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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V2 receptor' and Ligand = 'BDBM50087554'   
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 V2 receptor


(Rattus norvegicus (Rat))		BDBM50087554
PNG
(CHEMBL162748 | N-[3-Chloro-4-(4,5-dihydro-2H-9-thi...)
Show SMILES Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCc3c[nH]nc3-c3sccc23)c(Cl)c1
Show InChI InChI=1S/C24H18ClFN4O2S/c1-13-2-3-15(26)10-18(13)23(31)28-16-4-5-17(19(25)11-16)24(32)30-8-6-14-12-27-29-21(14)22-20(30)7-9-33-22/h2-5,7,9-12H,6,8H2,1H3,(H,27,29)(H,28,31)
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n/an/a 6n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro for its binding affinity to rat V2 receptor

Bioorg Med Chem Lett 10: 695-8 (2000)


BindingDB Entry DOI: 10.7270/Q2X34WP8
More data for this
Ligand-Target Pair