General Information of the Compound
| Compound ID |
CP0468577
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| Compound Name |
2-(4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)-3-fluorophenylamino)-N-o-tolylnicotinamide
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| Structure |
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| Formula |
C26H20FN5O2
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| Molecular Weight |
453.477
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| Canonical SMILES |
Cc1ccccc1NC(=O)c1cccnc1Nc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1
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| InChI |
InChI=1S/C26H20FN5O2/c1-16-5-2-3-7-21(16)32-26(33)19-6-4-12-28-25(19)31-17-8-9-23(20(27)15-17)34-22-11-14-30-24-18(22)10-13-29-24/h2-15H,1H3,(H,28,31)(H,29,30)(H,32,33)
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| InChIKey |
DRVWYCFPAIUURH-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