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BDBM50416135 CHEMBL1084482

SMILES: CN(C1CCN(C)CC1)C(=O)C1CN(c2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=ROKYRPTZROQHPQ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50416135   
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
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50416135
PNG
(CHEMBL1084482)
Show SMILES CN(C1CCN(C)CC1)C(=O)C1CN(c2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C28H31N3O3S/c1-29-18-16-23(17-19-29)30(2)28(32)26-20-31(27-11-7-6-10-25(26)27)35(33,34)24-14-12-22(13-15-24)21-8-4-3-5-9-21/h3-15,23,26H,16-20H2,1-2H3
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PC cid
PC sid
UniChem
Article
PubMed
126n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT6 expressed in CHO cells by FLIPR 384 assay


Bioorg Med Chem Lett 20: 3713-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.085
BindingDB Entry DOI: 10.7270/Q2V69KV3
More data for this
Ligand-Target Pair