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BDBM50140068 CHEMBL3753075

SMILES: CN(C)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cc1

InChI Key: InChIKey=GEPAZHSJKGQJML-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50140068   
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
Serotonin (5-HT) receptor


(Rattus norvegicus (Rat))
BDBM50140068
PNG
(CHEMBL3753075)
Show SMILES CN(C)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)N2CCc3cc(C)c(Cl)cc23)cc1
Show InChI InChI=1S/C27H31ClN4O3S/c1-20-17-22-13-14-32(26(22)18-25(20)28)27(33)29-23-9-11-24(12-10-23)36(34,35)31(16-15-30(2)3)19-21-7-5-4-6-8-21/h4-12,17-18H,13-16,19H2,1-3H3,(H,29,33)
KEGG

UniProtKB/SwissProt

DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
44n/an/an/an/an/an/an/an/a



Gedeon Richter Plc

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from 5HT2C in Sprague-Dawley rat whole brain membranes after 1 hr by liquid scintillation spectrometry


Bioorg Med Chem Lett 26: 914-20 (2016)


BindingDB Entry DOI: 10.7270/Q2VX0JC7
More data for this
Ligand-Target Pair