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SMILES: COc1cccc(c1)C(=N)C(=N/S(=O)(=O)c1ccc(Cl)cc1)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1

InChI Key: InChIKey=QRPLJUBJZZYNIK-PBRHTIIUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 463805   
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
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM463805
PNG
(US10787419, Serial # 17)
Show SMILES COc1cccc(c1)C(=N)C(=N/S(=O)(=O)c1ccc(Cl)cc1)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:27|
Show InChI InChI=1S/C30H24Cl2N4O3S/c1-39-25-9-5-8-22(18-25)28(33)30(35-40(37,38)26-16-14-24(32)15-17-26)36-19-27(20-6-3-2-4-7-20)29(34-36)21-10-12-23(31)13-11-21/h2-18,27,33H,19H2,1H3/b33-28?,35-30+
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UniChem
US Patent
 86n/an/an/an/an/an/an/an/a



The United States of America, as represented by the Secretary, Department of Health and Human Services

US Patent


Assay Description
Measuring its tissue levels 1 hour after administration of 10 mg/kg to mice, plasma levels were comparable after oral or i.p. administration (indicat...

US Patent US10787419 (2020)


BindingDB Entry DOI: 10.7270/Q2HH6P4S
More data for this
Ligand-Target Pair