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SMILES: COc1ccc(OCCOS(=O)(=O)c2ccc(C)cc2)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1

InChI Key: InChIKey=NXXJKNZCEXCLHX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50144887   
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
Translocator protein


(Rattus norvegicus (rat))		BDBM50144887
PNG
(CHEMBL443526 | Toluene-4-sulfonic acid 2-(2-{[acet...)
Show SMILES COc1ccc(OCCOS(=O)(=O)c2ccc(C)cc2)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C31H30FNO7S/c1-22-9-13-28(14-10-22)41(35,36)39-18-17-38-30-16-12-27(37-3)19-24(30)21-33(23(2)34)29-20-25(32)11-15-31(29)40-26-7-5-4-6-8-26/h4-16,19-20H,17-18,21H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents
Article
PubMed
 18.1n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
In vitro inhibition of [11C]2 binding to Peripheral benzodiazepine receptor (PBR) in rat brain

J Med Chem 47: 2228-35 (2004)


Article DOI: 10.1021/jm0304919
BindingDB Entry DOI: 10.7270/Q20G3KXQ
More data for this
Ligand-Target Pair