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BDBM50469595 CHEMBL28663

SMILES: CCCCc1nc2cccnc2n1-c1ccc(CCO\C(O)=C2\C(C(C(=O)Nc3ccccn3)=C(C)N=C2C(C)C)c2ccccc2Cl)cc1

InChI Key: InChIKey=XTRKSTWSZRTDNU-NJMFHTGSSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50469595   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Angiotensin II receptor (AT-1) type-1


(RAT)
BDBM50469595
PNG
(CHEMBL28663)
Show SMILES CCCCc1nc2cccnc2n1-c1ccc(CCO\C(O)=C2\C(C(C(=O)Nc3ccccn3)=C(C)N=C2C(C)C)c2ccccc2Cl)cc1
Show InChI InChI=1S/C40H41ClN6O3/c1-5-6-16-33-45-31-14-11-23-43-38(31)47(33)28-19-17-27(18-20-28)21-24-50-40(49)36-35(29-12-7-8-13-30(29)41)34(26(4)44-37(36)25(2)3)39(48)46-32-15-9-10-22-42-32/h7-15,17-20,22-23,25,35,49H,5-6,16,21,24H2,1-4H3,(H,42,46,48)/b40-36-
PDB

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GoogleScholar
PC cid
PC sid
UniChem
Article
n/an/a 120n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to Angiotensin II receptor, type 1 as displacement of 125I-Sar, Ile-AII from rat adrenal cortex membranes


Citation and Details

Article DOI: 10.1016/S0960-894X(01)81135-5
BindingDB Entry DOI: 10.7270/Q26M39H8
More data for this
Ligand-Target Pair