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SMILES: O=C(NC12CC3CC(CC(C3)C1)C2)N1c2ccccc2Sc2ccccc12

InChI Key: InChIKey=YTNHIPMOCAHDRX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50308401   
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
Cholinesterase


(Homo sapiens (Human))		BDBM50308401
PNG
(CHEMBL591468 | N-(Adamant-1-yl)-1'H-phenothiazine-...)
Show SMILES O=C(NC12CC3CC(CC(C3)C1)C2)N1c2ccccc2Sc2ccccc12 |TLB:6:7:4.5.10:11,THB:6:5:11:12.7.8,8:7:4:10.9.11,8:9:4:12.6.7|
Show InChI InChI=1S/C23H24N2OS/c26-22(24-23-12-15-9-16(13-23)11-17(10-15)14-23)25-18-5-1-3-7-20(18)27-21-8-4-2-6-19(21)25/h1-8,15-17H,9-14H2,(H,24,26)
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MMDB

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Article
PubMed
 350n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Inhibition of human plasma BuChE by modified Ellman's spectrophotometric method

Bioorg Med Chem 18: 2232-44 (2010)


Article DOI: 10.1016/j.bmc.2010.01.066
BindingDB Entry DOI: 10.7270/Q21C1X08
More data for this
Ligand-Target Pair