General Information of the Compound
| Compound ID |
CP0924822
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| Compound Name |
N-Methyl-3-[4-(pyridin-3-yl)quinolin-6-yl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
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| Structure |
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| Formula |
C23H17N5O
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| Molecular Weight |
379.423
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| Canonical SMILES |
CNC(=O)c1cnc2[nH]cc(-c3ccc4nccc(-c5cccnc5)c4c3)c2c1
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| InChI |
InChI=1S/C23H17N5O/c1-24-23(29)16-10-19-20(13-28-22(19)27-12-16)14-4-5-21-18(9-14)17(6-8-26-21)15-3-2-7-25-11-15/h2-13H,1H3,(H,24,29)(H,27,28)
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| InChIKey |
BKAFJYQDXGZTKS-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
Protein ID: PT01592, Dual specificity tyrosine-phosphorylation-regulated kinase 1A
Protein ID: PT01056, Dual specificity tyrosine-phosphorylation-regulated kinase 1B