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SMILES: CCCCCCCCCCCCCCCC(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O

InChI Key: InChIKey=XTIMRXVPVFZNGL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50044907   
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)		BDBM50044907
PNG
(CHEMBL166614 | Hexadecanoic acid 5-(5-methyl-2,4-d...)
Show SMILES CCCCCCCCCCCCCCCC(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O |c:22|
Show InChI InChI=1S/C26H42N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24(29)32-20-22-17-18-23(33-22)28-19-21(2)25(30)27-26(28)31/h17-19,22-23H,3-16,20H2,1-2H3,(H,27,30,31)
PDB
MMDB

UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/an/a 80n/an/an/an/a



URA CNRS 1309

Curated by ChEMBL


Assay Description
Effective concentration that reduces HIV-induced cytopathic effect by 50% was determined by reverse transcriptase (RT) assay.

J Med Chem 36: 826-30 (1993)


BindingDB Entry DOI: 10.7270/Q2WW7JBD
More data for this
Ligand-Target Pair