General Information of the Compound
| Compound ID |
CP0959880
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| Compound Name |
Benzo[d][1,3]dioxol-5-ylmethyl 4-(furan-3yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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| Structure |
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| Formula |
C18H16N2O6
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| Molecular Weight |
356.334
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| Canonical SMILES |
CC1=C(C(=O)OCc2ccc3c(c2)OCO3)C(c2ccoc2)NC(=O)N1
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| InChI |
InChI=1S/C18H16N2O6/c1-10-15(16(20-18(22)19-10)12-4-5-23-8-12)17(21)24-7-11-2-3-13-14(6-11)26-9-25-13/h2-6,8,16H,7,9H2,1H3,(H2,19,20,22)
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| InChIKey |
APTKIYZSANGZLZ-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