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SMILES: Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=N\S(=O)(=O)c1ccc(Cl)cc1)\C1NCCCC1=N

InChI Key: InChIKey=UJWJZJYUXIQIRO-NAKRYDGISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 463788   
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))		BDBM463788
PNG
(US10787419, Serial # 6)
Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=N\S(=O)(=O)c1ccc(Cl)cc1)\C1NCCCC1=N |t:8|
Show InChI InChI=1S/C27H25Cl2N5O2S/c28-20-10-8-19(9-11-20)25-23(18-5-2-1-3-6-18)17-34(32-25)27(26-24(30)7-4-16-31-26)33-37(35,36)22-14-12-21(29)13-15-22/h1-3,5-6,8-15,23,26,30-31H,4,7,16-17H2/b30-24?,33-27+
PDB

UniProtKB/SwissProt

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PC cid
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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