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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V1a/V1b receptor' and Ligand = 'BDBM50043075'   
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/V1b receptor


(RAT)		BDBM50043075
PNG
(1N-[7,7-dimethyl-1-spiro[2,3-dihydro-1H-indene-1,4...)
Show SMILES CN(C)CC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc34)CC1)C2(C)C
Show InChI InChI=1S/C29H44N4O4S/c1-27(2)22-10-12-29(27,24(17-22)31-25(34)18-30-26(35)19-32(3)4)20-38(36,37)33-15-13-28(14-16-33)11-9-21-7-5-6-8-23(21)28/h5-8,22,24H,9-20H2,1-4H3,(H,30,35)(H,31,34)/t22-,24+,29-/m1/s1
MMDB

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PC cid
PC sid
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Similars
PubMed
n/an/a>300n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of radioligand [3H]AVP binding to the vasopressin V1 receptor in rat liver tissue

J Med Chem 36: 3993-4005 (1994)


BindingDB Entry DOI: 10.7270/Q27M070W
More data for this
Ligand-Target Pair