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SMILES: CCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1

InChI Key: InChIKey=RLBFCTJFUDQGIX-UHFFFAOYSA-N

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   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50041503   
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))		BDBM50041503
PNG
(CHEMBL32254 | Propionic acid 5-phenyl-6-thia-10b-a...)
Show SMILES CCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1 |t:5|
Show InChI InChI=1S/C21H17NO2S/c1-2-19(23)24-20-17-12-8-14-22(17)16-11-6-7-13-18(16)25-21(20)15-9-4-3-5-10-15/h3-14H,2H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 67n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor

J Med Chem 37: 1427-38 (1994)


BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM50041503
PNG
(CHEMBL32254 | Propionic acid 5-phenyl-6-thia-10b-a...)
Show SMILES CCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1 |t:5|
Show InChI InChI=1S/C21H17NO2S/c1-2-19(23)24-20-17-12-8-14-22(17)16-11-6-7-13-18(16)25-21(20)15-9-4-3-5-10-15/h3-14H,2H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 66n/an/an/an/an/an/a



Universit£ di Napoli

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from rat peripheral (mitochondrial) benzodiazepine receptor

J Med Chem 37: 4100-8 (1995)


BindingDB Entry DOI: 10.7270/Q2XD129C
More data for this
Ligand-Target Pair