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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50057856   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50057856
PNG
((5aR,11bS)-3-Propyl-4,5,5a,6,7,11b-hexahydro-2-thi...)
Show SMILES CCCc1scc2[C@H]3[C@@H](CCc4cc(O)c(O)cc34)NCc12
Show InChI InChI=1S/C18H21NO2S/c1-2-3-17-12-8-19-14-5-4-10-6-15(20)16(21)7-11(10)18(14)13(12)9-22-17/h6-7,9,14,18-21H,2-5,8H2,1H3/t14-,18+/m1/s1
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PC sid
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Similars

Article
PubMed
100n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine receptor D2 like from rat caudate membrane using [3H]-spiperone as radioligand


J Med Chem 40: 1585-99 (1997)


Article DOI: 10.1021/jm970038v
BindingDB Entry DOI: 10.7270/Q2Z89D2B
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50057856
PNG
((5aR,11bS)-3-Propyl-4,5,5a,6,7,11b-hexahydro-2-thi...)
Show SMILES CCCc1scc2[C@H]3[C@@H](CCc4cc(O)c(O)cc34)NCc12
Show InChI InChI=1S/C18H21NO2S/c1-2-3-17-12-8-19-14-5-4-10-6-15(20)16(21)7-11(10)18(14)13(12)9-22-17/h6-7,9,14,18-21H,2-5,8H2,1H3/t14-,18+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
125n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine receptor D1 like from rat caudate membrane using [125I]-SCH as radioligand


J Med Chem 40: 1585-99 (1997)


Article DOI: 10.1021/jm970038v
BindingDB Entry DOI: 10.7270/Q2Z89D2B
More data for this
Ligand-Target Pair