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SMILES: Clc1ccc(cc1)-c1cc(C#N)c(OCC2CCOC2)nc1-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=FGRUXAONANJQNR-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50204197   
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
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50204197
PNG
(5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)-2-((tetr...)
Show SMILES Clc1ccc(cc1)-c1cc(C#N)c(OCC2CCOC2)nc1-c1ccc(Cl)cc1Cl |w:15.15|
Show InChI InChI=1S/C23H17Cl3N2O2/c24-17-3-1-15(2-4-17)20-9-16(11-27)23(30-13-14-7-8-29-12-14)28-22(20)19-6-5-18(25)10-21(19)26/h1-6,9-10,14H,7-8,12-13H2
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 430n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at CB2 receptor


Bioorg Med Chem Lett 17: 2031-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.005
BindingDB Entry DOI: 10.7270/Q27944BJ
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50204197
PNG
(5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)-2-((tetr...)
Show SMILES Clc1ccc(cc1)-c1cc(C#N)c(OCC2CCOC2)nc1-c1ccc(Cl)cc1Cl |w:15.15|
Show InChI InChI=1S/C23H17Cl3N2O2/c24-17-3-1-15(2-4-17)20-9-16(11-27)23(30-13-14-7-8-29-12-14)28-22(20)19-6-5-18(25)10-21(19)26/h1-6,9-10,14H,7-8,12-13H2
PDB

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UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.60n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at CB1 receptor


Bioorg Med Chem Lett 17: 2031-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.005
BindingDB Entry DOI: 10.7270/Q27944BJ
More data for this
Ligand-Target Pair