General Information of the Compound
| Compound ID |
CP0549090
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| Compound Name |
2-(2-pyridin-2-ylethyl)-1,2,4-triazinane-3,5,6-trione
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| Structure |
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| Formula |
C10H10N4O3
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| Molecular Weight |
234.215
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| Canonical SMILES |
Oc1nn(CCc2ccccn2)c(=O)[nH]c1=O
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| InChI |
InChI=1S/C10H10N4O3/c15-8-9(16)13-14(10(17)12-8)6-4-7-3-1-2-5-11-7/h1-3,5H,4,6H2,(H,13,16)(H,12,15,17)
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| InChIKey |
DIYWXPZODYIZLJ-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