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BDBM50141048 CHEMBL287829::N-Butyloxycarbonyl-5-isobutyl-3-(4-{6-[N-(thiophene-2-carbonyl)ethylamino]-4-oxo-2-propyl-4H-quinazolin-3-ylmethyl}phenyl)-thiophene-2-sulfonamide

SMILES: CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CCC)nc3ccc(cc3c2=O)N(CC)C(=O)c2cccs2)cc1

InChI Key: InChIKey=NBTAOBIVHRBVOB-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50141048   
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))		BDBM50141048
PNG
(CHEMBL287829 | N-Butyloxycarbonyl-5-isobutyl-3-(4-...)
Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CCC)nc3ccc(cc3c2=O)N(CC)C(=O)c2cccs2)cc1
Show InChI InChI=1S/C38H44N4O6S3/c1-6-9-19-48-38(45)40-51(46,47)37-30(23-29(50-37)21-25(4)5)27-15-13-26(14-16-27)24-42-34(11-7-2)39-32-18-17-28(22-31(32)35(42)43)41(8-3)36(44)33-12-10-20-49-33/h10,12-18,20,22-23,25H,6-9,11,19,21,24H2,1-5H3,(H,40,45)
PDB

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PC cid
PC sid
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Similars
Article
PubMed
 8n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.

J Med Chem 47: 1536-46 (2004)


Article DOI: 10.1021/jm031031i
BindingDB Entry DOI: 10.7270/Q2NS0TBV
More data for this
Ligand-Target Pair