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BDBM50411352 CHEMBL242934

SMILES: COc1cc2nc(nc(N)c2cc1OC)N1CCN([C@H]2CCCC[C@@H]12)C(=O)c1ccccc1

InChI Key: InChIKey=LHLZWQUFUNHDHT-VQTJNVASSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50411352   
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
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50411352
PNG
(CHEMBL242934)
Show SMILES COc1cc2nc(nc(N)c2cc1OC)N1CCN([C@H]2CCCC[C@@H]12)C(=O)c1ccccc1
Show InChI InChI=1S/C25H29N5O3/c1-32-21-14-17-18(15-22(21)33-2)27-25(28-23(17)26)30-13-12-29(19-10-6-7-11-20(19)30)24(31)16-8-4-3-5-9-16/h3-5,8-9,14-15,19-20H,6-7,10-13H2,1-2H3,(H2,26,27,28)/t19-,20+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 30.9n/an/an/an/an/a



University of Camerino

Curated by ChEMBL


Assay Description
Antagonist activity against adrenergic alpha-1A receptor in rat prostatic vas deferens assessed as inhibition of noradrenaline-induced contraction


Bioorg Med Chem 15: 2334-45 (2007)


Article DOI: 10.1016/j.bmc.2007.01.028
BindingDB Entry DOI: 10.7270/Q2G16229
More data for this
Ligand-Target Pair