General Information of the Compound
| Compound ID |
CP0391149
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| Compound Name |
[[2-[(2,4-dioxopyrimidin-1-yl)methoxy]ethoxy-sulfanylphosphinothioyl]oxy-hydroxyphosphoryl]methylphosphonic acid
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| Structure |
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| Formula |
C8H15N2O10P3S2
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| Molecular Weight |
456.268
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| Canonical SMILES |
OP(O)(=O)CP(O)(=O)OP(S)(=S)OCCOCn1ccc(=O)[nH]c1=O
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| InChI |
InChI=1S/C8H15N2O10P3S2/c11-7-1-2-10(8(12)9-7)5-18-3-4-19-23(24,25)20-22(16,17)6-21(13,14)15/h1-2H,3-6H2,(H,16,17)(H,24,25)(H,9,11,12)(H2,13,14,15)
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| InChIKey |
IGNBLEMYTVSCCH-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound