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SMILES: Cn1cc(cn1)-c1cnc2oc3c(nc(=O)n(CCC4CCCO4)c3c2c1)-c1ccn(C)n1

InChI Key: InChIKey=FVJHLTPVETWPQD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50492139   
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
Reverse transcriptase


(Human immunodeficiency virus 1)		BDBM50492139
PNG
(CHEMBL2397552)
Show SMILES Cn1cc(cn1)-c1cnc2oc3c(nc(=O)n(CCC4CCCO4)c3c2c1)-c1ccn(C)n1
Show InChI InChI=1S/C23H23N7O3/c1-28-7-6-18(27-28)19-21-20(30(23(31)26-19)8-5-16-4-3-9-32-16)17-10-14(11-24-22(17)33-21)15-12-25-29(2)13-15/h6-7,10-13,16H,3-5,8-9H2,1-2H3
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UniProtKB/TrEMBL

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PC cid
PC sid
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Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Boehringer Ingelheim (Canada) Ltd

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase using poly(rA)/oligo(dT)15 as substrate after 60 mins by fluorescence assay

Bioorg Med Chem Lett 23: 3967-75 (2013)


Article DOI: 10.1016/j.bmcl.2013.04.043
BindingDB Entry DOI: 10.7270/Q26976HF
More data for this
Ligand-Target Pair