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

InChI Key: InChIKey=IDPUZVQNTVTOAG-GBCCSZBUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 463787   
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))		BDBM463787
PNG
(US10787419, Serial # 5)
Show SMILES CC(C)C(=N)C(=N/S(=O)(=O)c1ccc(Cl)cc1)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:21|
Show InChI InChI=1S/C26H24Cl2N4O2S/c1-17(2)24(29)26(31-35(33,34)22-14-12-21(28)13-15-22)32-16-23(18-6-4-3-5-7-18)25(30-32)19-8-10-20(27)11-9-19/h3-15,17,23,29H,16H2,1-2H3/b29-24?,31-26+
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
 29n/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