General Information of the Compound
| Compound ID |
CP0501018
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| Compound Name |
2-(difluoromethyl)-5-methyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione
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| Structure |
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| Formula |
C9H6F2N2O3
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| Molecular Weight |
228.154
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| Canonical SMILES |
Cc1cc(=O)oc2nc([nH]c(=O)c12)C(F)F
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| InChI |
InChI=1S/C9H6F2N2O3/c1-3-2-4(14)16-9-5(3)8(15)12-7(13-9)6(10)11/h2,6H,1H3,(H,12,13,15)
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| InChIKey |
VJZAITNLLJYXEY-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