General Information of the Compound
| Compound ID |
CP0423520
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| Compound Name |
5-pentyl-1H-pyrano[2,3-d]pyrimidine-2,4,7-trione
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| Structure |
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| Formula |
C12H14N2O4
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| Molecular Weight |
250.254
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| Canonical SMILES |
CCCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12
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| InChI |
InChI=1S/C12H14N2O4/c1-2-3-4-5-7-6-8(15)18-11-9(7)10(16)13-12(17)14-11/h6H,2-5H2,1H3,(H2,13,14,16,17)
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| InChIKey |
AUIXOCKTXJWILY-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