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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50036510   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)		BDBM50036510
PNG
(6-Methyl-7-(3-methyl-but-2-enyl)-6,7,8,9-tetrahydr...)
Show SMILES CC1N(CC=C(C)C)CCn2c3c1cccc3[nH]c2=S |(11.37,-10.6,;11.71,-9.08,;13.21,-8.75,;14.01,-10.09,;13.26,-11.44,;14.05,-12.77,;13.3,-14.12,;15.59,-12.75,;13.91,-7.12,;13.17,-5.79,;11.67,-5.54,;10.51,-6.59,;10.51,-8.13,;9.18,-8.9,;7.85,-8.13,;7.85,-6.59,;9.18,-5.82,;9.5,-4.3,;11.04,-4.16,;11.84,-2.83,)|
Show InChI InChI=1S/C16H21N3S/c1-11(2)7-8-18-9-10-19-15-13(12(18)3)5-4-6-14(15)17-16(19)20/h4-7,12H,8-10H2,1-3H3,(H,17,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 78n/an/an/an/an/an/a



IBM Thomas J. Watson Research Center

Curated by ChEMBL


Assay Description
Inhibitory concentration against HIV-1 replication by interfering with virus reverse transcriptase

J Med Chem 39: 2129-40 (1996)


Article DOI: 10.1021/jm950589q
BindingDB Entry DOI: 10.7270/Q2697471
More data for this
Ligand-Target Pair