General Information of the Compound
| Compound ID |
CP0266507
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| Compound Name |
3-[(E)-2-(2-methoxyphenyl)sulfonylethenyl]pyridine
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| Structure |
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| Formula |
C14H13NO3S
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| Molecular Weight |
275.329
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| Canonical SMILES |
COc1ccccc1S(=O)(=O)\C=C\c1cccnc1
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| InChI |
InChI=1S/C14H13NO3S/c1-18-13-6-2-3-7-14(13)19(16,17)10-8-12-5-4-9-15-11-12/h2-11H,1H3/b10-8+
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| InChIKey |
KBVJGHRVSMYONJ-CSKARUKUSA-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