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SMILES: Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=N\S(=O)(=O)c1ccc(Cl)cc1)\C(=N)c1ccncc1

InChI Key: InChIKey=FJECATAZXKKXOT-QIWNMPJDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 463800   
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))		BDBM463800
PNG
(US10787419, Serial # 12)
Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=N\S(=O)(=O)c1ccc(Cl)cc1)\C(=N)c1ccncc1 |t:8|
Show InChI InChI=1S/C28H21Cl2N5O2S/c29-22-8-6-21(7-9-22)27-25(19-4-2-1-3-5-19)18-35(33-27)28(26(31)20-14-16-32-17-15-20)34-38(36,37)24-12-10-23(30)11-13-24/h1-17,25,31H,18H2/b31-26?,34-28+
PDB

UniProtKB/SwissProt

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PC cid
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UniChem
US Patent
 34n/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