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SMILES: CC(NC(=O)c1[nH]c2ccc(Br)cc2c1S(=O)(=O)c1cc(C)cc(C)c1)C(N)=O

InChI Key: InChIKey=ZWDMOCLWOFLYJB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50479971   
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)		BDBM50479971
PNG
(CHEMBL469562)
Show SMILES CC(NC(=O)c1[nH]c2ccc(Br)cc2c1S(=O)(=O)c1cc(C)cc(C)c1)C(N)=O
Show InChI InChI=1S/C20H20BrN3O4S/c1-10-6-11(2)8-14(7-10)29(27,28)18-15-9-13(21)4-5-16(15)24-17(18)20(26)23-12(3)19(22)25/h4-9,12,24H,1-3H3,(H2,22,25)(H,23,26)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Sapienza Universita di Roma

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase p66/p51

J Med Chem 52: 1922-34 (2009)


Article DOI: 10.1021/jm801470b
BindingDB Entry DOI: 10.7270/Q27H1NDK
More data for this
Ligand-Target Pair