BindingDB logo
myBDB logout

BDBM50407106 CHEMBL173868

SMILES: CCc1cc(CCC(=O)Nc2c(O)cc(Cl)cc2Cl)c(=O)[nH]c1C

InChI Key: InChIKey=PXRKCIWITLWWMI-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50407106   
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)
BDBM50407106
PNG
(CHEMBL173868)
Show SMILES CCc1cc(CCC(=O)Nc2c(O)cc(Cl)cc2Cl)c(=O)[nH]c1C
Show InChI InChI=1S/C17H18Cl2N2O3/c1-3-10-6-11(17(24)20-9(10)2)4-5-15(23)21-16-13(19)7-12(18)8-14(16)22/h6-8,22H,3-5H2,1-2H3,(H,20,24)(H,21,23)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



Merck Reserch Laboratories

Curated by ChEMBL


Assay Description
Tested for inhibition against HIV-1 RT (used (poly)rC-(oligo)dG as the template)


J Med Chem 36: 953-66 (1993)


BindingDB Entry DOI: 10.7270/Q2JW8G28
More data for this
Ligand-Target Pair