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BDBM50353077 CHEMBL1822931

SMILES: COc1ccc2cc(C(=O)NCC(F)c3ccccc3)c(=O)[nH]c2c1OC

InChI Key: InChIKey=RTTGKYVLNXUSQE-UHFFFAOYSA-N

Data: 2 KI

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 = 50353077   
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))
BDBM50353077
PNG
(CHEMBL1822931)
Show SMILES COc1ccc2cc(C(=O)NCC(F)c3ccccc3)c(=O)[nH]c2c1OC
Show InChI InChI=1S/C20H19FN2O4/c1-26-16-9-8-13-10-14(20(25)23-17(13)18(16)27-2)19(24)22-11-15(21)12-6-4-3-5-7-12/h3-10,15H,11H2,1-2H3,(H,22,24)(H,23,25)
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PC cid
PC sid
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Similars

Article
PubMed
22n/an/an/an/an/an/an/an/a



The University of Texas

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB2 receptor expressed in human U87 cells after 1 hr by scintillation counting


Bioorg Med Chem 19: 5698-707 (2011)


Article DOI: 10.1016/j.bmc.2011.07.062
BindingDB Entry DOI: 10.7270/Q2GH9JC3
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50353077
PNG
(CHEMBL1822931)
Show SMILES COc1ccc2cc(C(=O)NCC(F)c3ccccc3)c(=O)[nH]c2c1OC
Show InChI InChI=1S/C20H19FN2O4/c1-26-16-9-8-13-10-14(20(25)23-17(13)18(16)27-2)19(24)22-11-15(21)12-6-4-3-5-7-12/h3-10,15H,11H2,1-2H3,(H,22,24)(H,23,25)
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



The University of Texas

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB1 receptor expressed in human U87 cells after 1 hr by scintillation counting


Bioorg Med Chem 19: 5698-707 (2011)


Article DOI: 10.1016/j.bmc.2011.07.062
BindingDB Entry DOI: 10.7270/Q2GH9JC3
More data for this
Ligand-Target Pair