11H2,1-3H3,(H,25,27)(H,26,28)
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Nycomed Pharma Pvt. Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor after 4 hrs by luciferase reporter gene assay


Bioorg Med Chem Lett 22: 7314-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.10.087
BindingDB Entry DOI: 10.7270/Q2QR4Z9V
More data for this
Ligand-Target Pair