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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50543746'   
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))
BDBM50543746
PNG
(CHEMBL4639040)
Show SMILES CCCCCCC(C)(C)c1cc(OC)cc(OCCCCCCCC(=O)NCC=C)c1
Show InChI InChI=1S/C27H45NO3/c1-6-8-9-14-17-27(3,4)23-20-24(30-5)22-25(21-23)31-19-15-12-10-11-13-16-26(29)28-18-7-2/h7,20-22H,2,6,8-19H2,1,3-5H3,(H,28,29)
PDB

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PC cid
PC sid
UniChem
Article
PubMed
31n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human recombinant CB2 receptor expressed in HEK cell membrane


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115513
BindingDB Entry DOI: 10.7270/Q2R49VB2
More data for this
Ligand-Target Pair