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SMILES: O[C@@H]1CCN(Cc2ccc(F)cc2)C[C@H]1N1CCC2(CC1)C=Cc1ccccc21

InChI Key: InChIKey=XIPWKUWYGVRFON-DNQXCXABSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50039616   
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
Vesicular acetylcholine transporter


(Torpedo californica)		BDBM50039616
PNG
(1-(4-fluorobenzyl)-3-spiro[1H-indene-1,4'-(hexahyd...)
Show SMILES O[C@@H]1CCN(Cc2ccc(F)cc2)C[C@H]1N1CCC2(CC1)C=Cc1ccccc21 |c:24|
Show InChI InChI=1S/C25H29FN2O/c26-21-7-5-19(6-8-21)17-27-14-10-24(29)23(18-27)28-15-12-25(13-16-28)11-9-20-3-1-2-4-22(20)25/h1-9,11,23-24,29H,10,12-18H2/t23-,24-/m1/s1
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
 0.248n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
In vitro binding affinity to vesamicol receptor using [3H]-vesamicol.

J Med Chem 37: 2574-82 (1994)


BindingDB Entry DOI: 10.7270/Q2HH6J44
More data for this
Ligand-Target Pair