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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 = 'BDBM50087542'   
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


(Homo sapiens (Human))		BDBM50087542
PNG
(CHEMBL350089 | N-[3-Chloro-4-(5,6,7,8-tetrahydro-t...)
Show SMILES Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2CCCCc3sccc23)c(Cl)c1
Show InChI InChI=1S/C23H20ClFN2O2S/c1-14-5-6-15(25)12-18(14)22(28)26-16-7-8-17(19(24)13-16)23(29)27-10-3-2-4-21-20(27)9-11-30-21/h5-9,11-13H,2-4,10H2,1H3,(H,26,28)
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PubMed
n/an/a 3.40n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
In vitro binding affinity to human V2 receptor

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


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