General Information of the Compound
| Compound ID |
CP0438661
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| Compound Name |
5-nitroso-6-(octylamino)-1H-pyrimidine-2,4-dione
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| Structure |
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| Formula |
C12H20N4O3
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| Molecular Weight |
268.317
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| Canonical SMILES |
CCCCCCCCNc1[nH]c(=O)[nH]c(=O)c1N=O
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| InChI |
InChI=1S/C12H20N4O3/c1-2-3-4-5-6-7-8-13-10-9(16-19)11(17)15-12(18)14-10/h2-8H2,1H3,(H3,13,14,15,17,18)
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| InChIKey |
YDRCUCXLWRJFJU-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