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SMILES: CCc1nc2cccc(C(O)=O)c2n1Cc1ccc(cc1)-n1cccc1C(O)=O

InChI Key: InChIKey=JSRRACYCGMXWCM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50209828   
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
Type-1 angiotensin II receptor


(RABBIT)
BDBM50209828
PNG
(3-(4-(2-carboxy-1H-pyrrol-1-yl)benzyl)-2-ethyl-3H-...)
Show SMILES CCc1nc2cccc(C(O)=O)c2n1Cc1ccc(cc1)-n1cccc1C(O)=O
Show InChI InChI=1S/C22H19N3O4/c1-2-19-23-17-6-3-5-16(21(26)27)20(17)25(19)13-14-8-10-15(11-9-14)24-12-4-7-18(24)22(28)29/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 316n/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor assessed inhibition of angiotensin-2-induced contraction of rabbit thoracic aortic rings


Bioorg Med Chem Lett 17: 2921-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.042
BindingDB Entry DOI: 10.7270/Q2C82908
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(Bos taurus)
BDBM50209828
PNG
(3-(4-(2-carboxy-1H-pyrrol-1-yl)benzyl)-2-ethyl-3H-...)
Show SMILES CCc1nc2cccc(C(O)=O)c2n1Cc1ccc(cc1)-n1cccc1C(O)=O
Show InChI InChI=1S/C22H19N3O4/c1-2-19-23-17-6-3-5-16(21(26)27)20(17)25(19)13-14-8-10-15(11-9-14)24-12-4-7-18(24)22(28)29/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29)
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 160n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Displacement of [125I]angiotensin-2 from bovine adrenal cortex AT1 receptor


Bioorg Med Chem Lett 17: 2921-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.042
BindingDB Entry DOI: 10.7270/Q2C82908
More data for this
Ligand-Target Pair