General Information of the Compound
| Compound ID |
CP0968434
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| Compound Name |
8-Chloro-6-{1H-pyrrolo[2,3-b]pyridin-3-yl}quinoline hydrochloride
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| Structure |
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| Formula |
C16H11Cl2N3
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| Molecular Weight |
316.191
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| Canonical SMILES |
Cl.Clc1cc(-c2c[nH]c3ncccc23)cc2cccnc12
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| InChI |
InChI=1S/C16H10ClN3.ClH/c17-14-8-11(7-10-3-1-5-18-15(10)14)13-9-20-16-12(13)4-2-6-19-16;/h1-9H,(H,19,20);1H
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| InChIKey |
NPBUNTQKBSLGMM-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