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BDBM50416654 CHEMBL1222761

SMILES: CC(C)NC(=O)Cn1c(cn2cc(cc2c1=O)N1CCC(CC1)N(C)C)-c1cccc(Cl)c1

InChI Key: InChIKey=BMXNKFLJEJXKQP-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50416654   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Vasopressin V1b receptor


(Homo sapiens (Human))
BDBM50416654
PNG
(CHEMBL1222761)
Show SMILES CC(C)NC(=O)Cn1c(cn2cc(cc2c1=O)N1CCC(CC1)N(C)C)-c1cccc(Cl)c1
Show InChI InChI=1S/C25H32ClN5O2/c1-17(2)27-24(32)16-31-23(18-6-5-7-19(26)12-18)15-30-14-21(13-22(30)25(31)33)29-10-8-20(9-11-29)28(3)4/h5-7,12-15,17,20H,8-11,16H2,1-4H3,(H,27,32)
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PC sid
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Similars

Article
PubMed
n/an/a 63.1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human vasopressin 1b receptor expressed in CHO cells assessed as inhibition of vasopressin-induced intracellular calcium mobil...


Bioorg Med Chem Lett 20: 5044-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.037
BindingDB Entry DOI: 10.7270/Q24J0GC3
More data for this
Ligand-Target Pair