General Information of the Compound
| Compound ID |
CP0436509
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| Compound Name |
5-Methyl-1-(6-methyl-pyridin-2-yl)-[1,2,4]triazinan-3-one
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| Structure |
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| Formula |
C10H14N4O
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| Molecular Weight |
206.249
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| Canonical SMILES |
CC1CN(NC(=O)N1)c1cccc(C)n1
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| InChI |
InChI=1S/C10H14N4O/c1-7-4-3-5-9(11-7)14-6-8(2)12-10(15)13-14/h3-5,8H,6H2,1-2H3,(H2,12,13,15)
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| InChIKey |
VGSWWJUIJHMRJS-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