General Information of the Compound
| Compound ID |
CP0381098
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| Compound Name |
N-[3-(3-cyano-4,6-dimethylpyridin-2-yl)oxyphenyl]-4-(trifluoromethoxy)benzenesulfonamide
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| Structure |
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| Formula |
C21H16F3N3O4S
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| Molecular Weight |
463.437
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| Canonical SMILES |
Cc1cc(C)c(C#N)c(Oc2cccc(NS(=O)(=O)c3ccc(OC(F)(F)F)cc3)c2)n1
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| InChI |
InChI=1S/C21H16F3N3O4S/c1-13-10-14(2)26-20(19(13)12-25)30-17-5-3-4-15(11-17)27-32(28,29)18-8-6-16(7-9-18)31-21(22,23)24/h3-11,27H,1-2H3
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| InChIKey |
DDNRYFFBIQGXMD-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