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SMILES: C(CN1CCC(=CC1)c1cccs1)[C@H]1CC[C@@H](CC1)c1c[nH]c2ccccc12

InChI Key: InChIKey=LNRNEKDKLOZZSJ-MXVIHJGJSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50055730   
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))		BDBM50055730
PNG
(3-{4-[2-(4-Thiophen-2-yl-3,6-dihydro-2H-pyridin-1-...)
Show SMILES C(CN1CCC(=CC1)c1cccs1)[C@H]1CC[C@@H](CC1)c1c[nH]c2ccccc12 |wU:16.21,wD:13.14,c:5,(13.49,-6.14,;14.8,-6.91,;16.15,-6.14,;17.5,-6.91,;18.81,-6.14,;18.81,-4.57,;17.46,-3.83,;16.12,-4.6,;20.13,-3.8,;21.54,-4.44,;22.57,-3.28,;21.76,-1.94,;20.26,-2.29,;12.14,-6.88,;10.82,-6.11,;9.48,-6.88,;9.51,-8.42,;10.82,-9.19,;12.14,-8.42,;8.22,-9.25,;8.13,-10.82,;6.65,-11.21,;5.79,-9.92,;4.28,-9.7,;3.7,-8.26,;4.69,-7.07,;6.2,-7.29,;6.75,-8.74,)|
Show InChI InChI=1S/C25H30N2S/c1-2-5-24-22(4-1)23(18-26-24)20-9-7-19(8-10-20)11-14-27-15-12-21(13-16-27)25-6-3-17-28-25/h1-6,12,17-20,26H,7-11,13-16H2/t19-,20-
PDB

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 630n/an/an/an/an/an/an/an/a



Division of Warner Lambert Company

Curated by ChEMBL


Assay Description
In vitro binding affinity for dopamine receptor D2 on rat striatal membranes by [3H]-spiperone displacement.

J Med Chem 40: 250-9 (1997)


Article DOI: 10.1021/jm960597m
BindingDB Entry DOI: 10.7270/Q28W3CD4
More data for this
Ligand-Target Pair