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BDBM50408886 CHEMBL57929

SMILES: CCc1c(C)[nH]c(=O)c(NC(=O)CCCCCCCCCN)c1Cc1cc(C)cc(C)c1

InChI Key: InChIKey=NLULQTPWLYENNP-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50408886   
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)
BDBM50408886
PNG
(CHEMBL57929)
Show SMILES CCc1c(C)[nH]c(=O)c(NC(=O)CCCCCCCCCN)c1Cc1cc(C)cc(C)c1
Show InChI InChI=1S/C27H41N3O2/c1-5-23-21(4)29-27(32)26(24(23)18-22-16-19(2)15-20(3)17-22)30-25(31)13-11-9-7-6-8-10-12-14-28/h15-17H,5-14,18,28H2,1-4H3,(H,29,32)(H,30,31)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/an/an/a 5.80E+4n/an/an/an/a



UMR 176 CNRS/Institut Curie

Curated by ChEMBL


Assay Description
Effective concentration required to achieve 50% inhibition of HIV-1 LAI replication in human T4 lymphoblastoid CEM-SS cells.


J Med Chem 43: 1927-39 (2000)


BindingDB Entry DOI: 10.7270/Q2WS8VFT
More data for this
Ligand-Target Pair