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BDBM50217809 6-(5-butylpyrid-2-yl)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-furo[2,3-d]pyrimidin-2(3H)-one::CHEMBL244614

SMILES: CCCCc1ccc(nc1)-c1cc2cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)nc2o1

InChI Key: InChIKey=FRVTYBJEWRDHSI-CGTJXYLNSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50217809   
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
Thymidine kinase


(Varicella-zoster virus (strain Dumas) (HHV-3) (Hum...)
BDBM50217809
PNG
(6-(5-butylpyrid-2-yl)-3-(2-deoxy-beta-D-erythro-pe...)
Show SMILES CCCCc1ccc(nc1)-c1cc2cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)nc2o1
Show InChI InChI=1S/C20H23N3O5/c1-2-3-4-12-5-6-14(21-9-12)16-7-13-10-23(20(26)22-19(13)28-16)18-8-15(25)17(11-24)27-18/h5-7,9-10,15,17-18,24-25H,2-4,8,11H2,1H3/t15-,17+,18+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.40E+4n/an/an/an/an/an/a



Brigham Young University

Curated by ChEMBL


Assay Description
Inhibition of VZV thymidine kinase


J Med Chem 50: 3897-905 (2007)


Article DOI: 10.1021/jm070210n
BindingDB Entry DOI: 10.7270/Q2S75G19
More data for this
Ligand-Target Pair