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SMILES: CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@H]1OC[C@@H]2[C@H]3CCC(C)(C)N3O[C@H]12

InChI Key: InChIKey=WOAIFBDCDAQVMS-PXTDVBALSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50282901   
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


(Bos taurus)		BDBM50282901
PNG
(2-Butyl-6-((3R,3aS,8aR,8bS)-6,6-dimethyl-octahydro...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)[C@H]1OC[C@@H]2[C@H]3CCC(C)(C)N3O[C@H]12
Show InChI InChI=1S/C36H39N7O3/c1-4-5-10-31-37-29-16-15-24(32-33-28(21-45-32)30-17-18-36(2,3)43(30)46-33)19-27(29)35(44)42(31)20-22-11-13-23(14-12-22)25-8-6-7-9-26(25)34-38-40-41-39-34/h6-9,11-16,19,28,30,32-33H,4-5,10,17-18,20-21H2,1-3H3,(H,38,39,40,41)/t28-,30-,32-,33+/m1/s1
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Article
n/an/a 53n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity to angiotensin II receptor in bovine adrenal cortex

Bioorg Med Chem Lett 4: 1819-1824 (1994)


Article DOI: 10.1016/S0960-894X(01)80377-2
BindingDB Entry DOI: 10.7270/Q21V5DXH
More data for this
Ligand-Target Pair