General Information of the Compound
| Compound ID |
CP0462078
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| Compound Name |
N-[2-hydroxy-2-methyl-1-[4-(trifluoromethoxy)phenyl]propyl]-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
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| Structure |
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| Formula |
C19H19F3N4O4
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| Molecular Weight |
424.379
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| Canonical SMILES |
CC(C)(O)C(NC(=O)N1CC(=O)Nc2cccnc12)c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C19H19F3N4O4/c1-18(2,29)15(11-5-7-12(8-6-11)30-19(20,21)22)25-17(28)26-10-14(27)24-13-4-3-9-23-16(13)26/h3-9,15,29H,10H2,1-2H3,(H,24,27)(H,25,28)
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| InChIKey |
MQPYMNITEROIMR-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