General Information of the Compound
| Compound ID |
CP0870242
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| Compound Name |
3-[8-Methoxy-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 |
C23H17N5O2
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| Molecular Weight |
395.422
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| Canonical SMILES |
COc1cc(-c2c[nH]c3ncc(C(N)=O)cc23)cc2c(-c3cccnc3)ccnc12
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| InChI |
InChI=1S/C23H17N5O2/c1-30-20-9-14(19-12-28-23-18(19)8-15(11-27-23)22(24)29)7-17-16(4-6-26-21(17)20)13-3-2-5-25-10-13/h2-12H,1H3,(H2,24,29)(H,27,28)
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| InChIKey |
ANBWKZZFNJEDBU-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