BDBM50044913 CHEMBL440551::Heptadeca-9,12-dienoic acid 5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-2,5-dihydro-furan-2-ylmethyl ester

SMILES: CCCC\C=C\C\C=C\CCCCCCCC(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O

InChI Key: InChIKey=CNKOBTLXVUYXAI-AVQMFFATSA-N

Data: 1 EC50

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 = 50044913   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50044913 (CHEMBL440551 | Heptadeca-9,12-dienoic acid 5-(5-me...) Show SMILES CCCC\C=C\C\C=C\CCCCCCCC(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O |c:23| Show InChI InChI=1S/C27H40N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(30)33-21-23-18-19-24(34-23)29-20-22(2)26(31)28-27(29)32/h6-7,9-10,18-20,23-24H,3-5,8,11-17,21H2,1-2H3,(H,28,31,32)/b7-6+,10-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/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