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BDBM50493586 CHEMBL2435832

SMILES: CCCc1nc2c(C)cc(cc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)N1CCOCC1

InChI Key: InChIKey=CHQUUGVSBDZWQM-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50493586   
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
Angiotensin II receptor


(Homo sapiens (Human))
BDBM50493586
PNG
(CHEMBL2435832)
Show SMILES CCCc1nc2c(C)cc(cc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)N1CCOCC1
Show InChI InChI=1S/C30H31N3O4/c1-3-6-27-31-28-20(2)17-23(29(34)32-13-15-37-16-14-32)18-26(28)33(27)19-21-9-11-22(12-10-21)24-7-4-5-8-25(24)30(35)36/h4-5,7-12,17-18H,3,6,13-16,19H2,1-2H3,(H,35,36)
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.01E+3n/an/an/an/an/an/a



Beijing Institute of Technology

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1Ile8-angiotensin 2 from angiotensin 2 AT1 receptor (unknown origin) after 180 mins by gamma counting analysis


Eur J Med Chem 69: 44-54 (2013)


Article DOI: 10.1016/j.ejmech.2013.08.014
BindingDB Entry DOI: 10.7270/Q2PK0K32
More data for this
Ligand-Target Pair