General Information of the Compound
| Compound ID |
CP0060269
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| Compound Name |
4-[3-[3-[(E)-2-(3-fluoropyridin-2-yl)ethenyl]sulfonylphenoxy]propyl]morpholine
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| Structure |
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| Formula |
C20H23FN2O4S
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| Molecular Weight |
406.479
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| Canonical SMILES |
Fc1cccnc1\C=C\S(=O)(=O)c1cccc(OCCCN2CCOCC2)c1
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| InChI |
InChI=1S/C20H23FN2O4S/c21-19-6-2-8-22-20(19)7-15-28(24,25)18-5-1-4-17(16-18)27-12-3-9-23-10-13-26-14-11-23/h1-2,4-8,15-16H,3,9-14H2/b15-7+
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| InChIKey |
HKXGTJAVLQOQMS-VIZOYTHASA-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