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BDBM50193550 CHEMBL213365::[1-[2',5'-bis-O-(tert-butyldimethylsilyl)-beta-D-ribofuranosyl]-3-N-[3-N'-[glycyl-prolylamino]propyl]thymine]-3'-spiro-''-[4''-amino-1'',2''-oxathiole-2'',2''-dioxide]

SMILES: Cc1cn(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)c(=O)n(CCCNC(=O)[C@@H]2CCCN2C(=O)CN)c1=O

InChI Key: InChIKey=WULPBOQOZHAWQX-KFWJCNQQSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50193550   
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
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)		BDBM50193550
PNG
(CHEMBL213365 | [1-[2',5'-bis-O-(tert-butyldimethyl...)
Show SMILES Cc1cn(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)c(=O)n(CCCNC(=O)[C@@H]2CCCN2C(=O)CN)c1=O |c:21|
Show InChI InChI=1S/C34H60N6O10SSi2/c1-22-19-40(31(44)39(29(22)43)17-13-15-37-28(42)23-14-12-16-38(23)26(41)18-35)30-27(49-53(10,11)33(5,6)7)34(24(36)21-51(45,46)50-34)25(48-30)20-47-52(8,9)32(2,3)4/h19,21,23,25,27,30H,12-18,20,35-36H2,1-11H3,(H,37,42)/t23-,25?,27?,30?,34?/m0/s1
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Similars
Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



Instituto de Química Médica (C.S.I.C.)

Curated by ChEMBL


Assay Description
Inhibition of recombinant HIV1 reverse transcriptase

J Med Chem 49: 5339-51 (2006)


Article DOI: 10.1021/jm0606490
BindingDB Entry DOI: 10.7270/Q2M32VDQ
More data for this
Ligand-Target Pair