General Information of the Compound
Compound ID |
CP0529477
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Compound Name |
N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-2-oxo-7-propan-2-yloxy-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
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Structure |
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Formula |
C21H23F3N4O5
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Molecular Weight |
468.432
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Canonical SMILES |
COCC(NC(=O)N1CC(=O)Nc2cc(OC(C)C)cnc12)c1ccc(OC(F)(F)F)cc1
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InChI |
InChI=1S/C21H23F3N4O5/c1-12(2)32-15-8-16-19(25-9-15)28(10-18(29)26-16)20(30)27-17(11-31-3)13-4-6-14(7-5-13)33-21(22,23)24/h4-9,12,17H,10-11H2,1-3H3,(H,26,29)(H,27,30)
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InChIKey |
CSKDMDLRDNEDQP-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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