General Information of the Compound
| Compound ID |
CP0329200
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| Compound Name |
4-[6-amino-5-(4-methylsulfonylphenyl)pyridin-3-yl]phenol
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| Structure |
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| Formula |
C18H16N2O3S
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| Molecular Weight |
340.404
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)-c1cc(cnc1N)-c1ccc(O)cc1
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| InChI |
InChI=1S/C18H16N2O3S/c1-24(22,23)16-8-4-13(5-9-16)17-10-14(11-20-18(17)19)12-2-6-15(21)7-3-12/h2-11,21H,1H3,(H2,19,20)
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| InChIKey |
XFEKSSMJINNJSX-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: PT01149, Misshapen-like kinase 1
Protein ID: PT01532, Mitogen-activated protein kinase kinase kinase kinase 4
Protein ID: PT02000, TRAF2 and NCK-interacting protein kinase