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BDBM50246924 1-(4-[3-(2,6-Difluorophenyl)ureidomethyl]-2-methoxybenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine::CHEMBL455696

SMILES: COc1cc(CNC(=O)Nc2c(F)cccc2F)ccc1C(=O)N1CCCCc2ccccc12

InChI Key: InChIKey=MXJZHZBJXXYPOR-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50246924   
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 V2 receptor


(Homo sapiens (Human))
BDBM50246924
PNG
(1-(4-[3-(2,6-Difluorophenyl)ureidomethyl]-2-methox...)
Show SMILES COc1cc(CNC(=O)Nc2c(F)cccc2F)ccc1C(=O)N1CCCCc2ccccc12
Show InChI InChI=1S/C26H25F2N3O3/c1-34-23-15-17(16-29-26(33)30-24-20(27)9-6-10-21(24)28)12-13-19(23)25(32)31-14-5-4-8-18-7-2-3-11-22(18)31/h2-3,6-7,9-13,15H,4-5,8,14,16H2,1H3,(H2,29,30,33)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 110n/an/an/an/a



Vantia Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human vasopressin V2 receptor expressed in HEK293 cells assessed as increase in intracellular cAMP level by CRE-luciferase report...


J Med Chem 51: 8124-34 (2008)


Article DOI: 10.1021/jm8008162
BindingDB Entry DOI: 10.7270/Q28W3D6V
More data for this
Ligand-Target Pair