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BDBM50217170 CHEMBL299038

SMILES: FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccccc3)Cc2c1

InChI Key: InChIKey=MUBFHRQVIYYBCR-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 = 50217170   
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
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50217170
PNG
(CHEMBL299038)
Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccccc3)Cc2c1
Show InChI InChI=1S/C27H27F3N2O4S/c28-27(29,30)37(34,35)36-25-13-12-22-14-17-32(19-24(22)18-25)16-5-4-15-31-26(33)23-10-8-21(9-11-23)20-6-2-1-3-7-20/h1-3,6-13,18H,4-5,14-17,19H2,(H,31,33)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
7.90n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells


Bioorg Med Chem Lett 9: 179-84 (1999)


BindingDB Entry DOI: 10.7270/Q2057J4D
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50217170
PNG
(CHEMBL299038)
Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccccc3)Cc2c1
Show InChI InChI=1S/C27H27F3N2O4S/c28-27(29,30)37(34,35)36-25-13-12-22-14-17-32(19-24(22)18-25)16-5-4-15-31-26(33)23-10-8-21(9-11-23)20-6-2-1-3-7-20/h1-3,6-13,18H,4-5,14-17,19H2,(H,31,33)
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
501n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement [125I]iodosulpiride from human Dopamine receptor D2 expressed in CHO cells


Bioorg Med Chem Lett 9: 179-84 (1999)


BindingDB Entry DOI: 10.7270/Q2057J4D
More data for this
Ligand-Target Pair