General Information of the Compound
| Compound ID |
CP0431175
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| Compound Name |
[4-(1-methyl-2,4-dioxo-3-propyl-5H-pyrrolo[3,2-d]pyrimidin-6-yl)phenyl]methyl N-phenylcarbamate
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| Structure |
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| Formula |
C24H24N4O4
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| Molecular Weight |
432.48
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| Canonical SMILES |
CCCn1c(=O)n(C)c2cc([nH]c2c1=O)-c1ccc(COC(=O)Nc2ccccc2)cc1
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| InChI |
InChI=1S/C24H24N4O4/c1-3-13-28-22(29)21-20(27(2)24(28)31)14-19(26-21)17-11-9-16(10-12-17)15-32-23(30)25-18-7-5-4-6-8-18/h4-12,14,26H,3,13,15H2,1-2H3,(H,25,30)
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| InChIKey |
XHHVPDFARZOHCV-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