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SMILES: CCO[C@@H]1N(C2CC(N=[N+]=[N-])C(CO)O2)C(=O)NC(=O)[C@@]1(C)Br

InChI Key: InChIKey=PEXTUNYSUGCNRK-SEKBPNPPSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50407267   
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/RNaseH


(Human immunodeficiency virus 1)		BDBM50407267
PNG
(CHEMBL132707)
Show SMILES CCO[C@@H]1N(C2CC(N=[N+]=[N-])C(CO)O2)C(=O)NC(=O)[C@@]1(C)Br
Show InChI InChI=1S/C12H18BrN5O5/c1-3-22-10-12(2,13)9(20)15-11(21)18(10)8-4-6(16-17-14)7(5-19)23-8/h6-8,10,19H,3-5H2,1-2H3,(H,15,20,21)/t6?,7?,8?,10-,12+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

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DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/an/a 23.7n/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Effective concentration in vitro agaianst HIV-1-infected CEM cells relative to uninfected untreated controls

J Med Chem 37: 4297-306 (1995)


BindingDB Entry DOI: 10.7270/Q2NP25M9
More data for this
Ligand-Target Pair