General Information of the Compound
| Compound ID |
CP0579479
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| Compound Name |
5-[2-[6-(difluoromethoxy)pyridin-3-yl]ethyl]-1,4-dihydropyrazine-2,3-dione
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| Structure |
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| Formula |
C12H11F2N3O3
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| Molecular Weight |
283.234
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| Canonical SMILES |
FC(F)Oc1ccc(CCc2c[nH]c(=O)c(=O)[nH]2)cn1
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| InChI |
InChI=1S/C12H11F2N3O3/c13-12(14)20-9-4-2-7(5-15-9)1-3-8-6-16-10(18)11(19)17-8/h2,4-6,12H,1,3H2,(H,16,18)(H,17,19)
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| InChIKey |
WJOVQHGTXKAXTJ-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