General Information of the Compound
| Compound ID |
CP0238483
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| Compound Name |
3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(1H-pyrazol-4-yl)pyridin-2-amine
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| Structure |
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| Formula |
C16H14ClFN4O
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| Molecular Weight |
332.766
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| Canonical SMILES |
CC(Oc1cc(cnc1N)-c1cn[nH]c1)c1cc(F)ccc1Cl
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| InChI |
InChI=1S/C16H14ClFN4O/c1-9(13-5-12(18)2-3-14(13)17)23-15-4-10(6-20-16(15)19)11-7-21-22-8-11/h2-9H,1H3,(H2,19,20)(H,21,22)
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| InChIKey |
VPUZUVOAKUROBZ-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: PT01659, Tyrosine-protein kinase JAK1
Protein ID: PT01214, Tyrosine-protein kinase JAK2
Protein ID: PT00892, Tyrosine-protein kinase JAK3