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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V1b receptor' and Ligand = 'BDBM50325826'   
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 V1b receptor


(Homo sapiens (Human))		BDBM50325826
PNG
((S)-2-amino-N-(1-(3-(2-(cyclopropylmethylamino)-2-...)
Show SMILES CC(C)C[C@@H](COc1ccc2nc(-c3ccccc3)n(CC(=O)NCC3CC3)c(=O)c2c1)NC(=O)CN |r|
Show InChI InChI=1S/C28H35N5O4/c1-18(2)12-21(31-25(34)14-29)17-37-22-10-11-24-23(13-22)28(36)33(16-26(35)30-15-19-8-9-19)27(32-24)20-6-4-3-5-7-20/h3-7,10-11,13,18-19,21H,8-9,12,14-17,29H2,1-2H3,(H,30,35)(H,31,34)/t21-/m0/s1
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n/an/a 5.10E+3n/an/an/an/an/an/a



Ligand Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]AVP from human vasopresin3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 5394-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.118
BindingDB Entry DOI: 10.7270/Q2222TZ5
More data for this
Ligand-Target Pair