General Information of the Compound
| Compound ID |
CP0115308
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| Compound Name |
2-(5-chloropyridin-3-yl)oxy-N-ethyl-5-[(4-methylsulfonylphenyl)sulfonylamino]benzamide
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| Structure |
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| Formula |
C21H20ClN3O6S2
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| Molecular Weight |
509.993
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| Canonical SMILES |
CCNC(=O)c1cc(NS(=O)(=O)c2ccc(cc2)S(C)(=O)=O)ccc1Oc1cncc(Cl)c1
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| InChI |
InChI=1S/C21H20ClN3O6S2/c1-3-24-21(26)19-11-15(4-9-20(19)31-16-10-14(22)12-23-13-16)25-33(29,30)18-7-5-17(6-8-18)32(2,27)28/h4-13,25H,3H2,1-2H3,(H,24,26)
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| InChIKey |
RONQKTMVQHLWFD-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