General Information of the Compound
| Compound ID |
CP0553655
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| Compound Name |
N-[2-methylsulfonyl-1-[4-(trifluoromethoxy)phenyl]ethyl]-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
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| Structure |
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| Formula |
C18H17F3N4O5S
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| Molecular Weight |
458.418
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| Canonical SMILES |
CS(=O)(=O)CC(NC(=O)N1CC(=O)Nc2cccnc12)c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C18H17F3N4O5S/c1-31(28,29)10-14(11-4-6-12(7-5-11)30-18(19,20)21)24-17(27)25-9-15(26)23-13-3-2-8-22-16(13)25/h2-8,14H,9-10H2,1H3,(H,23,26)(H,24,27)
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| InChIKey |
KCKMSWQMOOGRQJ-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