General Information of the Compound
| Compound ID |
CP0415465
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| Compound Name |
9-(azetidin-3-yloxy)-1-methyl-8-(trifluoromethyl)-3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
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| Structure |
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| Formula |
C15H15F3N4O3
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| Molecular Weight |
356.304
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| Canonical SMILES |
CC1N2C(COc3cc(c(OC4CNC4)cc23)C(F)(F)F)=NNC1=O
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| InChI |
InChI=1S/C15H15F3N4O3/c1-7-14(23)21-20-13-6-24-12-2-9(15(16,17)18)11(3-10(12)22(7)13)25-8-4-19-5-8/h2-3,7-8,19H,4-6H2,1H3,(H,21,23)
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| InChIKey |
ABMRKQBDPAIZPT-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
Protein ID: PT00858, Protein kinase C alpha type
Protein ID: PT01127, Protein kinase C theta type