General Information of the Compound
| Compound ID |
CP0542151
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| Compound Name |
2-(difluoromethyl)-5-(2-(3-methylcyclobutyl)ethyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione
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| Structure |
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| Formula |
C15H16F2N2O3
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| Molecular Weight |
310.3
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| Canonical SMILES |
CC1CC(CCc2cc(=O)oc3nc([nH]c(=O)c23)C(F)F)C1
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| InChI |
InChI=1S/C15H16F2N2O3/c1-7-4-8(5-7)2-3-9-6-10(20)22-15-11(9)14(21)18-13(19-15)12(16)17/h6-8,12H,2-5H2,1H3,(H,18,19,21)
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| InChIKey |
RMGXDZQEZREJNX-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