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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V1a receptor' and Ligand = 'BDBM75546'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Vasopressin V1a receptor


(Homo sapiens (Human))		BDBM75546
PNG
(1-(5-bromo-2-thiophenyl)-2-[2-imino-3-(phenylmethy...)
Show SMILES Brc1ccc(s1)C(=O)Cn1c2ccccc2n(Cc2ccccc2)c1=N
Show InChI InChI=1S/C20H16BrN3OS/c21-19-11-10-18(26-19)17(25)13-24-16-9-5-4-8-15(16)23(20(24)22)12-14-6-2-1-3-7-14/h1-11,22H,12-13H2
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PCBioAssay
n/an/an/an/a 1.51E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q228062C
More data for this
Ligand-Target Pair