General Information of the Compound
| Compound ID |
CP0448027
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| Compound Name |
N-[3-(8-amino-6-methyl-5H-1,7-naphthyridin-6-yl)-4-fluorophenyl]-5-cyanopyridine-2-carboxamide
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| Structure |
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| Formula |
C22H17FN6O
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| Molecular Weight |
400.417
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| Canonical SMILES |
CC1(Cc2cccnc2C(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F
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| InChI |
InChI=1S/C22H17FN6O/c1-22(10-14-3-2-8-26-19(14)20(25)29-22)16-9-15(5-6-17(16)23)28-21(30)18-7-4-13(11-24)12-27-18/h2-9,12H,10H2,1H3,(H2,25,29)(H,28,30)
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| InChIKey |
QIEFQYLCHKYOIE-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