General Information of the Compound
| Compound ID |
CP0417019
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| Compound Name |
4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
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| Structure |
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| Formula |
C20H22N4O2S
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| Molecular Weight |
382.489
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| Canonical SMILES |
CCNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)N1CCOCC1
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| InChI |
InChI=1S/C20H22N4O2S/c1-2-22-20(25)16-12-23-19(21)15-11-17(27-18(15)16)13-3-5-14(6-4-13)24-7-9-26-10-8-24/h3-6,11-12H,2,7-10H2,1H3,(H2,21,23)(H,22,25)
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| InChIKey |
MWEYUGKSUFPEAR-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: PT01540, Non-receptor tyrosine-protein kinase TYK2
Protein ID: PT01659, Tyrosine-protein kinase JAK1
Protein ID: PT01214, Tyrosine-protein kinase JAK2
Protein ID: PT00892, Tyrosine-protein kinase JAK3