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BDBM50101084 CHEMBL3326219

SMILES: Cl.CN(C)[C@@]1(CC[C@@H](CC1)N1CCOCC1)c1ccccc1

InChI Key: InChIKey=KZDHHBYCERGVIK-HDICACEKSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50101084   
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
Nociceptin receptor


(Homo sapiens (Human))		BDBM50101084
PNG
(CHEMBL3326219)
Show SMILES Cl.CN(C)[C@@]1(CC[C@@H](CC1)N1CCOCC1)c1ccccc1 |r,wU:7.9,4.2,(16.38,-30.86,;12.7,-28.29,;11.37,-27.52,;11.36,-25.98,;10.03,-28.29,;9.26,-26.96,;7.72,-26.97,;6.96,-28.3,;7.73,-29.63,;9.27,-29.63,;5.41,-28.3,;4.64,-26.97,;3.1,-26.97,;2.32,-28.3,;3.09,-29.64,;4.64,-29.65,;10.83,-29.61,;10.09,-30.96,;10.88,-32.28,;12.43,-32.25,;13.17,-30.89,;12.37,-29.57,)|
Show InChI InChI=1S/C18H28N2O/c1-19(2)18(16-6-4-3-5-7-16)10-8-17(9-11-18)20-12-14-21-15-13-20/h3-7,17H,8-15H2,1-2H3/t17-,18+
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Similars
Article
PubMed
 810n/an/an/an/an/an/an/an/a



Pharmacokinetics

Curated by ChEMBL


Assay Description
Displacement of [3H]nociceptin from human NOP receptor expressed in CHO-K1 cells after 90 mins

ACS Med Chem Lett 5: 851-6 (2014)


Article DOI: 10.1021/ml500116x
BindingDB Entry DOI: 10.7270/Q28S4RPM
More data for this
Ligand-Target Pair