General Information of the Compound
| Compound ID |
CP0488535
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| Compound Name |
3-(6-methoxypyridin-3-yl)-5-(4-morpholin-4-ylsulfonylphenyl)pyridin-2-amine
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| Structure |
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| Formula |
C21H22N4O4S
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| Molecular Weight |
426.498
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| Canonical SMILES |
COc1ccc(cn1)-c1cc(cnc1N)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
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| InChI |
InChI=1S/C21H22N4O4S/c1-28-20-7-4-16(13-23-20)19-12-17(14-24-21(19)22)15-2-5-18(6-3-15)30(26,27)25-8-10-29-11-9-25/h2-7,12-14H,8-11H2,1H3,(H2,22,24)
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| InChIKey |
QJQHDPHQHXMLON-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