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BDBM86560 Azanium analog, 32

SMILES: CC[NH+](CCC(=O)N1CCc2ccccc12)CC1CCCO1

InChI Key: InChIKey=LNLCLUKMQMIOCU-UHFFFAOYSA-O

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 = 86560   
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))
BDBM86560
PNG
(Azanium analog, 32)
Show SMILES CC[NH+](CCC(=O)N1CCc2ccccc12)CC1CCCO1
Show InChI InChI=1S/C18H26N2O2/c1-2-19(14-16-7-5-13-22-16)11-10-18(21)20-12-9-15-6-3-4-8-17(15)20/h3-4,6,8,16H,2,5,7,9-14H2,1H3/p+1
PDB

UniProtKB/SwissProt

antibodypedia
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AffyNet 
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PC cid
PC sid
UniChem
Article
PubMed
3.00E+3 -7.45n/an/an/an/an/a7.422



University of California San Francisco



Assay Description
Affinities for D3-dopaminergic, D2-dopaminergic and beta2-adrenergic receptors were determined by radioligand competition binding at the National Ins...


Nat Chem Biol 7: 769-78 (2011)


Article DOI: 10.1038/nchembio.662
BindingDB Entry DOI: 10.7270/Q2TM78P6
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM86560
PNG
(Azanium analog, 32)
Show SMILES CC[NH+](CCC(=O)N1CCc2ccccc12)CC1CCCO1
Show InChI InChI=1S/C18H26N2O2/c1-2-19(14-16-7-5-13-22-16)11-10-18(21)20-12-9-15-6-3-4-8-17(15)20/h3-4,6,8,16H,2,5,7,9-14H2,1H3/p+1
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
3.80E+3 -7.31n/an/an/an/an/a7.422



University of California San Francisco



Assay Description
Affinities for D3-dopaminergic, D2-dopaminergic and beta2-adrenergic receptors were determined by radioligand competition binding at the National Ins...


Nat Chem Biol 7: 769-78 (2011)


Article DOI: 10.1038/nchembio.662
BindingDB Entry DOI: 10.7270/Q2TM78P6
More data for this
Ligand-Target Pair