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BDBM50027919 5-fluoro-deoxyuridinemonophosphate::CHEMBL416879

SMILES: OC1CC(OC1OP([O-])([O-])=O)n1cc(F)c(=O)[nH]c1=O

InChI Key: InChIKey=GUSUGGMZODUXJY-UHFFFAOYSA-L

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50027919   
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
Thymidylate Synthase (TS)


(Lactobacillus casei)
BDBM50027919
PNG
(5-fluoro-deoxyuridinemonophosphate | CHEMBL416879)
Show SMILES OC1CC(OC1OP([O-])([O-])=O)n1cc(F)c(=O)[nH]c1=O
Show InChI InChI=1S/C8H10FN2O8P/c9-3-2-11(8(14)10-6(3)13)5-1-4(12)7(18-5)19-20(15,16)17/h2,4-5,7,12H,1H2,(H,10,13,14)(H2,15,16,17)/p-2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
500n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inactivation of thymidylate synthetase measured asKi at 6.8 pH 30 degrees centigrade temp


J Med Chem 26: 1028-36 (1983)


BindingDB Entry DOI: 10.7270/Q2VD6XG7
More data for this
Ligand-Target Pair