General Information of the Compound
| Compound ID |
CP0475849
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| Compound Name |
5-[(4-fluorophenyl)methyl]-1H-pyrano[2,3-d]pyrimidine-2,4,7-trione
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| Structure |
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| Formula |
C14H9FN2O4
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| Molecular Weight |
288.234
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| Canonical SMILES |
Fc1ccc(Cc2cc(=O)oc3[nH]c(=O)[nH]c(=O)c23)cc1
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| InChI |
InChI=1S/C14H9FN2O4/c15-9-3-1-7(2-4-9)5-8-6-10(18)21-13-11(8)12(19)16-14(20)17-13/h1-4,6H,5H2,(H2,16,17,19,20)
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| InChIKey |
JFXXMWZQPCVBSK-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