Bioactive Compound Details

BioIDbio199412
Name5-FLUORODEOXYURIDYLATE
ChEMBL IDCHEMBL886
Molecular FormulaC9H12FN2O8P
Molecular Weight326.17
Molecular Weight (Monoisotopic)326.0315
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms5-Fluoro-2-Deoxyuridine Monophosphate (Fdump)
SmilesO=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)cc1F
InchiInChI=1S/C9H12FN2O8P/c10-4-2-12(9(15)11-8(4)14)7-1-5(13)6(20-7)3-19-21(16,17)18/h2,5-7,13H,1,3H2,(H,11,14,15)(H2,16,17,18)/t5-,6+,7+/m0/s1
Inchi KeyHFEKDTCAMMOLQP-RRKCRQDMSA-N
Molecular SpeciesACID
Targets20.0
Bioactivities94.0
Np Likeness Score0.72
Records Key['5F-dump', 'FdUMP', 'F-d UMP', '5-fluro-dU', 'FdUMP', '6', 'FdUMP', FDurd 5'P", '5-fluorodeoxyuridylate', 'FdUMP', 'FdUMP', '5F-dUMP', 'FdUMP', 'FdUMP', 'Fluorodeoxyuridylate', 'Pg No:1138, R9C2(5-F)', 'FdUMP', "5'-Fluoro-2'-deoxyuridine monophosphate", '4', '4, FdUMP, 5-FdUMP', '5-FLUORODEOXYURIDINE MONOPHOSPHATE', '5-FdUMP']"
Records Name['Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester (FdUMP)', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester (FdUMP)', '[5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl]methyl dihydrogen phosphate', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester (FDurd 5'P)", 'Phosphoric acid mono-[(2R,3S,5R)-5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', '((2R,3S,5R)-5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate', '(R)-5-Fluoro-1-((4S,5R)-4-hydroxy-5-methylphosphate-tetrahydro-furan-2-yl)-1H-pyrimidine-2,4-dione', 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', '((2R,3S,5R)-5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate', 'Fluorodeoxyuridylate', "5-fluoro-2'-deoxyuridine 5'-phosphate", "5-fluorodeoxyuridine 5'-monophosphate", "5'-Fluoro-2'-deoxyuridine monophosphate", 'Phosphoric acid mono-[5-(5-fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-3-hydroxy-tetrahydro-furan-2-ylmethyl] ester', '((2R,3S,5R)-5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate', '5-FLUORODEOXYURIDINE MONOPHOSPHATE', '((2R,3S,5R)-5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure