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BDBM50494118 CHEMBL2441255

SMILES: CCCCCn1c2ccccc2c2cc(ccc12)C(=O)N1CCOCC1

InChI Key: InChIKey=LTHKBEZTCNZXHJ-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 = 50494118   
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 1


(Rattus norvegicus (rat))
BDBM50494118
PNG
(CHEMBL2441255)
Show SMILES CCCCCn1c2ccccc2c2cc(ccc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C22H26N2O2/c1-2-3-6-11-24-20-8-5-4-7-18(20)19-16-17(9-10-21(19)24)22(25)23-12-14-26-15-13-23/h4-5,7-10,16H,2-3,6,11-15H2,1H3
PDB

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UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
60n/an/an/an/an/an/an/an/a



The University of Montana

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CB1 receptor in rat brain homogenate after 1.5 hrs by microbeta liquid scintillation counting analysis


Eur J Med Chem 69: 881-907 (2013)


Article DOI: 10.1016/j.ejmech.2013.09.038
BindingDB Entry DOI: 10.7270/Q20P12Z8
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50494118
PNG
(CHEMBL2441255)
Show SMILES CCCCCn1c2ccccc2c2cc(ccc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C22H26N2O2/c1-2-3-6-11-24-20-8-5-4-7-18(20)19-16-17(9-10-21(19)24)22(25)23-12-14-26-15-13-23/h4-5,7-10,16H,2-3,6,11-15H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
85n/an/an/an/an/an/an/an/a



The University of Montana

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cells after 1.5 hrs by microbeta liquid scintillation counting analysis


Eur J Med Chem 69: 881-907 (2013)


Article DOI: 10.1016/j.ejmech.2013.09.038
BindingDB Entry DOI: 10.7270/Q20P12Z8
More data for this
Ligand-Target Pair