General Information of the Compound
| Compound ID |
CP0260505
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| Compound Name |
N-[(5-ethylsulfonylpyridin-2-yl)methyl]-2-(oxan-4-yl)-4-oxo-2,3-dihydrochromene-6-sulfonamide
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| Structure |
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| Formula |
C22H26N2O7S2
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| Molecular Weight |
494.591
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| Canonical SMILES |
CCS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc3OC(CC(=O)c3c2)C2CCOCC2)nc1
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| InChI |
InChI=1S/C22H26N2O7S2/c1-2-32(26,27)18-4-3-16(23-14-18)13-24-33(28,29)17-5-6-21-19(11-17)20(25)12-22(31-21)15-7-9-30-10-8-15/h3-6,11,14-15,22,24H,2,7-10,12-13H2,1H3
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| InChIKey |
WKNURWRUFSQWDD-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