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BDBM50091591 (2S)-1-(4-amino-2,3,5-trimethylphenoxy)-3-{4-[4-(4-flourobenzyl)phenyl]-1-piperazinyl}-2-propanol dimethanesulfonate(SUN N8075)::CHEMBL325689

SMILES: Cc1cc(OC[C@@H](O)CN2CCN(CC2)c2ccc(Cc3ccc(F)cc3)cc2)c(C)c(C)c1N

InChI Key: InChIKey=BNGQNTZNOYCZSU-MHZLTWQESA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50091591   
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(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50091591
PNG
((2S)-1-(4-amino-2,3,5-trimethylphenoxy)-3-{4-[4-(4...)
Show SMILES Cc1cc(OC[C@@H](O)CN2CCN(CC2)c2ccc(Cc3ccc(F)cc3)cc2)c(C)c(C)c1N
Show InChI InChI=1S/C29H36FN3O2/c1-20-16-28(21(2)22(3)29(20)31)35-19-27(34)18-32-12-14-33(15-13-32)26-10-6-24(7-11-26)17-23-4-8-25(30)9-5-23/h4-11,16,27,34H,12-15,17-19,31H2,1-3H3/t27-/m0/s1
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PC cid
PC sid
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n/an/a>1.00E+4n/an/an/an/an/an/a



Suntory Biomedical Research Limited

Curated by ChEMBL


Assay Description
Concentration required for 50% inhibitory effect on Dopamine receptor D2 determined in competition experiments with [3H]raclopride

J Med Chem 43: 3372-6 (2000)


BindingDB Entry DOI: 10.7270/Q27945CD
More data for this
Ligand-Target Pair