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SMILES: [H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])C[C@H](OC(=O)CCCCC)C2=CC(=O)CC[C@]12C

InChI Key: InChIKey=AMIDPDOKRBRJTC-TTZDETBQSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50135976   
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
Aromatase


(Homo sapiens (Human))		BDBM50135976
PNG
(CHEMBL3752998)
Show SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])C[C@H](OC(=O)CCCCC)C2=CC(=O)CC[C@]12C |r,t:26|
Show InChI InChI=1S/C25H36O4/c1-4-5-6-7-23(28)29-21-15-17-18-8-9-22(27)25(18,3)13-11-19(17)24(2)12-10-16(26)14-20(21)24/h14,17-19,21H,4-13,15H2,1-3H3/t17-,18-,19-,21-,24+,25-/m0/s1
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Similars
Article
PubMed
 7n/an/an/an/an/an/an/an/a



The M. S. University of Baroda

Curated by ChEMBL


Assay Description
Competitive inhibition of human aromatase extracted from placental microsomes after 5 mins by Dixon plot analysis in presence of [1beta-3H]AD

Eur J Med Chem 105: 1-38 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.038
BindingDB Entry DOI: 10.7270/Q2W66NMZ
More data for this
Ligand-Target Pair