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BDBM50362797 CHEMBL1940379

SMILES: CC(C(=O)NCC1CC1(c1ccccc1)c1ccccc1)c1ccc(NS(C)(=O)=O)c(F)c1

InChI Key: InChIKey=JEFLZBMOFTXIKK-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50362797   
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
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50362797
PNG
(CHEMBL1940379)
Show SMILES CC(C(=O)NCC1CC1(c1ccccc1)c1ccccc1)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H27FN2O3S/c1-18(19-13-14-24(23(27)15-19)29-33(2,31)32)25(30)28-17-22-16-26(22,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-15,18,22,29H,16-17H2,1-2H3,(H,28,30)
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
148n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV1 expressed in CHO cells by 45Ca2+ uptake assay


Bioorg Med Chem 20: 1310-8 (2012)


Article DOI: 10.1016/j.bmc.2011.12.014
BindingDB Entry DOI: 10.7270/Q2ZK5H3M
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50362797
PNG
(CHEMBL1940379)
Show SMILES CC(C(=O)NCC1CC1(c1ccccc1)c1ccccc1)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C26H27FN2O3S/c1-18(19-13-14-24(23(27)15-19)29-33(2,31)32)25(30)28-17-22-16-26(22,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-15,18,22,29H,16-17H2,1-2H3,(H,28,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
188n/an/an/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Displacement of [3H]RTX from rat TRPV1 expressed in CHO cells


Bioorg Med Chem 20: 1310-8 (2012)


Article DOI: 10.1016/j.bmc.2011.12.014
BindingDB Entry DOI: 10.7270/Q2ZK5H3M
More data for this
Ligand-Target Pair