General Information of the Compound
| Compound ID |
CP0924814
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| Compound Name |
4-(Pyridin-3-yl)-6-{1H-pyrrolo[2,3-b]pyridin-3-yl}quinoline
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| Structure |
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| Formula |
C21H14N4
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| Molecular Weight |
322.371
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| Canonical SMILES |
c1cncc(-c2ccnc3ccc(-c4c[nH]c5ncccc45)cc23)c1
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| InChI |
InChI=1S/C21H14N4/c1-3-15(12-22-8-1)16-7-10-23-20-6-5-14(11-18(16)20)19-13-25-21-17(19)4-2-9-24-21/h1-13H,(H,24,25)
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| InChIKey |
LTRCPJPJRDKLHD-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