General Information of the Compound
| Compound ID |
CP0403716
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| Compound Name |
benzyl 2-[3-[3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-5-methyl-2,6-dioxopyrimidin-1-yl]acetate
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| Structure |
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| Formula |
C31H50N2O7Si2
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| Molecular Weight |
618.92
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| Canonical SMILES |
Cc1cn(C2OC(CO[Si](C)(C)C(C)(C)C)CC2O[Si](C)(C)C(C)(C)C)c(=O)n(CC(=O)OCc2ccccc2)c1=O
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| InChI |
InChI=1S/C31H50N2O7Si2/c1-22-18-33(29(36)32(27(22)35)19-26(34)37-20-23-15-13-12-14-16-23)28-25(40-42(10,11)31(5,6)7)17-24(39-28)21-38-41(8,9)30(2,3)4/h12-16,18,24-25,28H,17,19-21H2,1-11H3
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| InChIKey |
QSVJJFGGTNOGQD-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