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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 = 'BDBM50152978'   
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))
BDBM50152978
PNG
((3S,5R)-4-Methoxy-2-(4-methyl-[1,4]diazepane-1-car...)
Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)NCc1ccc(cc1Cl)C(=O)N1CCCCc2sccc12)C(=O)N1CCCN(C)CC1
Show InChI InChI=1S/C29H38ClN5O4S/c1-32-10-5-11-33(14-13-32)28(37)25-17-22(39-2)19-35(25)29(38)31-18-21-8-7-20(16-23(21)30)27(36)34-12-4-3-6-26-24(34)9-15-40-26/h7-9,15-16,22,25H,3-6,10-14,17-19H2,1-2H3,(H,31,38)/t22-,25+/m1/s1
PDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 1.30E+3n/an/an/an/a



Ferring Research Ltd

Curated by ChEMBL


Assay Description
Effective concentration for human Vassopressin V2 receptor


Bioorg Med Chem Lett 14: 4585-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.107
BindingDB Entry DOI: 10.7270/Q2DF6QPR
More data for this
Ligand-Target Pair