General Information of the Compound
| Compound ID |
CP0468888
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| Compound Name |
4-[6-(dimethylamino)-5-(4-methylsulfonylphenyl)pyridin-3-yl]phenol
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| Structure |
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| Formula |
C20H20N2O3S
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| Molecular Weight |
368.458
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| Canonical SMILES |
CN(C)c1ncc(cc1-c1ccc(cc1)S(C)(=O)=O)-c1ccc(O)cc1
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| InChI |
InChI=1S/C20H20N2O3S/c1-22(2)20-19(15-6-10-18(11-7-15)26(3,24)25)12-16(13-21-20)14-4-8-17(23)9-5-14/h4-13,23H,1-3H3
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| InChIKey |
JUSSLCLDOMYWPZ-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