General Information of the Compound
| Compound ID |
CP0891295
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| Compound Name |
5-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-N-(3,3,3-trifluoropropyl)-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C13H14F3N5O2
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| Molecular Weight |
329.282
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| Canonical SMILES |
Cc1cc(=O)[nH]c(-n2ncc(C(=O)NCCC(F)(F)F)c2C)n1
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| InChI |
InChI=1S/C13H14F3N5O2/c1-7-5-10(22)20-12(19-7)21-8(2)9(6-18-21)11(23)17-4-3-13(14,15)16/h5-6H,3-4H2,1-2H3,(H,17,23)(H,19,20,22)
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| InChIKey |
SQCXWYKNQKYKGS-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